USER MOD reduce.3.24.130724 H: found=0, std=0, add=875, rem=0, adj=23 USER MOD reduce.3.24.130724 removed 872 hydrogens (29 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 36 HIS : no HD1:sc= -1.23 X(o=-0.84,f=-0.45) USER MOD Set 1.2: A 50 SER OG : rot 16:sc= 0.4! USER MOD Set 2.1: A 10 THR OG1 : rot -82:sc= 1 USER MOD Set 2.2: A 12 SER OG : rot 180:sc= 0 USER MOD Single : A 1 GLY N :NH3+ -116:sc= 0.0823 (180deg=0) USER MOD Single : A 4 SER OG : rot -51:sc= 0.219 USER MOD Single : A 5 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 6 THR OG1 : rot 180:sc= -0.0398 USER MOD Single : A 9 THR OG1 : rot 180:sc= -0.671 USER MOD Single : A 15 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 16 TYR OH : rot 180:sc= 0 USER MOD Single : A 20 THR OG1 : rot -30:sc= 0.373 USER MOD Single : A 23 SER OG : rot 180:sc= 0 USER MOD Single : A 31 GLN : amide:sc= -1.13 K(o=-1.1,f=-8.8!) USER MOD Single : A 32 THR OG1 : rot 180:sc= -1.05 USER MOD Single : A 34 SER OG : rot 180:sc= -0.0523 USER MOD Single : A 37 TYR OH : rot 180:sc= 0 USER MOD Single : A 38 THR OG1 : rot 158:sc= 0.604 USER MOD Single : A 42 THR OG1 : rot 180:sc= 0 USER MOD Single : A 45 GLN : amide:sc= -1.54 K(o=-1.5,f=-3.2!) USER MOD Single : A 46 LYS NZ :NH3+ 140:sc= -0.233 (180deg=-1.72!) USER MOD Single : A 49 SER OG : rot 180:sc= 0 USER MOD Single : A 51 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 54 ASN : amide:sc= -0.86 K(o=-0.86,f=-2.1!) USER MOD Single : A 65 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 68 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 75 GLN : amide:sc= -2.71 K(o=-2.7,f=-7.9!) USER MOD Single : A 77 MET CE :methyl -167:sc= -11.7! (180deg=-12.3!) USER MOD Single : A 78 LYS NZ :NH3+ 160:sc= -0.0317 (180deg=-0.301) USER MOD Single : A 86 THR OG1 : rot 172:sc= -0.729 USER MOD Single : A 90 GLN : amide:sc= 0 X(o=0,f=-0.006) USER MOD Single : A 93 TYR OH : rot -50:sc= -0.772 USER MOD Single : A 105 ASN : amide:sc= -0.0894 K(o=-0.089,f=-2.9!) USER MOD Single : A 107 THR OG1 : rot 180:sc= 0 USER MOD Single : A 130 JZF OH : rot -170:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 1 6.637 -4.677 22.195 1.00 0.00 N ATOM 2 CA GLY A 1 6.824 -3.725 21.117 1.00 0.00 C ATOM 3 C GLY A 1 5.548 -2.985 20.769 1.00 0.00 C ATOM 4 O GLY A 1 4.459 -3.333 21.227 1.00 0.00 O ATOM 0 H1 GLY A 1 7.209 -4.390 23.015 1.00 0.00 H new ATOM 0 H2 GLY A 1 5.633 -4.703 22.465 1.00 0.00 H new ATOM 0 H3 GLY A 1 6.935 -5.622 21.879 1.00 0.00 H new ATOM 0 HA2 GLY A 1 7.592 -3.005 21.401 1.00 0.00 H new ATOM 0 HA3 GLY A 1 7.189 -4.248 20.233 1.00 0.00 H new ATOM 8 N PRO A 2 5.674 -1.937 19.941 1.00 0.00 N ATOM 9 CA PRO A 2 4.531 -1.124 19.515 1.00 0.00 C ATOM 10 C PRO A 2 3.600 -1.880 18.574 1.00 0.00 C ATOM 11 O PRO A 2 2.381 -1.729 18.637 1.00 0.00 O ATOM 12 CB PRO A 2 5.185 0.053 18.787 1.00 0.00 C ATOM 13 CG PRO A 2 6.497 -0.473 18.318 1.00 0.00 C ATOM 14 CD PRO A 2 6.941 -1.466 19.357 1.00 0.00 C ATOM 0 HA PRO A 2 3.905 -0.828 20.357 1.00 0.00 H new ATOM 0 HB2 PRO A 2 4.572 0.391 17.951 1.00 0.00 H new ATOM 0 HB3 PRO A 2 5.316 0.907 19.452 1.00 0.00 H new ATOM 0 HG2 PRO A 2 6.401 -0.947 17.341 1.00 0.00 H new ATOM 0 HG3 PRO A 2 7.224 0.332 18.211 1.00 0.00 H new ATOM 0 HD2 PRO A 2 7.508 -2.285 18.914 1.00 0.00 H new ATOM 0 HD3 PRO A 2 7.582 -1.003 20.107 1.00 0.00 H new ATOM 22 N GLY A 3 4.183 -2.697 17.701 1.00 0.00 N ATOM 23 CA GLY A 3 3.390 -3.465 16.759 1.00 0.00 C ATOM 24 C GLY A 3 4.243 -4.334 15.857 1.00 0.00 C ATOM 25 O GLY A 3 4.573 -5.467 16.206 1.00 0.00 O ATOM 0 H GLY A 3 5.190 -2.840 17.630 1.00 0.00 H new ATOM 0 HA2 GLY A 3 2.689 -4.094 17.307 1.00 0.00 H new ATOM 0 HA3 GLY A 3 2.797 -2.784 16.148 1.00 0.00 H new ATOM 29 N SER A 4 4.599 -3.803 14.691 1.00 0.00 N ATOM 30 CA SER A 4 5.415 -4.541 13.733 1.00 0.00 C ATOM 31 C SER A 4 4.791 -5.897 13.419 1.00 0.00 C ATOM 32 O SER A 4 5.491 -6.852 13.085 1.00 0.00 O ATOM 33 CB SER A 4 6.831 -4.732 14.278 1.00 0.00 C ATOM 34 OG SER A 4 7.729 -5.102 13.245 1.00 0.00 O ATOM 0 H SER A 4 4.336 -2.866 14.387 1.00 0.00 H new ATOM 0 HA SER A 4 5.463 -3.961 12.811 1.00 0.00 H new ATOM 0 HB2 SER A 4 7.171 -3.809 14.747 1.00 0.00 H new ATOM 0 HB3 SER A 4 6.826 -5.499 15.052 1.00 0.00 H new ATOM 0 HG SER A 4 7.358 -5.858 12.744 1.00 0.00 H new ATOM 40 N MET A 5 3.468 -5.973 13.530 1.00 0.00 N ATOM 41 CA MET A 5 2.749 -7.211 13.257 1.00 0.00 C ATOM 42 C MET A 5 2.762 -7.530 11.765 1.00 0.00 C ATOM 43 O MET A 5 3.000 -6.653 10.934 1.00 0.00 O ATOM 44 CB MET A 5 1.306 -7.109 13.756 1.00 0.00 C ATOM 45 CG MET A 5 1.197 -6.798 15.240 1.00 0.00 C ATOM 46 SD MET A 5 1.919 -8.087 16.274 1.00 0.00 S ATOM 47 CE MET A 5 1.488 -7.492 17.907 1.00 0.00 C ATOM 0 H MET A 5 2.873 -5.192 13.807 1.00 0.00 H new ATOM 0 HA MET A 5 3.253 -8.019 13.788 1.00 0.00 H new ATOM 0 HB2 MET A 5 0.789 -6.333 13.192 1.00 0.00 H new ATOM 0 HB3 MET A 5 0.792 -8.048 13.551 1.00 0.00 H new ATOM 0 HG2 MET A 5 1.695 -5.851 15.446 1.00 0.00 H new ATOM 0 HG3 MET A 5 0.147 -6.671 15.505 1.00 0.00 H new ATOM 0 HE1 MET A 5 1.867 -8.185 18.658 1.00 0.00 H new ATOM 0 HE2 MET A 5 1.930 -6.508 18.064 1.00 0.00 H new ATOM 0 HE3 MET A 5 0.404 -7.420 17.994 1.00 0.00 H new ATOM 57 N THR A 6 2.504 -8.791 11.431 1.00 0.00 N ATOM 58 CA THR A 6 2.488 -9.225 10.040 1.00 0.00 C ATOM 59 C THR A 6 1.117 -9.766 9.649 1.00 0.00 C ATOM 60 O THR A 6 0.334 -10.178 10.505 1.00 0.00 O ATOM 61 CB THR A 6 3.549 -10.310 9.778 1.00 0.00 C ATOM 62 OG1 THR A 6 3.556 -10.664 8.390 1.00 0.00 O ATOM 63 CG2 THR A 6 3.278 -11.548 10.620 1.00 0.00 C ATOM 0 H THR A 6 2.303 -9.529 12.105 1.00 0.00 H new ATOM 0 HA THR A 6 2.717 -8.349 9.433 1.00 0.00 H new ATOM 0 HB THR A 6 4.523 -9.907 10.055 1.00 0.00 H new ATOM 0 HG1 THR A 6 4.235 -11.353 8.232 1.00 0.00 H new ATOM 0 HG21 THR A 6 4.041 -12.300 10.417 1.00 0.00 H new ATOM 0 HG22 THR A 6 3.303 -11.282 11.677 1.00 0.00 H new ATOM 0 HG23 THR A 6 2.296 -11.950 10.370 1.00 0.00 H new ATOM 71 N VAL A 7 0.833 -9.764 8.350 1.00 0.00 N ATOM 72 CA VAL A 7 -0.443 -10.256 7.846 1.00 0.00 C ATOM 73 C VAL A 7 -0.445 -11.778 7.748 1.00 0.00 C ATOM 74 O VAL A 7 0.096 -12.351 6.803 1.00 0.00 O ATOM 75 CB VAL A 7 -0.765 -9.664 6.461 1.00 0.00 C ATOM 76 CG1 VAL A 7 -2.091 -10.201 5.946 1.00 0.00 C ATOM 77 CG2 VAL A 7 -0.784 -8.144 6.524 1.00 0.00 C ATOM 0 H VAL A 7 1.470 -9.427 7.628 1.00 0.00 H new ATOM 0 HA VAL A 7 -1.207 -9.939 8.556 1.00 0.00 H new ATOM 0 HB VAL A 7 0.017 -9.967 5.764 1.00 0.00 H new ATOM 0 HG11 VAL A 7 -2.302 -9.772 4.967 1.00 0.00 H new ATOM 0 HG12 VAL A 7 -2.036 -11.286 5.862 1.00 0.00 H new ATOM 0 HG13 VAL A 7 -2.887 -9.930 6.640 1.00 0.00 H new ATOM 0 HG21 VAL A 7 -1.013 -7.742 5.537 1.00 0.00 H new ATOM 0 HG22 VAL A 7 -1.545 -7.819 7.234 1.00 0.00 H new ATOM 0 HG23 VAL A 7 0.192 -7.781 6.846 1.00 0.00 H new ATOM 87 N VAL A 8 -1.058 -12.427 8.733 1.00 0.00 N ATOM 88 CA VAL A 8 -1.132 -13.883 8.758 1.00 0.00 C ATOM 89 C VAL A 8 -2.142 -14.399 7.739 1.00 0.00 C ATOM 90 O VAL A 8 -3.204 -13.806 7.544 1.00 0.00 O ATOM 91 CB VAL A 8 -1.519 -14.401 10.156 1.00 0.00 C ATOM 92 CG1 VAL A 8 -1.614 -15.920 10.155 1.00 0.00 C ATOM 93 CG2 VAL A 8 -0.519 -13.922 11.197 1.00 0.00 C ATOM 0 H VAL A 8 -1.510 -11.968 9.524 1.00 0.00 H new ATOM 0 HA VAL A 8 -0.140 -14.255 8.503 1.00 0.00 H new ATOM 0 HB VAL A 8 -2.499 -14.000 10.415 1.00 0.00 H new ATOM 0 HG11 VAL A 8 -1.888 -16.268 11.151 1.00 0.00 H new ATOM 0 HG12 VAL A 8 -2.372 -16.237 9.438 1.00 0.00 H new ATOM 0 HG13 VAL A 8 -0.650 -16.345 9.875 1.00 0.00 H new ATOM 0 HG21 VAL A 8 -0.808 -14.297 12.179 1.00 0.00 H new ATOM 0 HG22 VAL A 8 0.475 -14.293 10.945 1.00 0.00 H new ATOM 0 HG23 VAL A 8 -0.506 -12.832 11.215 1.00 0.00 H new ATOM 103 N THR A 9 -1.806 -15.510 7.091 1.00 0.00 N ATOM 104 CA THR A 9 -2.683 -16.107 6.091 1.00 0.00 C ATOM 105 C THR A 9 -3.178 -17.476 6.542 1.00 0.00 C ATOM 106 O THR A 9 -2.579 -18.111 7.411 1.00 0.00 O ATOM 107 CB THR A 9 -1.970 -16.253 4.734 1.00 0.00 C ATOM 108 OG1 THR A 9 -1.181 -15.088 4.467 1.00 0.00 O ATOM 109 CG2 THR A 9 -2.978 -16.456 3.612 1.00 0.00 C ATOM 0 H THR A 9 -0.932 -16.015 7.241 1.00 0.00 H new ATOM 0 HA THR A 9 -3.534 -15.436 5.975 1.00 0.00 H new ATOM 0 HB THR A 9 -1.322 -17.128 4.782 1.00 0.00 H new ATOM 0 HG1 THR A 9 -0.730 -15.190 3.603 1.00 0.00 H new ATOM 0 HG21 THR A 9 -2.451 -16.557 2.663 1.00 0.00 H new ATOM 0 HG22 THR A 9 -3.558 -17.359 3.803 1.00 0.00 H new ATOM 0 HG23 THR A 9 -3.648 -15.598 3.565 1.00 0.00 H new ATOM 117 N THR A 10 -4.277 -17.929 5.945 1.00 0.00 N ATOM 118 CA THR A 10 -4.854 -19.223 6.286 1.00 0.00 C ATOM 119 C THR A 10 -4.672 -20.222 5.149 1.00 0.00 C ATOM 120 O THR A 10 -4.021 -19.925 4.148 1.00 0.00 O ATOM 121 CB THR A 10 -6.354 -19.101 6.612 1.00 0.00 C ATOM 122 OG1 THR A 10 -7.071 -18.649 5.458 1.00 0.00 O ATOM 123 CG2 THR A 10 -6.581 -18.136 7.766 1.00 0.00 C ATOM 0 H THR A 10 -4.785 -17.418 5.223 1.00 0.00 H new ATOM 0 HA THR A 10 -4.326 -19.582 7.170 1.00 0.00 H new ATOM 0 HB THR A 10 -6.720 -20.085 6.905 1.00 0.00 H new ATOM 0 HG1 THR A 10 -6.993 -17.675 5.385 1.00 0.00 H new ATOM 0 HG21 THR A 10 -7.648 -18.067 7.978 1.00 0.00 H new ATOM 0 HG22 THR A 10 -6.058 -18.498 8.651 1.00 0.00 H new ATOM 0 HG23 THR A 10 -6.200 -17.151 7.497 1.00 0.00 H new ATOM 131 N GLU A 11 -5.251 -21.408 5.311 1.00 0.00 N ATOM 132 CA GLU A 11 -5.151 -22.451 4.297 1.00 0.00 C ATOM 133 C GLU A 11 -6.060 -22.144 3.109 1.00 0.00 C ATOM 134 O GLU A 11 -5.805 -22.586 1.989 1.00 0.00 O ATOM 135 CB GLU A 11 -5.517 -23.811 4.894 1.00 0.00 C ATOM 136 CG GLU A 11 -4.538 -24.295 5.951 1.00 0.00 C ATOM 137 CD GLU A 11 -4.994 -25.573 6.627 1.00 0.00 C ATOM 138 OE1 GLU A 11 -5.883 -25.497 7.501 1.00 0.00 O ATOM 139 OE2 GLU A 11 -4.463 -26.649 6.282 1.00 0.00 O ATOM 0 H GLU A 11 -5.794 -21.670 6.134 1.00 0.00 H new ATOM 0 HA GLU A 11 -4.120 -22.482 3.946 1.00 0.00 H new ATOM 0 HB2 GLU A 11 -6.512 -23.749 5.334 1.00 0.00 H new ATOM 0 HB3 GLU A 11 -5.568 -24.548 4.093 1.00 0.00 H new ATOM 0 HG2 GLU A 11 -3.564 -24.460 5.490 1.00 0.00 H new ATOM 0 HG3 GLU A 11 -4.407 -23.517 6.703 1.00 0.00 H new ATOM 146 N SER A 12 -7.120 -21.383 3.364 1.00 0.00 N ATOM 147 CA SER A 12 -8.069 -21.020 2.318 1.00 0.00 C ATOM 148 C SER A 12 -7.616 -19.760 1.588 1.00 0.00 C ATOM 149 O SER A 12 -7.957 -19.546 0.425 1.00 0.00 O ATOM 150 CB SER A 12 -9.461 -20.805 2.916 1.00 0.00 C ATOM 151 OG SER A 12 -9.618 -19.474 3.376 1.00 0.00 O ATOM 0 H SER A 12 -7.343 -21.006 4.285 1.00 0.00 H new ATOM 0 HA SER A 12 -8.113 -21.839 1.600 1.00 0.00 H new ATOM 0 HB2 SER A 12 -10.221 -21.026 2.166 1.00 0.00 H new ATOM 0 HB3 SER A 12 -9.617 -21.499 3.742 1.00 0.00 H new ATOM 0 HG SER A 12 -10.516 -19.362 3.752 1.00 0.00 H new ATOM 157 N GLY A 13 -6.845 -18.927 2.280 1.00 0.00 N ATOM 158 CA GLY A 13 -6.357 -17.697 1.682 1.00 0.00 C ATOM 159 C GLY A 13 -6.647 -16.481 2.539 1.00 0.00 C ATOM 160 O GLY A 13 -5.850 -15.543 2.589 1.00 0.00 O ATOM 0 H GLY A 13 -6.549 -19.081 3.244 1.00 0.00 H new ATOM 0 HA2 GLY A 13 -5.282 -17.776 1.521 1.00 0.00 H new ATOM 0 HA3 GLY A 13 -6.817 -17.565 0.703 1.00 0.00 H new ATOM 164 N LEU A 14 -7.791 -16.495 3.215 1.00 0.00 N ATOM 165 CA LEU A 14 -8.185 -15.384 4.074 1.00 0.00 C ATOM 166 C LEU A 14 -7.074 -15.036 5.059 1.00 0.00 C ATOM 167 O LEU A 14 -6.527 -15.912 5.730 1.00 0.00 O ATOM 168 CB LEU A 14 -9.466 -15.730 4.834 1.00 0.00 C ATOM 169 CG LEU A 14 -10.105 -14.590 5.628 1.00 0.00 C ATOM 170 CD1 LEU A 14 -11.193 -13.913 4.809 1.00 0.00 C ATOM 171 CD2 LEU A 14 -10.670 -15.107 6.943 1.00 0.00 C ATOM 0 H LEU A 14 -8.461 -17.263 3.185 1.00 0.00 H new ATOM 0 HA LEU A 14 -8.369 -14.516 3.441 1.00 0.00 H new ATOM 0 HB2 LEU A 14 -10.199 -16.103 4.119 1.00 0.00 H new ATOM 0 HB3 LEU A 14 -9.247 -16.547 5.522 1.00 0.00 H new ATOM 0 HG LEU A 14 -9.334 -13.852 5.851 1.00 0.00 H new ATOM 0 HD11 LEU A 14 -11.636 -13.105 5.390 1.00 0.00 H new ATOM 0 HD12 LEU A 14 -10.761 -13.507 3.894 1.00 0.00 H new ATOM 0 HD13 LEU A 14 -11.963 -14.641 4.554 1.00 0.00 H new ATOM 0 HD21 LEU A 14 -11.121 -14.282 7.495 1.00 0.00 H new ATOM 0 HD22 LEU A 14 -11.427 -15.865 6.741 1.00 0.00 H new ATOM 0 HD23 LEU A 14 -9.868 -15.545 7.537 1.00 0.00 H new ATOM 183 N LYS A 15 -6.745 -13.751 5.144 1.00 0.00 N ATOM 184 CA LYS A 15 -5.702 -13.286 6.050 1.00 0.00 C ATOM 185 C LYS A 15 -6.294 -12.438 7.171 1.00 0.00 C ATOM 186 O LYS A 15 -7.420 -11.951 7.066 1.00 0.00 O ATOM 187 CB LYS A 15 -4.656 -12.475 5.281 1.00 0.00 C ATOM 188 CG LYS A 15 -3.739 -13.327 4.420 1.00 0.00 C ATOM 189 CD LYS A 15 -3.110 -12.513 3.302 1.00 0.00 C ATOM 190 CE LYS A 15 -2.879 -13.358 2.059 1.00 0.00 C ATOM 191 NZ LYS A 15 -2.912 -12.538 0.816 1.00 0.00 N ATOM 0 H LYS A 15 -7.186 -13.013 4.596 1.00 0.00 H new ATOM 0 HA LYS A 15 -5.223 -14.159 6.493 1.00 0.00 H new ATOM 0 HB2 LYS A 15 -5.165 -11.749 4.647 1.00 0.00 H new ATOM 0 HB3 LYS A 15 -4.052 -11.910 5.991 1.00 0.00 H new ATOM 0 HG2 LYS A 15 -2.955 -13.761 5.041 1.00 0.00 H new ATOM 0 HG3 LYS A 15 -4.304 -14.156 3.994 1.00 0.00 H new ATOM 0 HD2 LYS A 15 -3.757 -11.671 3.056 1.00 0.00 H new ATOM 0 HD3 LYS A 15 -2.161 -12.098 3.642 1.00 0.00 H new ATOM 0 HE2 LYS A 15 -1.915 -13.862 2.136 1.00 0.00 H new ATOM 0 HE3 LYS A 15 -3.641 -14.135 2.002 1.00 0.00 H new ATOM 0 HZ1 LYS A 15 -2.750 -13.151 -0.009 1.00 0.00 H new ATOM 0 HZ2 LYS A 15 -3.840 -12.077 0.729 1.00 0.00 H new ATOM 0 HZ3 LYS A 15 -2.168 -11.812 0.859 1.00 0.00 H new ATOM 205 N TYR A 16 -5.528 -12.265 8.243 1.00 0.00 N ATOM 206 CA TYR A 16 -5.978 -11.477 9.384 1.00 0.00 C ATOM 207 C TYR A 16 -4.801 -10.783 10.064 1.00 0.00 C ATOM 208 O TYR A 16 -3.759 -11.394 10.299 1.00 0.00 O ATOM 209 CB TYR A 16 -6.709 -12.368 10.390 1.00 0.00 C ATOM 210 CG TYR A 16 -5.788 -13.261 11.189 1.00 0.00 C ATOM 211 CD1 TYR A 16 -5.354 -14.479 10.680 1.00 0.00 C ATOM 212 CD2 TYR A 16 -5.351 -12.887 12.454 1.00 0.00 C ATOM 213 CE1 TYR A 16 -4.513 -15.299 11.408 1.00 0.00 C ATOM 214 CE2 TYR A 16 -4.509 -13.700 13.188 1.00 0.00 C ATOM 215 CZ TYR A 16 -4.093 -14.905 12.661 1.00 0.00 C ATOM 216 OH TYR A 16 -3.254 -15.718 13.388 1.00 0.00 O ATOM 0 H TYR A 16 -4.593 -12.660 8.345 1.00 0.00 H new ATOM 0 HA TYR A 16 -6.665 -10.714 9.018 1.00 0.00 H new ATOM 0 HB2 TYR A 16 -7.276 -11.738 11.076 1.00 0.00 H new ATOM 0 HB3 TYR A 16 -7.430 -12.988 9.857 1.00 0.00 H new ATOM 0 HD1 TYR A 16 -5.680 -14.790 9.698 1.00 0.00 H new ATOM 0 HD2 TYR A 16 -5.675 -11.945 12.870 1.00 0.00 H new ATOM 0 HE1 TYR A 16 -4.186 -16.243 10.998 1.00 0.00 H new ATOM 0 HE2 TYR A 16 -4.178 -13.394 14.169 1.00 0.00 H new ATOM 0 HH TYR A 16 -3.052 -15.294 14.248 1.00 0.00 H new ATOM 226 N GLU A 17 -4.978 -9.504 10.378 1.00 0.00 N ATOM 227 CA GLU A 17 -3.931 -8.726 11.030 1.00 0.00 C ATOM 228 C GLU A 17 -4.491 -7.951 12.220 1.00 0.00 C ATOM 229 O GLU A 17 -5.371 -7.104 12.065 1.00 0.00 O ATOM 230 CB GLU A 17 -3.288 -7.759 10.035 1.00 0.00 C ATOM 231 CG GLU A 17 -1.809 -7.518 10.289 1.00 0.00 C ATOM 232 CD GLU A 17 -1.560 -6.640 11.499 1.00 0.00 C ATOM 233 OE1 GLU A 17 -1.542 -5.401 11.339 1.00 0.00 O ATOM 234 OE2 GLU A 17 -1.383 -7.190 12.606 1.00 0.00 O ATOM 0 H GLU A 17 -5.836 -8.985 10.192 1.00 0.00 H new ATOM 0 HA GLU A 17 -3.172 -9.419 11.394 1.00 0.00 H new ATOM 0 HB2 GLU A 17 -3.416 -8.151 9.026 1.00 0.00 H new ATOM 0 HB3 GLU A 17 -3.815 -6.806 10.075 1.00 0.00 H new ATOM 0 HG2 GLU A 17 -1.308 -8.476 10.430 1.00 0.00 H new ATOM 0 HG3 GLU A 17 -1.364 -7.052 9.409 1.00 0.00 H new ATOM 241 N ASP A 18 -3.975 -8.249 13.408 1.00 0.00 N ATOM 242 CA ASP A 18 -4.422 -7.581 14.624 1.00 0.00 C ATOM 243 C ASP A 18 -4.155 -6.081 14.550 1.00 0.00 C ATOM 244 O ASP A 18 -3.078 -5.651 14.134 1.00 0.00 O ATOM 245 CB ASP A 18 -3.720 -8.177 15.846 1.00 0.00 C ATOM 246 CG ASP A 18 -4.352 -7.732 17.150 1.00 0.00 C ATOM 247 OD1 ASP A 18 -5.430 -7.103 17.104 1.00 0.00 O ATOM 248 OD2 ASP A 18 -3.768 -8.014 18.218 1.00 0.00 O ATOM 0 H ASP A 18 -3.247 -8.949 13.554 1.00 0.00 H new ATOM 0 HA ASP A 18 -5.497 -7.736 14.720 1.00 0.00 H new ATOM 0 HB2 ASP A 18 -3.749 -9.265 15.784 1.00 0.00 H new ATOM 0 HB3 ASP A 18 -2.670 -7.885 15.836 1.00 0.00 H new ATOM 253 N LEU A 19 -5.141 -5.289 14.956 1.00 0.00 N ATOM 254 CA LEU A 19 -5.013 -3.836 14.935 1.00 0.00 C ATOM 255 C LEU A 19 -5.154 -3.256 16.339 1.00 0.00 C ATOM 256 O LEU A 19 -4.460 -2.306 16.703 1.00 0.00 O ATOM 257 CB LEU A 19 -6.068 -3.225 14.010 1.00 0.00 C ATOM 258 CG LEU A 19 -5.640 -2.999 12.560 1.00 0.00 C ATOM 259 CD1 LEU A 19 -6.795 -2.443 11.742 1.00 0.00 C ATOM 260 CD2 LEU A 19 -4.441 -2.064 12.497 1.00 0.00 C ATOM 0 H LEU A 19 -6.038 -5.628 15.304 1.00 0.00 H new ATOM 0 HA LEU A 19 -4.021 -3.589 14.558 1.00 0.00 H new ATOM 0 HB2 LEU A 19 -6.944 -3.874 14.012 1.00 0.00 H new ATOM 0 HB3 LEU A 19 -6.379 -2.268 14.429 1.00 0.00 H new ATOM 0 HG LEU A 19 -5.350 -3.959 12.134 1.00 0.00 H new ATOM 0 HD11 LEU A 19 -6.471 -2.289 10.713 1.00 0.00 H new ATOM 0 HD12 LEU A 19 -7.626 -3.149 11.759 1.00 0.00 H new ATOM 0 HD13 LEU A 19 -7.118 -1.493 12.167 1.00 0.00 H new ATOM 0 HD21 LEU A 19 -4.150 -1.915 11.457 1.00 0.00 H new ATOM 0 HD22 LEU A 19 -4.704 -1.104 12.942 1.00 0.00 H new ATOM 0 HD23 LEU A 19 -3.608 -2.502 13.047 1.00 0.00 H new ATOM 272 N THR A 20 -6.056 -3.835 17.125 1.00 0.00 N ATOM 273 CA THR A 20 -6.287 -3.377 18.489 1.00 0.00 C ATOM 274 C THR A 20 -6.992 -4.447 19.316 1.00 0.00 C ATOM 275 O THR A 20 -8.085 -4.892 18.968 1.00 0.00 O ATOM 276 CB THR A 20 -7.129 -2.088 18.514 1.00 0.00 C ATOM 277 OG1 THR A 20 -6.617 -1.150 17.561 1.00 0.00 O ATOM 278 CG2 THR A 20 -7.123 -1.464 19.901 1.00 0.00 C ATOM 0 H THR A 20 -6.639 -4.622 16.840 1.00 0.00 H new ATOM 0 HA THR A 20 -5.309 -3.171 18.923 1.00 0.00 H new ATOM 0 HB THR A 20 -8.156 -2.346 18.254 1.00 0.00 H new ATOM 0 HG1 THR A 20 -5.651 -1.281 17.459 1.00 0.00 H new ATOM 0 HG21 THR A 20 -7.724 -0.555 19.894 1.00 0.00 H new ATOM 0 HG22 THR A 20 -7.541 -2.170 20.619 1.00 0.00 H new ATOM 0 HG23 THR A 20 -6.100 -1.220 20.186 1.00 0.00 H new ATOM 286 N GLU A 21 -6.360 -4.854 20.412 1.00 0.00 N ATOM 287 CA GLU A 21 -6.928 -5.872 21.288 1.00 0.00 C ATOM 288 C GLU A 21 -8.352 -5.505 21.695 1.00 0.00 C ATOM 289 O GLU A 21 -8.789 -4.370 21.513 1.00 0.00 O ATOM 290 CB GLU A 21 -6.058 -6.047 22.534 1.00 0.00 C ATOM 291 CG GLU A 21 -6.187 -7.417 23.178 1.00 0.00 C ATOM 292 CD GLU A 21 -4.957 -7.805 23.976 1.00 0.00 C ATOM 293 OE1 GLU A 21 -3.835 -7.497 23.521 1.00 0.00 O ATOM 294 OE2 GLU A 21 -5.115 -8.416 25.053 1.00 0.00 O ATOM 0 H GLU A 21 -5.455 -4.495 20.715 1.00 0.00 H new ATOM 0 HA GLU A 21 -6.957 -6.813 20.739 1.00 0.00 H new ATOM 0 HB2 GLU A 21 -5.015 -5.878 22.266 1.00 0.00 H new ATOM 0 HB3 GLU A 21 -6.327 -5.284 23.265 1.00 0.00 H new ATOM 0 HG2 GLU A 21 -7.058 -7.426 23.833 1.00 0.00 H new ATOM 0 HG3 GLU A 21 -6.363 -8.163 22.403 1.00 0.00 H new ATOM 301 N GLY A 22 -9.072 -6.477 22.247 1.00 0.00 N ATOM 302 CA GLY A 22 -10.439 -6.239 22.671 1.00 0.00 C ATOM 303 C GLY A 22 -10.720 -6.786 24.057 1.00 0.00 C ATOM 304 O GLY A 22 -11.231 -6.074 24.921 1.00 0.00 O ATOM 0 H GLY A 22 -8.733 -7.425 22.408 1.00 0.00 H new ATOM 0 HA2 GLY A 22 -10.638 -5.167 22.659 1.00 0.00 H new ATOM 0 HA3 GLY A 22 -11.123 -6.698 21.957 1.00 0.00 H new ATOM 308 N SER A 23 -10.388 -8.056 24.268 1.00 0.00 N ATOM 309 CA SER A 23 -10.614 -8.700 25.557 1.00 0.00 C ATOM 310 C SER A 23 -12.101 -8.734 25.895 1.00 0.00 C ATOM 311 O SER A 23 -12.517 -8.290 26.964 1.00 0.00 O ATOM 312 CB SER A 23 -9.846 -7.967 26.659 1.00 0.00 C ATOM 313 OG SER A 23 -8.580 -7.531 26.194 1.00 0.00 O ATOM 0 H SER A 23 -9.962 -8.659 23.564 1.00 0.00 H new ATOM 0 HA SER A 23 -10.251 -9.726 25.491 1.00 0.00 H new ATOM 0 HB2 SER A 23 -10.426 -7.110 27.003 1.00 0.00 H new ATOM 0 HB3 SER A 23 -9.715 -8.627 27.516 1.00 0.00 H new ATOM 0 HG SER A 23 -8.109 -7.064 26.916 1.00 0.00 H new ATOM 319 N GLY A 24 -12.899 -9.265 24.973 1.00 0.00 N ATOM 320 CA GLY A 24 -14.331 -9.348 25.190 1.00 0.00 C ATOM 321 C GLY A 24 -14.893 -10.712 24.839 1.00 0.00 C ATOM 322 O GLY A 24 -14.163 -11.702 24.806 1.00 0.00 O ATOM 0 H GLY A 24 -12.579 -9.639 24.080 1.00 0.00 H new ATOM 0 HA2 GLY A 24 -14.551 -9.126 26.234 1.00 0.00 H new ATOM 0 HA3 GLY A 24 -14.831 -8.587 24.590 1.00 0.00 H new ATOM 326 N ALA A 25 -16.195 -10.764 24.577 1.00 0.00 N ATOM 327 CA ALA A 25 -16.854 -12.016 24.226 1.00 0.00 C ATOM 328 C ALA A 25 -16.844 -12.237 22.717 1.00 0.00 C ATOM 329 O ALA A 25 -16.976 -11.292 21.941 1.00 0.00 O ATOM 330 CB ALA A 25 -18.281 -12.027 24.753 1.00 0.00 C ATOM 0 H ALA A 25 -16.814 -9.954 24.601 1.00 0.00 H new ATOM 0 HA ALA A 25 -16.300 -12.832 24.690 1.00 0.00 H new ATOM 0 HB1 ALA A 25 -18.761 -12.968 24.484 1.00 0.00 H new ATOM 0 HB2 ALA A 25 -18.269 -11.923 25.838 1.00 0.00 H new ATOM 0 HB3 ALA A 25 -18.837 -11.198 24.315 1.00 0.00 H new ATOM 336 N GLU A 26 -16.685 -13.493 22.309 1.00 0.00 N ATOM 337 CA GLU A 26 -16.656 -13.837 20.893 1.00 0.00 C ATOM 338 C GLU A 26 -18.070 -13.957 20.333 1.00 0.00 C ATOM 339 O GLU A 26 -18.958 -14.514 20.976 1.00 0.00 O ATOM 340 CB GLU A 26 -15.897 -15.149 20.679 1.00 0.00 C ATOM 341 CG GLU A 26 -15.846 -15.592 19.227 1.00 0.00 C ATOM 342 CD GLU A 26 -14.898 -16.756 19.006 1.00 0.00 C ATOM 343 OE1 GLU A 26 -13.845 -16.798 19.675 1.00 0.00 O ATOM 344 OE2 GLU A 26 -15.210 -17.624 18.164 1.00 0.00 O ATOM 0 H GLU A 26 -16.575 -14.288 22.939 1.00 0.00 H new ATOM 0 HA GLU A 26 -16.140 -13.037 20.362 1.00 0.00 H new ATOM 0 HB2 GLU A 26 -14.879 -15.035 21.051 1.00 0.00 H new ATOM 0 HB3 GLU A 26 -16.368 -15.932 21.273 1.00 0.00 H new ATOM 0 HG2 GLU A 26 -16.847 -15.876 18.902 1.00 0.00 H new ATOM 0 HG3 GLU A 26 -15.536 -14.752 18.605 1.00 0.00 H new ATOM 351 N ALA A 27 -18.270 -13.430 19.129 1.00 0.00 N ATOM 352 CA ALA A 27 -19.575 -13.479 18.481 1.00 0.00 C ATOM 353 C ALA A 27 -20.033 -14.920 18.278 1.00 0.00 C ATOM 354 O ALA A 27 -19.217 -15.815 18.056 1.00 0.00 O ATOM 355 CB ALA A 27 -19.531 -12.744 17.150 1.00 0.00 C ATOM 0 H ALA A 27 -17.545 -12.964 18.583 1.00 0.00 H new ATOM 0 HA ALA A 27 -20.296 -12.985 19.132 1.00 0.00 H new ATOM 0 HB1 ALA A 27 -20.512 -12.789 16.677 1.00 0.00 H new ATOM 0 HB2 ALA A 27 -19.256 -11.703 17.318 1.00 0.00 H new ATOM 0 HB3 ALA A 27 -18.793 -13.213 16.499 1.00 0.00 H new ATOM 361 N ARG A 28 -21.342 -15.136 18.355 1.00 0.00 N ATOM 362 CA ARG A 28 -21.908 -16.469 18.181 1.00 0.00 C ATOM 363 C ARG A 28 -23.034 -16.451 17.152 1.00 0.00 C ATOM 364 O ARG A 28 -23.855 -15.535 17.132 1.00 0.00 O ATOM 365 CB ARG A 28 -22.431 -17.002 19.516 1.00 0.00 C ATOM 366 CG ARG A 28 -21.342 -17.567 20.415 1.00 0.00 C ATOM 367 CD ARG A 28 -21.892 -17.954 21.779 1.00 0.00 C ATOM 368 NE ARG A 28 -20.829 -18.297 22.720 1.00 0.00 N ATOM 369 CZ ARG A 28 -20.090 -17.394 23.355 1.00 0.00 C ATOM 370 NH1 ARG A 28 -20.299 -16.101 23.152 1.00 0.00 N ATOM 371 NH2 ARG A 28 -19.141 -17.784 24.197 1.00 0.00 N ATOM 0 H ARG A 28 -22.031 -14.406 18.537 1.00 0.00 H new ATOM 0 HA ARG A 28 -21.119 -17.128 17.819 1.00 0.00 H new ATOM 0 HB2 ARG A 28 -22.944 -16.198 20.043 1.00 0.00 H new ATOM 0 HB3 ARG A 28 -23.170 -17.779 19.323 1.00 0.00 H new ATOM 0 HG2 ARG A 28 -20.894 -18.440 19.941 1.00 0.00 H new ATOM 0 HG3 ARG A 28 -20.550 -16.829 20.537 1.00 0.00 H new ATOM 0 HD2 ARG A 28 -22.479 -17.128 22.181 1.00 0.00 H new ATOM 0 HD3 ARG A 28 -22.568 -18.802 21.670 1.00 0.00 H new ATOM 0 HE ARG A 28 -20.644 -19.284 22.899 1.00 0.00 H new ATOM 0 HH11 ARG A 28 -21.029 -15.797 22.507 1.00 0.00 H new ATOM 0 HH12 ARG A 28 -19.730 -15.410 23.641 1.00 0.00 H new ATOM 0 HH21 ARG A 28 -18.978 -18.778 24.357 1.00 0.00 H new ATOM 0 HH22 ARG A 28 -18.574 -17.090 24.684 1.00 0.00 H new ATOM 385 N ALA A 29 -23.065 -17.469 16.299 1.00 0.00 N ATOM 386 CA ALA A 29 -24.090 -17.572 15.268 1.00 0.00 C ATOM 387 C ALA A 29 -25.484 -17.636 15.884 1.00 0.00 C ATOM 388 O ALA A 29 -25.785 -18.534 16.669 1.00 0.00 O ATOM 389 CB ALA A 29 -23.841 -18.792 14.394 1.00 0.00 C ATOM 0 H ALA A 29 -22.391 -18.235 16.302 1.00 0.00 H new ATOM 0 HA ALA A 29 -24.036 -16.678 14.647 1.00 0.00 H new ATOM 0 HB1 ALA A 29 -24.615 -18.855 13.629 1.00 0.00 H new ATOM 0 HB2 ALA A 29 -22.865 -18.705 13.917 1.00 0.00 H new ATOM 0 HB3 ALA A 29 -23.865 -19.691 15.009 1.00 0.00 H new ATOM 395 N GLY A 30 -26.330 -16.676 15.524 1.00 0.00 N ATOM 396 CA GLY A 30 -27.681 -16.641 16.052 1.00 0.00 C ATOM 397 C GLY A 30 -27.946 -15.404 16.887 1.00 0.00 C ATOM 398 O GLY A 30 -29.098 -15.020 17.088 1.00 0.00 O ATOM 0 H GLY A 30 -26.104 -15.922 14.876 1.00 0.00 H new ATOM 0 HA2 GLY A 30 -28.391 -16.677 15.226 1.00 0.00 H new ATOM 0 HA3 GLY A 30 -27.853 -17.529 16.660 1.00 0.00 H new ATOM 402 N GLN A 31 -26.878 -14.781 17.374 1.00 0.00 N ATOM 403 CA GLN A 31 -27.002 -13.582 18.194 1.00 0.00 C ATOM 404 C GLN A 31 -26.648 -12.334 17.391 1.00 0.00 C ATOM 405 O GLN A 31 -25.762 -12.364 16.536 1.00 0.00 O ATOM 406 CB GLN A 31 -26.100 -13.684 19.425 1.00 0.00 C ATOM 407 CG GLN A 31 -24.700 -13.135 19.200 1.00 0.00 C ATOM 408 CD GLN A 31 -23.806 -13.303 20.413 1.00 0.00 C ATOM 409 OE1 GLN A 31 -22.736 -13.907 20.330 1.00 0.00 O ATOM 410 NE2 GLN A 31 -24.240 -12.769 21.548 1.00 0.00 N ATOM 0 H GLN A 31 -25.918 -15.086 17.215 1.00 0.00 H new ATOM 0 HA GLN A 31 -28.039 -13.501 18.519 1.00 0.00 H new ATOM 0 HB2 GLN A 31 -26.564 -13.145 20.251 1.00 0.00 H new ATOM 0 HB3 GLN A 31 -26.028 -14.729 19.727 1.00 0.00 H new ATOM 0 HG2 GLN A 31 -24.248 -13.641 18.347 1.00 0.00 H new ATOM 0 HG3 GLN A 31 -24.765 -12.077 18.945 1.00 0.00 H new ATOM 0 HE21 GLN A 31 -25.133 -12.277 21.571 1.00 0.00 H new ATOM 0 HE22 GLN A 31 -23.680 -12.851 22.397 1.00 0.00 H new ATOM 419 N THR A 32 -27.345 -11.238 17.671 1.00 0.00 N ATOM 420 CA THR A 32 -27.105 -9.981 16.975 1.00 0.00 C ATOM 421 C THR A 32 -26.028 -9.160 17.675 1.00 0.00 C ATOM 422 O THR A 32 -25.933 -9.162 18.903 1.00 0.00 O ATOM 423 CB THR A 32 -28.392 -9.139 16.875 1.00 0.00 C ATOM 424 OG1 THR A 32 -29.514 -9.989 16.615 1.00 0.00 O ATOM 425 CG2 THR A 32 -28.273 -8.097 15.773 1.00 0.00 C ATOM 0 H THR A 32 -28.081 -11.196 18.376 1.00 0.00 H new ATOM 0 HA THR A 32 -26.767 -10.237 15.971 1.00 0.00 H new ATOM 0 HB THR A 32 -28.538 -8.625 17.825 1.00 0.00 H new ATOM 0 HG1 THR A 32 -30.328 -9.447 16.555 1.00 0.00 H new ATOM 0 HG21 THR A 32 -29.193 -7.515 15.722 1.00 0.00 H new ATOM 0 HG22 THR A 32 -27.436 -7.433 15.989 1.00 0.00 H new ATOM 0 HG23 THR A 32 -28.105 -8.595 14.818 1.00 0.00 H new ATOM 433 N VAL A 33 -25.219 -8.459 16.888 1.00 0.00 N ATOM 434 CA VAL A 33 -24.149 -7.632 17.434 1.00 0.00 C ATOM 435 C VAL A 33 -23.867 -6.435 16.534 1.00 0.00 C ATOM 436 O VAL A 33 -24.218 -6.435 15.354 1.00 0.00 O ATOM 437 CB VAL A 33 -22.851 -8.442 17.615 1.00 0.00 C ATOM 438 CG1 VAL A 33 -23.109 -9.683 18.454 1.00 0.00 C ATOM 439 CG2 VAL A 33 -22.263 -8.815 16.262 1.00 0.00 C ATOM 0 H VAL A 33 -25.284 -8.447 15.870 1.00 0.00 H new ATOM 0 HA VAL A 33 -24.487 -7.279 18.408 1.00 0.00 H new ATOM 0 HB VAL A 33 -22.126 -7.821 18.142 1.00 0.00 H new ATOM 0 HG11 VAL A 33 -22.181 -10.242 18.571 1.00 0.00 H new ATOM 0 HG12 VAL A 33 -23.481 -9.388 19.435 1.00 0.00 H new ATOM 0 HG13 VAL A 33 -23.850 -10.310 17.958 1.00 0.00 H new ATOM 0 HG21 VAL A 33 -21.347 -9.387 16.409 1.00 0.00 H new ATOM 0 HG22 VAL A 33 -22.982 -9.418 15.707 1.00 0.00 H new ATOM 0 HG23 VAL A 33 -22.039 -7.908 15.700 1.00 0.00 H new ATOM 449 N SER A 34 -23.230 -5.414 17.098 1.00 0.00 N ATOM 450 CA SER A 34 -22.902 -4.207 16.348 1.00 0.00 C ATOM 451 C SER A 34 -21.394 -4.076 16.161 1.00 0.00 C ATOM 452 O SER A 34 -20.633 -4.095 17.128 1.00 0.00 O ATOM 453 CB SER A 34 -23.448 -2.971 17.066 1.00 0.00 C ATOM 454 OG SER A 34 -22.413 -2.271 17.733 1.00 0.00 O ATOM 0 H SER A 34 -22.930 -5.398 18.073 1.00 0.00 H new ATOM 0 HA SER A 34 -23.367 -4.282 15.365 1.00 0.00 H new ATOM 0 HB2 SER A 34 -23.931 -2.312 16.345 1.00 0.00 H new ATOM 0 HB3 SER A 34 -24.210 -3.271 17.785 1.00 0.00 H new ATOM 0 HG SER A 34 -22.787 -1.485 18.183 1.00 0.00 H new ATOM 460 N VAL A 35 -20.969 -3.943 14.909 1.00 0.00 N ATOM 461 CA VAL A 35 -19.552 -3.807 14.593 1.00 0.00 C ATOM 462 C VAL A 35 -19.336 -2.830 13.443 1.00 0.00 C ATOM 463 O VAL A 35 -20.278 -2.466 12.738 1.00 0.00 O ATOM 464 CB VAL A 35 -18.927 -5.166 14.222 1.00 0.00 C ATOM 465 CG1 VAL A 35 -19.403 -6.251 15.175 1.00 0.00 C ATOM 466 CG2 VAL A 35 -19.257 -5.527 12.781 1.00 0.00 C ATOM 0 H VAL A 35 -21.586 -3.927 14.097 1.00 0.00 H new ATOM 0 HA VAL A 35 -19.064 -3.423 15.488 1.00 0.00 H new ATOM 0 HB VAL A 35 -17.844 -5.086 14.314 1.00 0.00 H new ATOM 0 HG11 VAL A 35 -18.951 -7.203 14.897 1.00 0.00 H new ATOM 0 HG12 VAL A 35 -19.111 -5.994 16.193 1.00 0.00 H new ATOM 0 HG13 VAL A 35 -20.488 -6.334 15.119 1.00 0.00 H new ATOM 0 HG21 VAL A 35 -18.808 -6.489 12.535 1.00 0.00 H new ATOM 0 HG22 VAL A 35 -20.338 -5.589 12.660 1.00 0.00 H new ATOM 0 HG23 VAL A 35 -18.861 -4.761 12.114 1.00 0.00 H new ATOM 476 N HIS A 36 -18.089 -2.408 13.258 1.00 0.00 N ATOM 477 CA HIS A 36 -17.749 -1.473 12.192 1.00 0.00 C ATOM 478 C HIS A 36 -16.864 -2.142 11.144 1.00 0.00 C ATOM 479 O HIS A 36 -15.935 -2.876 11.480 1.00 0.00 O ATOM 480 CB HIS A 36 -17.040 -0.247 12.767 1.00 0.00 C ATOM 481 CG HIS A 36 -17.916 0.965 12.858 1.00 0.00 C ATOM 482 ND1 HIS A 36 -18.775 1.349 11.850 1.00 0.00 N ATOM 483 CD2 HIS A 36 -18.064 1.878 13.846 1.00 0.00 C ATOM 484 CE1 HIS A 36 -19.413 2.448 12.213 1.00 0.00 C ATOM 485 NE2 HIS A 36 -19.000 2.789 13.421 1.00 0.00 N ATOM 0 H HIS A 36 -17.298 -2.699 13.832 1.00 0.00 H new ATOM 0 HA HIS A 36 -18.675 -1.156 11.712 1.00 0.00 H new ATOM 0 HB2 HIS A 36 -16.664 -0.488 13.761 1.00 0.00 H new ATOM 0 HB3 HIS A 36 -16.175 -0.014 12.146 1.00 0.00 H new ATOM 0 HD2 HIS A 36 -17.543 1.888 14.792 1.00 0.00 H new ATOM 0 HE1 HIS A 36 -20.147 2.977 11.623 1.00 0.00 H new ATOM 0 HE2 HIS A 36 -19.324 3.598 13.952 1.00 0.00 H new ATOM 493 N TYR A 37 -17.160 -1.884 9.875 1.00 0.00 N ATOM 494 CA TYR A 37 -16.394 -2.464 8.778 1.00 0.00 C ATOM 495 C TYR A 37 -15.776 -1.373 7.909 1.00 0.00 C ATOM 496 O TYR A 37 -16.452 -0.425 7.506 1.00 0.00 O ATOM 497 CB TYR A 37 -17.287 -3.367 7.926 1.00 0.00 C ATOM 498 CG TYR A 37 -18.328 -2.612 7.131 1.00 0.00 C ATOM 499 CD1 TYR A 37 -19.513 -2.193 7.722 1.00 0.00 C ATOM 500 CD2 TYR A 37 -18.125 -2.317 5.788 1.00 0.00 C ATOM 501 CE1 TYR A 37 -20.468 -1.504 6.999 1.00 0.00 C ATOM 502 CE2 TYR A 37 -19.074 -1.627 5.058 1.00 0.00 C ATOM 503 CZ TYR A 37 -20.243 -1.223 5.667 1.00 0.00 C ATOM 504 OH TYR A 37 -21.191 -0.536 4.944 1.00 0.00 O ATOM 0 H TYR A 37 -17.925 -1.277 9.580 1.00 0.00 H new ATOM 0 HA TYR A 37 -15.589 -3.061 9.206 1.00 0.00 H new ATOM 0 HB2 TYR A 37 -16.662 -3.939 7.240 1.00 0.00 H new ATOM 0 HB3 TYR A 37 -17.788 -4.085 8.575 1.00 0.00 H new ATOM 0 HD1 TYR A 37 -19.691 -2.409 8.765 1.00 0.00 H new ATOM 0 HD2 TYR A 37 -17.211 -2.632 5.307 1.00 0.00 H new ATOM 0 HE1 TYR A 37 -21.385 -1.187 7.474 1.00 0.00 H new ATOM 0 HE2 TYR A 37 -18.901 -1.405 4.015 1.00 0.00 H new ATOM 0 HH TYR A 37 -20.878 -0.419 4.023 1.00 0.00 H new ATOM 514 N THR A 38 -14.486 -1.513 7.622 1.00 0.00 N ATOM 515 CA THR A 38 -13.775 -0.541 6.801 1.00 0.00 C ATOM 516 C THR A 38 -13.131 -1.210 5.592 1.00 0.00 C ATOM 517 O THR A 38 -12.165 -1.960 5.726 1.00 0.00 O ATOM 518 CB THR A 38 -12.687 0.189 7.610 1.00 0.00 C ATOM 519 OG1 THR A 38 -12.954 0.067 9.012 1.00 0.00 O ATOM 520 CG2 THR A 38 -12.623 1.660 7.227 1.00 0.00 C ATOM 0 H THR A 38 -13.912 -2.291 7.946 1.00 0.00 H new ATOM 0 HA THR A 38 -14.513 0.186 6.461 1.00 0.00 H new ATOM 0 HB THR A 38 -11.726 -0.272 7.382 1.00 0.00 H new ATOM 0 HG1 THR A 38 -12.126 0.211 9.516 1.00 0.00 H new ATOM 0 HG21 THR A 38 -11.847 2.155 7.812 1.00 0.00 H new ATOM 0 HG22 THR A 38 -12.391 1.750 6.166 1.00 0.00 H new ATOM 0 HG23 THR A 38 -13.585 2.131 7.429 1.00 0.00 H new ATOM 528 N GLY A 39 -13.671 -0.931 4.409 1.00 0.00 N ATOM 529 CA GLY A 39 -13.135 -1.513 3.193 1.00 0.00 C ATOM 530 C GLY A 39 -11.756 -0.981 2.854 1.00 0.00 C ATOM 531 O GLY A 39 -11.607 0.184 2.484 1.00 0.00 O ATOM 0 H GLY A 39 -14.470 -0.312 4.272 1.00 0.00 H new ATOM 0 HA2 GLY A 39 -13.086 -2.596 3.303 1.00 0.00 H new ATOM 0 HA3 GLY A 39 -13.814 -1.307 2.365 1.00 0.00 H new ATOM 535 N TRP A 40 -10.747 -1.834 2.983 1.00 0.00 N ATOM 536 CA TRP A 40 -9.373 -1.442 2.689 1.00 0.00 C ATOM 537 C TRP A 40 -8.809 -2.260 1.532 1.00 0.00 C ATOM 538 O TRP A 40 -9.259 -3.377 1.272 1.00 0.00 O ATOM 539 CB TRP A 40 -8.495 -1.616 3.929 1.00 0.00 C ATOM 540 CG TRP A 40 -8.854 -0.684 5.047 1.00 0.00 C ATOM 541 CD1 TRP A 40 -9.633 0.434 4.963 1.00 0.00 C ATOM 542 CD2 TRP A 40 -8.446 -0.790 6.415 1.00 0.00 C ATOM 543 NE1 TRP A 40 -9.734 1.031 6.197 1.00 0.00 N ATOM 544 CE2 TRP A 40 -9.016 0.298 7.105 1.00 0.00 C ATOM 545 CE3 TRP A 40 -7.658 -1.699 7.125 1.00 0.00 C ATOM 546 CZ2 TRP A 40 -8.819 0.500 8.468 1.00 0.00 C ATOM 547 CZ3 TRP A 40 -7.463 -1.497 8.478 1.00 0.00 C ATOM 548 CH2 TRP A 40 -8.042 -0.405 9.138 1.00 0.00 C ATOM 0 H TRP A 40 -10.854 -2.801 3.289 1.00 0.00 H new ATOM 0 HA TRP A 40 -9.375 -0.391 2.399 1.00 0.00 H new ATOM 0 HB2 TRP A 40 -8.577 -2.644 4.282 1.00 0.00 H new ATOM 0 HB3 TRP A 40 -7.453 -1.456 3.653 1.00 0.00 H new ATOM 0 HD1 TRP A 40 -10.101 0.796 4.060 1.00 0.00 H new ATOM 0 HE1 TRP A 40 -10.258 1.881 6.403 1.00 0.00 H new ATOM 0 HE3 TRP A 40 -7.209 -2.545 6.625 1.00 0.00 H new ATOM 0 HZ2 TRP A 40 -9.264 1.341 8.979 1.00 0.00 H new ATOM 0 HZ3 TRP A 40 -6.854 -2.193 9.036 1.00 0.00 H new ATOM 0 HH2 TRP A 40 -7.872 -0.275 10.197 1.00 0.00 H new ATOM 559 N LEU A 41 -7.823 -1.699 0.842 1.00 0.00 N ATOM 560 CA LEU A 41 -7.197 -2.378 -0.287 1.00 0.00 C ATOM 561 C LEU A 41 -6.063 -3.284 0.182 1.00 0.00 C ATOM 562 O LEU A 41 -5.616 -3.197 1.326 1.00 0.00 O ATOM 563 CB LEU A 41 -6.664 -1.354 -1.291 1.00 0.00 C ATOM 564 CG LEU A 41 -7.557 -1.072 -2.500 1.00 0.00 C ATOM 565 CD1 LEU A 41 -6.938 0.001 -3.382 1.00 0.00 C ATOM 566 CD2 LEU A 41 -7.796 -2.347 -3.296 1.00 0.00 C ATOM 0 H LEU A 41 -7.439 -0.776 1.044 1.00 0.00 H new ATOM 0 HA LEU A 41 -7.953 -2.995 -0.772 1.00 0.00 H new ATOM 0 HB2 LEU A 41 -6.491 -0.415 -0.765 1.00 0.00 H new ATOM 0 HB3 LEU A 41 -5.695 -1.699 -1.653 1.00 0.00 H new ATOM 0 HG LEU A 41 -8.519 -0.707 -2.140 1.00 0.00 H new ATOM 0 HD11 LEU A 41 -7.587 0.188 -4.237 1.00 0.00 H new ATOM 0 HD12 LEU A 41 -6.820 0.920 -2.808 1.00 0.00 H new ATOM 0 HD13 LEU A 41 -5.963 -0.335 -3.734 1.00 0.00 H new ATOM 0 HD21 LEU A 41 -8.433 -2.127 -4.152 1.00 0.00 H new ATOM 0 HD22 LEU A 41 -6.842 -2.742 -3.646 1.00 0.00 H new ATOM 0 HD23 LEU A 41 -8.284 -3.086 -2.661 1.00 0.00 H new ATOM 578 N THR A 42 -5.599 -4.154 -0.710 1.00 0.00 N ATOM 579 CA THR A 42 -4.517 -5.075 -0.388 1.00 0.00 C ATOM 580 C THR A 42 -3.265 -4.322 0.045 1.00 0.00 C ATOM 581 O THR A 42 -2.383 -4.886 0.694 1.00 0.00 O ATOM 582 CB THR A 42 -4.171 -5.977 -1.588 1.00 0.00 C ATOM 583 OG1 THR A 42 -3.465 -5.222 -2.580 1.00 0.00 O ATOM 584 CG2 THR A 42 -5.431 -6.572 -2.199 1.00 0.00 C ATOM 0 H THR A 42 -5.956 -4.240 -1.662 1.00 0.00 H new ATOM 0 HA THR A 42 -4.866 -5.697 0.436 1.00 0.00 H new ATOM 0 HB THR A 42 -3.539 -6.791 -1.233 1.00 0.00 H new ATOM 0 HG1 THR A 42 -3.247 -5.802 -3.339 1.00 0.00 H new ATOM 0 HG21 THR A 42 -5.161 -7.205 -3.044 1.00 0.00 H new ATOM 0 HG22 THR A 42 -5.952 -7.169 -1.450 1.00 0.00 H new ATOM 0 HG23 THR A 42 -6.084 -5.769 -2.541 1.00 0.00 H new ATOM 592 N ASP A 43 -3.192 -3.046 -0.316 1.00 0.00 N ATOM 593 CA ASP A 43 -2.047 -2.215 0.037 1.00 0.00 C ATOM 594 C ASP A 43 -2.340 -1.389 1.286 1.00 0.00 C ATOM 595 O ASP A 43 -1.425 -0.912 1.956 1.00 0.00 O ATOM 596 CB ASP A 43 -1.682 -1.291 -1.126 1.00 0.00 C ATOM 597 CG ASP A 43 -2.901 -0.653 -1.763 1.00 0.00 C ATOM 598 OD1 ASP A 43 -3.752 -0.126 -1.017 1.00 0.00 O ATOM 599 OD2 ASP A 43 -3.004 -0.682 -3.007 1.00 0.00 O ATOM 0 H ASP A 43 -3.913 -2.564 -0.853 1.00 0.00 H new ATOM 0 HA ASP A 43 -1.203 -2.872 0.247 1.00 0.00 H new ATOM 0 HB2 ASP A 43 -1.011 -0.510 -0.769 1.00 0.00 H new ATOM 0 HB3 ASP A 43 -1.137 -1.859 -1.880 1.00 0.00 H new ATOM 604 N GLY A 44 -3.624 -1.224 1.593 1.00 0.00 N ATOM 605 CA GLY A 44 -4.014 -0.455 2.760 1.00 0.00 C ATOM 606 C GLY A 44 -4.811 0.783 2.398 1.00 0.00 C ATOM 607 O GLY A 44 -5.130 1.598 3.263 1.00 0.00 O ATOM 0 H GLY A 44 -4.400 -1.609 1.054 1.00 0.00 H new ATOM 0 HA2 GLY A 44 -4.607 -1.084 3.424 1.00 0.00 H new ATOM 0 HA3 GLY A 44 -3.122 -0.160 3.312 1.00 0.00 H new ATOM 611 N GLN A 45 -5.132 0.924 1.116 1.00 0.00 N ATOM 612 CA GLN A 45 -5.895 2.073 0.642 1.00 0.00 C ATOM 613 C GLN A 45 -7.384 1.890 0.919 1.00 0.00 C ATOM 614 O GLN A 45 -8.021 0.988 0.374 1.00 0.00 O ATOM 615 CB GLN A 45 -5.664 2.283 -0.855 1.00 0.00 C ATOM 616 CG GLN A 45 -4.250 2.724 -1.197 1.00 0.00 C ATOM 617 CD GLN A 45 -3.865 2.393 -2.626 1.00 0.00 C ATOM 618 OE1 GLN A 45 -2.767 1.902 -2.887 1.00 0.00 O ATOM 619 NE2 GLN A 45 -4.770 2.662 -3.560 1.00 0.00 N ATOM 0 H GLN A 45 -4.876 0.258 0.387 1.00 0.00 H new ATOM 0 HA GLN A 45 -5.550 2.954 1.182 1.00 0.00 H new ATOM 0 HB2 GLN A 45 -5.883 1.354 -1.382 1.00 0.00 H new ATOM 0 HB3 GLN A 45 -6.367 3.031 -1.221 1.00 0.00 H new ATOM 0 HG2 GLN A 45 -4.161 3.799 -1.040 1.00 0.00 H new ATOM 0 HG3 GLN A 45 -3.549 2.243 -0.515 1.00 0.00 H new ATOM 0 HE21 GLN A 45 -5.668 3.069 -3.298 1.00 0.00 H new ATOM 0 HE22 GLN A 45 -4.567 2.461 -4.539 1.00 0.00 H new ATOM 628 N LYS A 46 -7.933 2.751 1.769 1.00 0.00 N ATOM 629 CA LYS A 46 -9.347 2.685 2.118 1.00 0.00 C ATOM 630 C LYS A 46 -10.215 3.174 0.963 1.00 0.00 C ATOM 631 O LYS A 46 -10.030 4.282 0.460 1.00 0.00 O ATOM 632 CB LYS A 46 -9.624 3.523 3.368 1.00 0.00 C ATOM 633 CG LYS A 46 -11.076 3.490 3.814 1.00 0.00 C ATOM 634 CD LYS A 46 -11.437 4.720 4.629 1.00 0.00 C ATOM 635 CE LYS A 46 -10.901 4.625 6.049 1.00 0.00 C ATOM 636 NZ LYS A 46 -9.450 4.953 6.117 1.00 0.00 N ATOM 0 H LYS A 46 -7.420 3.503 2.229 1.00 0.00 H new ATOM 0 HA LYS A 46 -9.597 1.644 2.323 1.00 0.00 H new ATOM 0 HB2 LYS A 46 -8.994 3.164 4.182 1.00 0.00 H new ATOM 0 HB3 LYS A 46 -9.336 4.556 3.174 1.00 0.00 H new ATOM 0 HG2 LYS A 46 -11.725 3.428 2.940 1.00 0.00 H new ATOM 0 HG3 LYS A 46 -11.255 2.594 4.408 1.00 0.00 H new ATOM 0 HD2 LYS A 46 -11.033 5.609 4.145 1.00 0.00 H new ATOM 0 HD3 LYS A 46 -12.521 4.835 4.655 1.00 0.00 H new ATOM 0 HE2 LYS A 46 -11.458 5.305 6.694 1.00 0.00 H new ATOM 0 HE3 LYS A 46 -11.064 3.618 6.432 1.00 0.00 H new ATOM 0 HZ1 LYS A 46 -9.262 5.519 6.969 1.00 0.00 H new ATOM 0 HZ2 LYS A 46 -8.897 4.073 6.157 1.00 0.00 H new ATOM 0 HZ3 LYS A 46 -9.177 5.496 5.273 1.00 0.00 H new ATOM 650 N PHE A 47 -11.164 2.341 0.549 1.00 0.00 N ATOM 651 CA PHE A 47 -12.062 2.688 -0.547 1.00 0.00 C ATOM 652 C PHE A 47 -13.520 2.522 -0.128 1.00 0.00 C ATOM 653 O PHE A 47 -14.413 2.438 -0.972 1.00 0.00 O ATOM 654 CB PHE A 47 -11.768 1.818 -1.770 1.00 0.00 C ATOM 655 CG PHE A 47 -12.154 0.378 -1.588 1.00 0.00 C ATOM 656 CD1 PHE A 47 -11.272 -0.521 -1.009 1.00 0.00 C ATOM 657 CD2 PHE A 47 -13.397 -0.077 -1.996 1.00 0.00 C ATOM 658 CE1 PHE A 47 -11.624 -1.847 -0.842 1.00 0.00 C ATOM 659 CE2 PHE A 47 -13.755 -1.402 -1.830 1.00 0.00 C ATOM 660 CZ PHE A 47 -12.867 -2.288 -1.251 1.00 0.00 C ATOM 0 H PHE A 47 -11.331 1.421 0.956 1.00 0.00 H new ATOM 0 HA PHE A 47 -11.893 3.733 -0.805 1.00 0.00 H new ATOM 0 HB2 PHE A 47 -12.301 2.223 -2.630 1.00 0.00 H new ATOM 0 HB3 PHE A 47 -10.704 1.874 -1.999 1.00 0.00 H new ATOM 0 HD1 PHE A 47 -10.299 -0.182 -0.685 1.00 0.00 H new ATOM 0 HD2 PHE A 47 -14.095 0.611 -2.449 1.00 0.00 H new ATOM 0 HE1 PHE A 47 -10.927 -2.538 -0.392 1.00 0.00 H new ATOM 0 HE2 PHE A 47 -14.727 -1.744 -2.152 1.00 0.00 H new ATOM 0 HZ PHE A 47 -13.144 -3.323 -1.119 1.00 0.00 H new ATOM 670 N ASP A 48 -13.752 2.475 1.179 1.00 0.00 N ATOM 671 CA ASP A 48 -15.102 2.319 1.710 1.00 0.00 C ATOM 672 C ASP A 48 -15.096 2.387 3.234 1.00 0.00 C ATOM 673 O ASP A 48 -14.356 1.659 3.895 1.00 0.00 O ATOM 674 CB ASP A 48 -15.705 0.992 1.248 1.00 0.00 C ATOM 675 CG ASP A 48 -17.212 1.061 1.099 1.00 0.00 C ATOM 676 OD1 ASP A 48 -17.915 0.965 2.126 1.00 0.00 O ATOM 677 OD2 ASP A 48 -17.688 1.213 -0.045 1.00 0.00 O ATOM 0 H ASP A 48 -13.024 2.543 1.890 1.00 0.00 H new ATOM 0 HA ASP A 48 -15.713 3.138 1.330 1.00 0.00 H new ATOM 0 HB2 ASP A 48 -15.261 0.707 0.294 1.00 0.00 H new ATOM 0 HB3 ASP A 48 -15.449 0.211 1.964 1.00 0.00 H new ATOM 682 N SER A 49 -15.926 3.267 3.785 1.00 0.00 N ATOM 683 CA SER A 49 -16.014 3.434 5.231 1.00 0.00 C ATOM 684 C SER A 49 -17.468 3.555 5.677 1.00 0.00 C ATOM 685 O SER A 49 -18.269 4.239 5.041 1.00 0.00 O ATOM 686 CB SER A 49 -15.228 4.670 5.672 1.00 0.00 C ATOM 687 OG SER A 49 -15.384 5.730 4.744 1.00 0.00 O ATOM 0 H SER A 49 -16.547 3.875 3.252 1.00 0.00 H new ATOM 0 HA SER A 49 -15.581 2.551 5.701 1.00 0.00 H new ATOM 0 HB2 SER A 49 -15.570 4.990 6.656 1.00 0.00 H new ATOM 0 HB3 SER A 49 -14.172 4.418 5.768 1.00 0.00 H new ATOM 0 HG SER A 49 -14.874 6.509 5.049 1.00 0.00 H new ATOM 693 N SER A 50 -17.801 2.885 6.775 1.00 0.00 N ATOM 694 CA SER A 50 -19.159 2.913 7.306 1.00 0.00 C ATOM 695 C SER A 50 -19.497 4.294 7.859 1.00 0.00 C ATOM 696 O SER A 50 -20.656 4.595 8.145 1.00 0.00 O ATOM 697 CB SER A 50 -19.324 1.858 8.401 1.00 0.00 C ATOM 698 OG SER A 50 -20.357 2.216 9.303 1.00 0.00 O ATOM 0 H SER A 50 -17.149 2.316 7.315 1.00 0.00 H new ATOM 0 HA SER A 50 -19.846 2.689 6.490 1.00 0.00 H new ATOM 0 HB2 SER A 50 -19.550 0.892 7.949 1.00 0.00 H new ATOM 0 HB3 SER A 50 -18.386 1.744 8.944 1.00 0.00 H new ATOM 0 HG SER A 50 -20.907 2.924 8.906 1.00 0.00 H new ATOM 704 N LYS A 51 -18.476 5.131 8.009 1.00 0.00 N ATOM 705 CA LYS A 51 -18.662 6.481 8.527 1.00 0.00 C ATOM 706 C LYS A 51 -19.669 7.254 7.681 1.00 0.00 C ATOM 707 O LYS A 51 -20.301 8.197 8.159 1.00 0.00 O ATOM 708 CB LYS A 51 -17.326 7.227 8.557 1.00 0.00 C ATOM 709 CG LYS A 51 -16.406 6.781 9.680 1.00 0.00 C ATOM 710 CD LYS A 51 -15.215 7.713 9.828 1.00 0.00 C ATOM 711 CE LYS A 51 -15.606 9.014 10.511 1.00 0.00 C ATOM 712 NZ LYS A 51 -14.513 10.024 10.450 1.00 0.00 N ATOM 0 H LYS A 51 -17.510 4.898 7.779 1.00 0.00 H new ATOM 0 HA LYS A 51 -19.050 6.403 9.543 1.00 0.00 H new ATOM 0 HB2 LYS A 51 -16.818 7.084 7.603 1.00 0.00 H new ATOM 0 HB3 LYS A 51 -17.518 8.295 8.658 1.00 0.00 H new ATOM 0 HG2 LYS A 51 -16.963 6.749 10.617 1.00 0.00 H new ATOM 0 HG3 LYS A 51 -16.054 5.768 9.483 1.00 0.00 H new ATOM 0 HD2 LYS A 51 -14.434 7.218 10.406 1.00 0.00 H new ATOM 0 HD3 LYS A 51 -14.796 7.929 8.845 1.00 0.00 H new ATOM 0 HE2 LYS A 51 -16.501 9.418 10.037 1.00 0.00 H new ATOM 0 HE3 LYS A 51 -15.859 8.815 11.552 1.00 0.00 H new ATOM 0 HZ1 LYS A 51 -14.819 10.896 10.927 1.00 0.00 H new ATOM 0 HZ2 LYS A 51 -13.667 9.649 10.924 1.00 0.00 H new ATOM 0 HZ3 LYS A 51 -14.289 10.233 9.456 1.00 0.00 H new ATOM 726 N ASP A 52 -19.814 6.849 6.425 1.00 0.00 N ATOM 727 CA ASP A 52 -20.746 7.503 5.513 1.00 0.00 C ATOM 728 C ASP A 52 -22.134 7.606 6.138 1.00 0.00 C ATOM 729 O ASP A 52 -22.885 8.541 5.857 1.00 0.00 O ATOM 730 CB ASP A 52 -20.824 6.736 4.192 1.00 0.00 C ATOM 731 CG ASP A 52 -21.297 7.606 3.044 1.00 0.00 C ATOM 732 OD1 ASP A 52 -22.103 8.527 3.291 1.00 0.00 O ATOM 733 OD2 ASP A 52 -20.860 7.366 1.900 1.00 0.00 O ATOM 0 H ASP A 52 -19.298 6.071 6.014 1.00 0.00 H new ATOM 0 HA ASP A 52 -20.378 8.510 5.318 1.00 0.00 H new ATOM 0 HB2 ASP A 52 -19.842 6.328 3.954 1.00 0.00 H new ATOM 0 HB3 ASP A 52 -21.502 5.890 4.306 1.00 0.00 H new ATOM 738 N ARG A 53 -22.470 6.639 6.985 1.00 0.00 N ATOM 739 CA ARG A 53 -23.768 6.619 7.648 1.00 0.00 C ATOM 740 C ARG A 53 -23.650 7.105 9.090 1.00 0.00 C ATOM 741 O ARG A 53 -24.640 7.500 9.705 1.00 0.00 O ATOM 742 CB ARG A 53 -24.358 5.208 7.621 1.00 0.00 C ATOM 743 CG ARG A 53 -25.854 5.167 7.886 1.00 0.00 C ATOM 744 CD ARG A 53 -26.457 3.835 7.471 1.00 0.00 C ATOM 745 NE ARG A 53 -26.330 2.826 8.519 1.00 0.00 N ATOM 746 CZ ARG A 53 -26.843 1.604 8.429 1.00 0.00 C ATOM 747 NH1 ARG A 53 -27.512 1.240 7.344 1.00 0.00 N ATOM 748 NH2 ARG A 53 -26.685 0.742 9.426 1.00 0.00 N ATOM 0 H ARG A 53 -21.861 5.858 7.229 1.00 0.00 H new ATOM 0 HA ARG A 53 -24.433 7.293 7.108 1.00 0.00 H new ATOM 0 HB2 ARG A 53 -24.158 4.758 6.648 1.00 0.00 H new ATOM 0 HB3 ARG A 53 -23.849 4.596 8.366 1.00 0.00 H new ATOM 0 HG2 ARG A 53 -26.042 5.338 8.946 1.00 0.00 H new ATOM 0 HG3 ARG A 53 -26.343 5.975 7.341 1.00 0.00 H new ATOM 0 HD2 ARG A 53 -27.510 3.974 7.228 1.00 0.00 H new ATOM 0 HD3 ARG A 53 -25.965 3.481 6.565 1.00 0.00 H new ATOM 0 HE ARG A 53 -25.819 3.073 9.367 1.00 0.00 H new ATOM 0 HH11 ARG A 53 -27.634 1.899 6.575 1.00 0.00 H new ATOM 0 HH12 ARG A 53 -27.905 0.301 7.278 1.00 0.00 H new ATOM 0 HH21 ARG A 53 -26.169 1.018 10.262 1.00 0.00 H new ATOM 0 HH22 ARG A 53 -27.079 -0.196 9.356 1.00 0.00 H new ATOM 762 N ASN A 54 -22.433 7.073 9.622 1.00 0.00 N ATOM 763 CA ASN A 54 -22.186 7.509 10.991 1.00 0.00 C ATOM 764 C ASN A 54 -22.923 6.619 11.987 1.00 0.00 C ATOM 765 O ASN A 54 -23.754 7.093 12.763 1.00 0.00 O ATOM 766 CB ASN A 54 -22.621 8.965 11.172 1.00 0.00 C ATOM 767 CG ASN A 54 -22.313 9.815 9.954 1.00 0.00 C ATOM 768 OD1 ASN A 54 -23.108 9.887 9.017 1.00 0.00 O ATOM 769 ND2 ASN A 54 -21.155 10.464 9.963 1.00 0.00 N ATOM 0 H ASN A 54 -21.602 6.750 9.126 1.00 0.00 H new ATOM 0 HA ASN A 54 -21.116 7.430 11.183 1.00 0.00 H new ATOM 0 HB2 ASN A 54 -23.691 8.999 11.375 1.00 0.00 H new ATOM 0 HB3 ASN A 54 -22.118 9.386 12.043 1.00 0.00 H new ATOM 0 HD21 ASN A 54 -20.894 11.052 9.171 1.00 0.00 H new ATOM 0 HD22 ASN A 54 -20.527 10.375 10.762 1.00 0.00 H new ATOM 776 N ASP A 55 -22.614 5.327 11.960 1.00 0.00 N ATOM 777 CA ASP A 55 -23.246 4.371 12.861 1.00 0.00 C ATOM 778 C ASP A 55 -22.702 2.964 12.628 1.00 0.00 C ATOM 779 O ASP A 55 -22.388 2.572 11.504 1.00 0.00 O ATOM 780 CB ASP A 55 -24.763 4.382 12.669 1.00 0.00 C ATOM 781 CG ASP A 55 -25.404 3.059 13.039 1.00 0.00 C ATOM 782 OD1 ASP A 55 -25.321 2.112 12.229 1.00 0.00 O ATOM 783 OD2 ASP A 55 -25.988 2.970 14.139 1.00 0.00 O ATOM 0 H ASP A 55 -21.930 4.918 11.324 1.00 0.00 H new ATOM 0 HA ASP A 55 -23.015 4.667 13.884 1.00 0.00 H new ATOM 0 HB2 ASP A 55 -25.197 5.175 13.277 1.00 0.00 H new ATOM 0 HB3 ASP A 55 -24.993 4.615 11.629 1.00 0.00 H new ATOM 788 N PRO A 56 -22.587 2.187 13.715 1.00 0.00 N ATOM 789 CA PRO A 56 -22.081 0.812 13.655 1.00 0.00 C ATOM 790 C PRO A 56 -23.054 -0.134 12.960 1.00 0.00 C ATOM 791 O PRO A 56 -24.266 -0.054 13.164 1.00 0.00 O ATOM 792 CB PRO A 56 -21.921 0.429 15.128 1.00 0.00 C ATOM 793 CG PRO A 56 -22.891 1.297 15.853 1.00 0.00 C ATOM 794 CD PRO A 56 -22.943 2.589 15.086 1.00 0.00 C ATOM 0 HA PRO A 56 -21.158 0.742 13.080 1.00 0.00 H new ATOM 0 HB2 PRO A 56 -22.138 -0.627 15.288 1.00 0.00 H new ATOM 0 HB3 PRO A 56 -20.901 0.601 15.473 1.00 0.00 H new ATOM 0 HG2 PRO A 56 -23.875 0.830 15.898 1.00 0.00 H new ATOM 0 HG3 PRO A 56 -22.571 1.466 16.881 1.00 0.00 H new ATOM 0 HD2 PRO A 56 -23.934 3.041 15.128 1.00 0.00 H new ATOM 0 HD3 PRO A 56 -22.241 3.322 15.485 1.00 0.00 H new ATOM 802 N PHE A 57 -22.517 -1.031 12.140 1.00 0.00 N ATOM 803 CA PHE A 57 -23.338 -1.993 11.414 1.00 0.00 C ATOM 804 C PHE A 57 -23.774 -3.134 12.329 1.00 0.00 C ATOM 805 O PHE A 57 -22.973 -3.997 12.686 1.00 0.00 O ATOM 806 CB PHE A 57 -22.569 -2.550 10.215 1.00 0.00 C ATOM 807 CG PHE A 57 -23.437 -3.291 9.238 1.00 0.00 C ATOM 808 CD1 PHE A 57 -24.510 -2.662 8.628 1.00 0.00 C ATOM 809 CD2 PHE A 57 -23.179 -4.617 8.930 1.00 0.00 C ATOM 810 CE1 PHE A 57 -25.311 -3.342 7.730 1.00 0.00 C ATOM 811 CE2 PHE A 57 -23.976 -5.302 8.032 1.00 0.00 C ATOM 812 CZ PHE A 57 -25.043 -4.663 7.431 1.00 0.00 C ATOM 0 H PHE A 57 -21.516 -1.112 11.961 1.00 0.00 H new ATOM 0 HA PHE A 57 -24.229 -1.477 11.056 1.00 0.00 H new ATOM 0 HB2 PHE A 57 -22.073 -1.728 9.698 1.00 0.00 H new ATOM 0 HB3 PHE A 57 -21.787 -3.219 10.574 1.00 0.00 H new ATOM 0 HD1 PHE A 57 -24.723 -1.628 8.857 1.00 0.00 H new ATOM 0 HD2 PHE A 57 -22.346 -5.121 9.397 1.00 0.00 H new ATOM 0 HE1 PHE A 57 -26.146 -2.841 7.263 1.00 0.00 H new ATOM 0 HE2 PHE A 57 -23.765 -6.336 7.801 1.00 0.00 H new ATOM 0 HZ PHE A 57 -25.667 -5.196 6.728 1.00 0.00 H new ATOM 822 N ALA A 58 -25.049 -3.131 12.703 1.00 0.00 N ATOM 823 CA ALA A 58 -25.592 -4.166 13.574 1.00 0.00 C ATOM 824 C ALA A 58 -26.418 -5.173 12.780 1.00 0.00 C ATOM 825 O ALA A 58 -27.245 -4.796 11.950 1.00 0.00 O ATOM 826 CB ALA A 58 -26.435 -3.540 14.675 1.00 0.00 C ATOM 0 H ALA A 58 -25.725 -2.423 12.416 1.00 0.00 H new ATOM 0 HA ALA A 58 -24.757 -4.699 14.029 1.00 0.00 H new ATOM 0 HB1 ALA A 58 -26.834 -4.324 15.318 1.00 0.00 H new ATOM 0 HB2 ALA A 58 -25.817 -2.865 15.267 1.00 0.00 H new ATOM 0 HB3 ALA A 58 -27.258 -2.982 14.230 1.00 0.00 H new ATOM 832 N PHE A 59 -26.188 -6.456 13.041 1.00 0.00 N ATOM 833 CA PHE A 59 -26.909 -7.517 12.349 1.00 0.00 C ATOM 834 C PHE A 59 -26.774 -8.842 13.095 1.00 0.00 C ATOM 835 O PHE A 59 -26.060 -8.935 14.094 1.00 0.00 O ATOM 836 CB PHE A 59 -26.388 -7.670 10.919 1.00 0.00 C ATOM 837 CG PHE A 59 -25.021 -8.287 10.841 1.00 0.00 C ATOM 838 CD1 PHE A 59 -23.912 -7.610 11.321 1.00 0.00 C ATOM 839 CD2 PHE A 59 -24.846 -9.546 10.288 1.00 0.00 C ATOM 840 CE1 PHE A 59 -22.653 -8.176 11.250 1.00 0.00 C ATOM 841 CE2 PHE A 59 -23.589 -10.117 10.214 1.00 0.00 C ATOM 842 CZ PHE A 59 -22.492 -9.432 10.697 1.00 0.00 C ATOM 0 H PHE A 59 -25.508 -6.785 13.726 1.00 0.00 H new ATOM 0 HA PHE A 59 -27.963 -7.243 12.316 1.00 0.00 H new ATOM 0 HB2 PHE A 59 -27.087 -8.283 10.350 1.00 0.00 H new ATOM 0 HB3 PHE A 59 -26.363 -6.690 10.443 1.00 0.00 H new ATOM 0 HD1 PHE A 59 -24.032 -6.629 11.756 1.00 0.00 H new ATOM 0 HD2 PHE A 59 -25.701 -10.087 9.911 1.00 0.00 H new ATOM 0 HE1 PHE A 59 -21.796 -7.637 11.626 1.00 0.00 H new ATOM 0 HE2 PHE A 59 -23.465 -11.098 9.779 1.00 0.00 H new ATOM 0 HZ PHE A 59 -21.510 -9.877 10.643 1.00 0.00 H new ATOM 852 N VAL A 60 -27.466 -9.864 12.603 1.00 0.00 N ATOM 853 CA VAL A 60 -27.424 -11.184 13.222 1.00 0.00 C ATOM 854 C VAL A 60 -26.274 -12.016 12.665 1.00 0.00 C ATOM 855 O VAL A 60 -26.076 -12.087 11.451 1.00 0.00 O ATOM 856 CB VAL A 60 -28.745 -11.947 13.008 1.00 0.00 C ATOM 857 CG1 VAL A 60 -28.665 -13.336 13.621 1.00 0.00 C ATOM 858 CG2 VAL A 60 -29.912 -11.164 13.591 1.00 0.00 C ATOM 0 H VAL A 60 -28.062 -9.804 11.778 1.00 0.00 H new ATOM 0 HA VAL A 60 -27.272 -11.028 14.290 1.00 0.00 H new ATOM 0 HB VAL A 60 -28.911 -12.059 11.936 1.00 0.00 H new ATOM 0 HG11 VAL A 60 -29.607 -13.860 13.460 1.00 0.00 H new ATOM 0 HG12 VAL A 60 -27.855 -13.894 13.152 1.00 0.00 H new ATOM 0 HG13 VAL A 60 -28.476 -13.251 14.691 1.00 0.00 H new ATOM 0 HG21 VAL A 60 -30.837 -11.717 13.431 1.00 0.00 H new ATOM 0 HG22 VAL A 60 -29.756 -11.020 14.660 1.00 0.00 H new ATOM 0 HG23 VAL A 60 -29.980 -10.193 13.100 1.00 0.00 H new ATOM 868 N LEU A 61 -25.518 -12.644 13.559 1.00 0.00 N ATOM 869 CA LEU A 61 -24.387 -13.472 13.157 1.00 0.00 C ATOM 870 C LEU A 61 -24.863 -14.802 12.582 1.00 0.00 C ATOM 871 O LEU A 61 -25.746 -15.451 13.141 1.00 0.00 O ATOM 872 CB LEU A 61 -23.462 -13.720 14.350 1.00 0.00 C ATOM 873 CG LEU A 61 -22.239 -14.597 14.080 1.00 0.00 C ATOM 874 CD1 LEU A 61 -21.475 -14.089 12.867 1.00 0.00 C ATOM 875 CD2 LEU A 61 -21.334 -14.641 15.303 1.00 0.00 C ATOM 0 H LEU A 61 -25.668 -12.595 14.567 1.00 0.00 H new ATOM 0 HA LEU A 61 -23.835 -12.940 12.382 1.00 0.00 H new ATOM 0 HB2 LEU A 61 -23.117 -12.756 14.724 1.00 0.00 H new ATOM 0 HB3 LEU A 61 -24.046 -14.181 15.147 1.00 0.00 H new ATOM 0 HG LEU A 61 -22.581 -15.610 13.870 1.00 0.00 H new ATOM 0 HD11 LEU A 61 -20.608 -14.726 12.690 1.00 0.00 H new ATOM 0 HD12 LEU A 61 -22.125 -14.110 11.992 1.00 0.00 H new ATOM 0 HD13 LEU A 61 -21.144 -13.066 13.048 1.00 0.00 H new ATOM 0 HD21 LEU A 61 -20.469 -15.270 15.093 1.00 0.00 H new ATOM 0 HD22 LEU A 61 -20.999 -13.632 15.545 1.00 0.00 H new ATOM 0 HD23 LEU A 61 -21.885 -15.053 16.149 1.00 0.00 H new ATOM 887 N GLY A 62 -24.269 -15.204 11.463 1.00 0.00 N ATOM 888 CA GLY A 62 -24.644 -16.457 10.832 1.00 0.00 C ATOM 889 C GLY A 62 -25.763 -16.286 9.824 1.00 0.00 C ATOM 890 O GLY A 62 -26.432 -17.252 9.459 1.00 0.00 O ATOM 0 H GLY A 62 -23.535 -14.685 10.982 1.00 0.00 H new ATOM 0 HA2 GLY A 62 -23.773 -16.885 10.335 1.00 0.00 H new ATOM 0 HA3 GLY A 62 -24.955 -17.167 11.598 1.00 0.00 H new ATOM 894 N GLY A 63 -25.967 -15.052 9.372 1.00 0.00 N ATOM 895 CA GLY A 63 -27.015 -14.780 8.406 1.00 0.00 C ATOM 896 C GLY A 63 -26.714 -15.373 7.043 1.00 0.00 C ATOM 897 O GLY A 63 -27.086 -16.510 6.757 1.00 0.00 O ATOM 0 H GLY A 63 -25.425 -14.236 9.658 1.00 0.00 H new ATOM 0 HA2 GLY A 63 -27.958 -15.183 8.774 1.00 0.00 H new ATOM 0 HA3 GLY A 63 -27.145 -13.702 8.309 1.00 0.00 H new ATOM 901 N GLY A 64 -26.040 -14.598 6.198 1.00 0.00 N ATOM 902 CA GLY A 64 -25.703 -15.069 4.868 1.00 0.00 C ATOM 903 C GLY A 64 -25.640 -13.945 3.853 1.00 0.00 C ATOM 904 O GLY A 64 -25.064 -14.102 2.777 1.00 0.00 O ATOM 0 H GLY A 64 -25.722 -13.653 6.411 1.00 0.00 H new ATOM 0 HA2 GLY A 64 -24.741 -15.580 4.900 1.00 0.00 H new ATOM 0 HA3 GLY A 64 -26.443 -15.803 4.548 1.00 0.00 H new ATOM 908 N MET A 65 -26.236 -12.807 4.195 1.00 0.00 N ATOM 909 CA MET A 65 -26.246 -11.652 3.305 1.00 0.00 C ATOM 910 C MET A 65 -24.826 -11.177 3.016 1.00 0.00 C ATOM 911 O MET A 65 -24.564 -10.564 1.981 1.00 0.00 O ATOM 912 CB MET A 65 -27.062 -10.514 3.920 1.00 0.00 C ATOM 913 CG MET A 65 -27.603 -9.531 2.894 1.00 0.00 C ATOM 914 SD MET A 65 -29.037 -8.619 3.496 1.00 0.00 S ATOM 915 CE MET A 65 -28.344 -6.977 3.673 1.00 0.00 C ATOM 0 H MET A 65 -26.718 -12.660 5.082 1.00 0.00 H new ATOM 0 HA MET A 65 -26.708 -11.953 2.365 1.00 0.00 H new ATOM 0 HB2 MET A 65 -27.896 -10.937 4.480 1.00 0.00 H new ATOM 0 HB3 MET A 65 -26.439 -9.975 4.634 1.00 0.00 H new ATOM 0 HG2 MET A 65 -26.817 -8.826 2.622 1.00 0.00 H new ATOM 0 HG3 MET A 65 -27.875 -10.071 1.987 1.00 0.00 H new ATOM 0 HE1 MET A 65 -29.112 -6.295 4.039 1.00 0.00 H new ATOM 0 HE2 MET A 65 -27.517 -7.006 4.382 1.00 0.00 H new ATOM 0 HE3 MET A 65 -27.981 -6.629 2.706 1.00 0.00 H new ATOM 925 N VAL A 66 -23.912 -11.462 3.939 1.00 0.00 N ATOM 926 CA VAL A 66 -22.518 -11.064 3.783 1.00 0.00 C ATOM 927 C VAL A 66 -21.696 -12.179 3.147 1.00 0.00 C ATOM 928 O VAL A 66 -22.010 -13.360 3.301 1.00 0.00 O ATOM 929 CB VAL A 66 -21.888 -10.683 5.136 1.00 0.00 C ATOM 930 CG1 VAL A 66 -22.727 -9.626 5.837 1.00 0.00 C ATOM 931 CG2 VAL A 66 -21.726 -11.916 6.013 1.00 0.00 C ATOM 0 H VAL A 66 -24.112 -11.967 4.802 1.00 0.00 H new ATOM 0 HA VAL A 66 -22.509 -10.192 3.129 1.00 0.00 H new ATOM 0 HB VAL A 66 -20.899 -10.263 4.952 1.00 0.00 H new ATOM 0 HG11 VAL A 66 -22.266 -9.370 6.791 1.00 0.00 H new ATOM 0 HG12 VAL A 66 -22.787 -8.735 5.212 1.00 0.00 H new ATOM 0 HG13 VAL A 66 -23.730 -10.015 6.011 1.00 0.00 H new ATOM 0 HG21 VAL A 66 -21.280 -11.629 6.965 1.00 0.00 H new ATOM 0 HG22 VAL A 66 -22.702 -12.367 6.191 1.00 0.00 H new ATOM 0 HG23 VAL A 66 -21.080 -12.637 5.512 1.00 0.00 H new ATOM 941 N ILE A 67 -20.642 -11.797 2.434 1.00 0.00 N ATOM 942 CA ILE A 67 -19.773 -12.765 1.777 1.00 0.00 C ATOM 943 C ILE A 67 -19.228 -13.781 2.775 1.00 0.00 C ATOM 944 O ILE A 67 -19.141 -13.507 3.972 1.00 0.00 O ATOM 945 CB ILE A 67 -18.593 -12.074 1.069 1.00 0.00 C ATOM 946 CG1 ILE A 67 -17.957 -11.031 1.991 1.00 0.00 C ATOM 947 CG2 ILE A 67 -19.058 -11.429 -0.228 1.00 0.00 C ATOM 948 CD1 ILE A 67 -16.547 -10.653 1.594 1.00 0.00 C ATOM 0 H ILE A 67 -20.369 -10.824 2.297 1.00 0.00 H new ATOM 0 HA ILE A 67 -20.381 -13.280 1.033 1.00 0.00 H new ATOM 0 HB ILE A 67 -17.841 -12.826 0.829 1.00 0.00 H new ATOM 0 HG12 ILE A 67 -18.577 -10.135 1.995 1.00 0.00 H new ATOM 0 HG13 ILE A 67 -17.948 -11.417 3.010 1.00 0.00 H new ATOM 0 HG21 ILE A 67 -18.213 -10.945 -0.717 1.00 0.00 H new ATOM 0 HG22 ILE A 67 -19.469 -12.193 -0.887 1.00 0.00 H new ATOM 0 HG23 ILE A 67 -19.826 -10.686 -0.010 1.00 0.00 H new ATOM 0 HD11 ILE A 67 -16.159 -9.910 2.291 1.00 0.00 H new ATOM 0 HD12 ILE A 67 -15.912 -11.539 1.618 1.00 0.00 H new ATOM 0 HD13 ILE A 67 -16.552 -10.237 0.586 1.00 0.00 H new ATOM 960 N LYS A 68 -18.859 -14.955 2.274 1.00 0.00 N ATOM 961 CA LYS A 68 -18.318 -16.013 3.120 1.00 0.00 C ATOM 962 C LYS A 68 -17.248 -15.465 4.059 1.00 0.00 C ATOM 963 O LYS A 68 -17.304 -15.675 5.270 1.00 0.00 O ATOM 964 CB LYS A 68 -17.731 -17.133 2.259 1.00 0.00 C ATOM 965 CG LYS A 68 -18.758 -18.159 1.812 1.00 0.00 C ATOM 966 CD LYS A 68 -18.095 -19.428 1.303 1.00 0.00 C ATOM 967 CE LYS A 68 -17.758 -19.326 -0.177 1.00 0.00 C ATOM 968 NZ LYS A 68 -17.073 -20.550 -0.675 1.00 0.00 N ATOM 0 H LYS A 68 -18.925 -15.198 1.286 1.00 0.00 H new ATOM 0 HA LYS A 68 -19.133 -16.415 3.722 1.00 0.00 H new ATOM 0 HB2 LYS A 68 -17.261 -16.695 1.379 1.00 0.00 H new ATOM 0 HB3 LYS A 68 -16.946 -17.638 2.821 1.00 0.00 H new ATOM 0 HG2 LYS A 68 -19.418 -18.401 2.645 1.00 0.00 H new ATOM 0 HG3 LYS A 68 -19.381 -17.733 1.026 1.00 0.00 H new ATOM 0 HD2 LYS A 68 -17.185 -19.618 1.872 1.00 0.00 H new ATOM 0 HD3 LYS A 68 -18.758 -20.278 1.469 1.00 0.00 H new ATOM 0 HE2 LYS A 68 -18.673 -19.164 -0.747 1.00 0.00 H new ATOM 0 HE3 LYS A 68 -17.120 -18.459 -0.345 1.00 0.00 H new ATOM 0 HZ1 LYS A 68 -16.860 -20.441 -1.687 1.00 0.00 H new ATOM 0 HZ2 LYS A 68 -16.187 -20.691 -0.148 1.00 0.00 H new ATOM 0 HZ3 LYS A 68 -17.692 -21.374 -0.538 1.00 0.00 H new ATOM 982 N GLY A 69 -16.274 -14.760 3.491 1.00 0.00 N ATOM 983 CA GLY A 69 -15.205 -14.192 4.293 1.00 0.00 C ATOM 984 C GLY A 69 -15.727 -13.355 5.444 1.00 0.00 C ATOM 985 O GLY A 69 -15.166 -13.378 6.540 1.00 0.00 O ATOM 0 H GLY A 69 -16.206 -14.572 2.491 1.00 0.00 H new ATOM 0 HA2 GLY A 69 -14.583 -14.996 4.685 1.00 0.00 H new ATOM 0 HA3 GLY A 69 -14.567 -13.576 3.659 1.00 0.00 H new ATOM 989 N TRP A 70 -16.800 -12.614 5.196 1.00 0.00 N ATOM 990 CA TRP A 70 -17.396 -11.765 6.221 1.00 0.00 C ATOM 991 C TRP A 70 -17.977 -12.604 7.354 1.00 0.00 C ATOM 992 O TRP A 70 -17.704 -12.353 8.528 1.00 0.00 O ATOM 993 CB TRP A 70 -18.488 -10.883 5.611 1.00 0.00 C ATOM 994 CG TRP A 70 -17.997 -9.527 5.203 1.00 0.00 C ATOM 995 CD1 TRP A 70 -16.883 -9.247 4.465 1.00 0.00 C ATOM 996 CD2 TRP A 70 -18.604 -8.268 5.512 1.00 0.00 C ATOM 997 NE1 TRP A 70 -16.760 -7.889 4.296 1.00 0.00 N ATOM 998 CE2 TRP A 70 -17.804 -7.266 4.928 1.00 0.00 C ATOM 999 CE3 TRP A 70 -19.746 -7.889 6.223 1.00 0.00 C ATOM 1000 CZ2 TRP A 70 -18.111 -5.912 5.036 1.00 0.00 C ATOM 1001 CZ3 TRP A 70 -20.049 -6.545 6.329 1.00 0.00 C ATOM 1002 CH2 TRP A 70 -19.234 -5.570 5.737 1.00 0.00 C ATOM 0 H TRP A 70 -17.276 -12.584 4.294 1.00 0.00 H new ATOM 0 HA TRP A 70 -16.612 -11.129 6.631 1.00 0.00 H new ATOM 0 HB2 TRP A 70 -18.908 -11.387 4.740 1.00 0.00 H new ATOM 0 HB3 TRP A 70 -19.297 -10.767 6.333 1.00 0.00 H new ATOM 0 HD1 TRP A 70 -16.199 -9.985 4.072 1.00 0.00 H new ATOM 0 HE1 TRP A 70 -16.013 -7.421 3.783 1.00 0.00 H new ATOM 0 HE3 TRP A 70 -20.380 -8.633 6.681 1.00 0.00 H new ATOM 0 HZ2 TRP A 70 -17.484 -5.159 4.582 1.00 0.00 H new ATOM 0 HZ3 TRP A 70 -20.928 -6.241 6.877 1.00 0.00 H new ATOM 0 HH2 TRP A 70 -19.499 -4.528 5.837 1.00 0.00 H new ATOM 1013 N ASP A 71 -18.778 -13.601 6.995 1.00 0.00 N ATOM 1014 CA ASP A 71 -19.397 -14.478 7.982 1.00 0.00 C ATOM 1015 C ASP A 71 -18.337 -15.155 8.846 1.00 0.00 C ATOM 1016 O ASP A 71 -18.483 -15.246 10.065 1.00 0.00 O ATOM 1017 CB ASP A 71 -20.259 -15.534 7.288 1.00 0.00 C ATOM 1018 CG ASP A 71 -20.693 -16.638 8.232 1.00 0.00 C ATOM 1019 OD1 ASP A 71 -20.839 -16.361 9.441 1.00 0.00 O ATOM 1020 OD2 ASP A 71 -20.887 -17.779 7.763 1.00 0.00 O ATOM 0 H ASP A 71 -19.014 -13.822 6.028 1.00 0.00 H new ATOM 0 HA ASP A 71 -20.032 -13.870 8.627 1.00 0.00 H new ATOM 0 HB2 ASP A 71 -21.141 -15.056 6.862 1.00 0.00 H new ATOM 0 HB3 ASP A 71 -19.700 -15.968 6.459 1.00 0.00 H new ATOM 1025 N GLU A 72 -17.274 -15.630 8.206 1.00 0.00 N ATOM 1026 CA GLU A 72 -16.191 -16.301 8.916 1.00 0.00 C ATOM 1027 C GLU A 72 -15.482 -15.337 9.863 1.00 0.00 C ATOM 1028 O GLU A 72 -15.028 -15.727 10.938 1.00 0.00 O ATOM 1029 CB GLU A 72 -15.187 -16.889 7.924 1.00 0.00 C ATOM 1030 CG GLU A 72 -15.091 -18.405 7.980 1.00 0.00 C ATOM 1031 CD GLU A 72 -14.481 -18.998 6.725 1.00 0.00 C ATOM 1032 OE1 GLU A 72 -13.387 -18.545 6.326 1.00 0.00 O ATOM 1033 OE2 GLU A 72 -15.097 -19.914 6.142 1.00 0.00 O ATOM 0 H GLU A 72 -17.139 -15.563 7.197 1.00 0.00 H new ATOM 0 HA GLU A 72 -16.624 -17.110 9.505 1.00 0.00 H new ATOM 0 HB2 GLU A 72 -15.468 -16.588 6.915 1.00 0.00 H new ATOM 0 HB3 GLU A 72 -14.203 -16.464 8.121 1.00 0.00 H new ATOM 0 HG2 GLU A 72 -14.492 -18.696 8.843 1.00 0.00 H new ATOM 0 HG3 GLU A 72 -16.087 -18.823 8.128 1.00 0.00 H new ATOM 1040 N GLY A 73 -15.392 -14.075 9.455 1.00 0.00 N ATOM 1041 CA GLY A 73 -14.737 -13.074 10.277 1.00 0.00 C ATOM 1042 C GLY A 73 -15.605 -12.613 11.431 1.00 0.00 C ATOM 1043 O GLY A 73 -15.143 -12.525 12.569 1.00 0.00 O ATOM 0 H GLY A 73 -15.761 -13.728 8.570 1.00 0.00 H new ATOM 0 HA2 GLY A 73 -13.805 -13.482 10.668 1.00 0.00 H new ATOM 0 HA3 GLY A 73 -14.474 -12.216 9.659 1.00 0.00 H new ATOM 1047 N VAL A 74 -16.867 -12.315 11.137 1.00 0.00 N ATOM 1048 CA VAL A 74 -17.802 -11.859 12.159 1.00 0.00 C ATOM 1049 C VAL A 74 -18.144 -12.982 13.131 1.00 0.00 C ATOM 1050 O VAL A 74 -18.554 -12.731 14.264 1.00 0.00 O ATOM 1051 CB VAL A 74 -19.103 -11.325 11.530 1.00 0.00 C ATOM 1052 CG1 VAL A 74 -19.793 -12.414 10.723 1.00 0.00 C ATOM 1053 CG2 VAL A 74 -20.029 -10.780 12.607 1.00 0.00 C ATOM 0 H VAL A 74 -17.265 -12.381 10.200 1.00 0.00 H new ATOM 0 HA VAL A 74 -17.310 -11.051 12.701 1.00 0.00 H new ATOM 0 HB VAL A 74 -18.851 -10.510 10.852 1.00 0.00 H new ATOM 0 HG11 VAL A 74 -20.710 -12.018 10.287 1.00 0.00 H new ATOM 0 HG12 VAL A 74 -19.129 -12.753 9.927 1.00 0.00 H new ATOM 0 HG13 VAL A 74 -20.035 -13.253 11.376 1.00 0.00 H new ATOM 0 HG21 VAL A 74 -20.943 -10.407 12.146 1.00 0.00 H new ATOM 0 HG22 VAL A 74 -20.276 -11.575 13.311 1.00 0.00 H new ATOM 0 HG23 VAL A 74 -19.532 -9.967 13.137 1.00 0.00 H new ATOM 1063 N GLN A 75 -17.972 -14.221 12.681 1.00 0.00 N ATOM 1064 CA GLN A 75 -18.263 -15.383 13.512 1.00 0.00 C ATOM 1065 C GLN A 75 -17.019 -15.836 14.269 1.00 0.00 C ATOM 1066 O GLN A 75 -16.927 -16.983 14.703 1.00 0.00 O ATOM 1067 CB GLN A 75 -18.796 -16.530 12.652 1.00 0.00 C ATOM 1068 CG GLN A 75 -17.711 -17.283 11.900 1.00 0.00 C ATOM 1069 CD GLN A 75 -18.274 -18.298 10.924 1.00 0.00 C ATOM 1070 OE1 GLN A 75 -18.716 -17.946 9.830 1.00 0.00 O ATOM 1071 NE2 GLN A 75 -18.260 -19.566 11.316 1.00 0.00 N ATOM 0 H GLN A 75 -17.633 -14.446 11.746 1.00 0.00 H new ATOM 0 HA GLN A 75 -19.024 -15.098 14.238 1.00 0.00 H new ATOM 0 HB2 GLN A 75 -19.337 -17.230 13.289 1.00 0.00 H new ATOM 0 HB3 GLN A 75 -19.514 -16.132 11.935 1.00 0.00 H new ATOM 0 HG2 GLN A 75 -17.088 -16.571 11.359 1.00 0.00 H new ATOM 0 HG3 GLN A 75 -17.065 -17.792 12.615 1.00 0.00 H new ATOM 0 HE21 GLN A 75 -17.884 -19.813 12.232 1.00 0.00 H new ATOM 0 HE22 GLN A 75 -18.625 -20.294 10.702 1.00 0.00 H new ATOM 1080 N GLY A 76 -16.062 -14.925 14.425 1.00 0.00 N ATOM 1081 CA GLY A 76 -14.836 -15.250 15.130 1.00 0.00 C ATOM 1082 C GLY A 76 -14.344 -14.107 15.996 1.00 0.00 C ATOM 1083 O GLY A 76 -13.838 -14.326 17.096 1.00 0.00 O ATOM 0 H GLY A 76 -16.115 -13.968 14.076 1.00 0.00 H new ATOM 0 HA2 GLY A 76 -15.001 -16.129 15.753 1.00 0.00 H new ATOM 0 HA3 GLY A 76 -14.064 -15.512 14.407 1.00 0.00 H new ATOM 1087 N MET A 77 -14.492 -12.884 15.498 1.00 0.00 N ATOM 1088 CA MET A 77 -14.059 -11.702 16.234 1.00 0.00 C ATOM 1089 C MET A 77 -14.726 -11.640 17.604 1.00 0.00 C ATOM 1090 O MET A 77 -15.707 -12.338 17.860 1.00 0.00 O ATOM 1091 CB MET A 77 -14.378 -10.434 15.440 1.00 0.00 C ATOM 1092 CG MET A 77 -15.862 -10.245 15.168 1.00 0.00 C ATOM 1093 SD MET A 77 -16.311 -8.515 14.936 1.00 0.00 S ATOM 1094 CE MET A 77 -17.515 -8.651 13.617 1.00 0.00 C ATOM 0 H MET A 77 -14.908 -12.686 14.588 1.00 0.00 H new ATOM 0 HA MET A 77 -12.981 -11.769 16.377 1.00 0.00 H new ATOM 0 HB2 MET A 77 -14.004 -9.569 15.987 1.00 0.00 H new ATOM 0 HB3 MET A 77 -13.844 -10.466 14.490 1.00 0.00 H new ATOM 0 HG2 MET A 77 -16.139 -10.811 14.278 1.00 0.00 H new ATOM 0 HG3 MET A 77 -16.435 -10.657 15.999 1.00 0.00 H new ATOM 0 HE1 MET A 77 -17.715 -7.662 13.204 1.00 0.00 H new ATOM 0 HE2 MET A 77 -17.124 -9.300 12.833 1.00 0.00 H new ATOM 0 HE3 MET A 77 -18.440 -9.074 14.010 1.00 0.00 H new ATOM 1104 N LYS A 78 -14.188 -10.800 18.482 1.00 0.00 N ATOM 1105 CA LYS A 78 -14.732 -10.645 19.826 1.00 0.00 C ATOM 1106 C LYS A 78 -14.989 -9.175 20.143 1.00 0.00 C ATOM 1107 O LYS A 78 -14.448 -8.285 19.487 1.00 0.00 O ATOM 1108 CB LYS A 78 -13.771 -11.240 20.858 1.00 0.00 C ATOM 1109 CG LYS A 78 -13.225 -12.602 20.467 1.00 0.00 C ATOM 1110 CD LYS A 78 -12.191 -13.096 21.465 1.00 0.00 C ATOM 1111 CE LYS A 78 -11.356 -14.229 20.888 1.00 0.00 C ATOM 1112 NZ LYS A 78 -10.463 -13.758 19.794 1.00 0.00 N ATOM 0 H LYS A 78 -13.375 -10.216 18.287 1.00 0.00 H new ATOM 0 HA LYS A 78 -15.681 -11.179 19.871 1.00 0.00 H new ATOM 0 HB2 LYS A 78 -12.938 -10.553 21.005 1.00 0.00 H new ATOM 0 HB3 LYS A 78 -14.286 -11.326 21.815 1.00 0.00 H new ATOM 0 HG2 LYS A 78 -14.044 -13.319 20.405 1.00 0.00 H new ATOM 0 HG3 LYS A 78 -12.776 -12.544 19.475 1.00 0.00 H new ATOM 0 HD2 LYS A 78 -11.538 -12.272 21.752 1.00 0.00 H new ATOM 0 HD3 LYS A 78 -12.692 -13.437 22.371 1.00 0.00 H new ATOM 0 HE2 LYS A 78 -10.755 -14.677 21.680 1.00 0.00 H new ATOM 0 HE3 LYS A 78 -12.016 -15.009 20.508 1.00 0.00 H new ATOM 0 HZ1 LYS A 78 -9.690 -14.441 19.658 1.00 0.00 H new ATOM 0 HZ2 LYS A 78 -11.009 -13.673 18.913 1.00 0.00 H new ATOM 0 HZ3 LYS A 78 -10.065 -12.831 20.046 1.00 0.00 H new ATOM 1126 N VAL A 79 -15.817 -8.928 21.153 1.00 0.00 N ATOM 1127 CA VAL A 79 -16.144 -7.567 21.559 1.00 0.00 C ATOM 1128 C VAL A 79 -14.881 -6.759 21.840 1.00 0.00 C ATOM 1129 O VAL A 79 -14.030 -7.172 22.626 1.00 0.00 O ATOM 1130 CB VAL A 79 -17.038 -7.554 22.813 1.00 0.00 C ATOM 1131 CG1 VAL A 79 -17.350 -6.125 23.232 1.00 0.00 C ATOM 1132 CG2 VAL A 79 -18.318 -8.336 22.561 1.00 0.00 C ATOM 0 H VAL A 79 -16.274 -9.654 21.705 1.00 0.00 H new ATOM 0 HA VAL A 79 -16.687 -7.112 20.731 1.00 0.00 H new ATOM 0 HB VAL A 79 -16.499 -8.036 23.628 1.00 0.00 H new ATOM 0 HG11 VAL A 79 -17.983 -6.136 24.120 1.00 0.00 H new ATOM 0 HG12 VAL A 79 -16.421 -5.600 23.455 1.00 0.00 H new ATOM 0 HG13 VAL A 79 -17.870 -5.614 22.422 1.00 0.00 H new ATOM 0 HG21 VAL A 79 -18.938 -8.317 23.457 1.00 0.00 H new ATOM 0 HG22 VAL A 79 -18.863 -7.884 21.732 1.00 0.00 H new ATOM 0 HG23 VAL A 79 -18.071 -9.368 22.313 1.00 0.00 H new ATOM 1142 N GLY A 80 -14.768 -5.604 21.191 1.00 0.00 N ATOM 1143 CA GLY A 80 -13.606 -4.756 21.385 1.00 0.00 C ATOM 1144 C GLY A 80 -12.433 -5.173 20.521 1.00 0.00 C ATOM 1145 O GLY A 80 -11.384 -4.530 20.533 1.00 0.00 O ATOM 0 H GLY A 80 -15.460 -5.241 20.535 1.00 0.00 H new ATOM 0 HA2 GLY A 80 -13.872 -3.724 21.158 1.00 0.00 H new ATOM 0 HA3 GLY A 80 -13.310 -4.786 22.433 1.00 0.00 H new ATOM 1149 N GLY A 81 -12.609 -6.256 19.769 1.00 0.00 N ATOM 1150 CA GLY A 81 -11.547 -6.741 18.907 1.00 0.00 C ATOM 1151 C GLY A 81 -11.531 -6.046 17.560 1.00 0.00 C ATOM 1152 O GLY A 81 -12.526 -6.056 16.836 1.00 0.00 O ATOM 0 H GLY A 81 -13.468 -6.806 19.742 1.00 0.00 H new ATOM 0 HA2 GLY A 81 -10.586 -6.593 19.400 1.00 0.00 H new ATOM 0 HA3 GLY A 81 -11.666 -7.814 18.757 1.00 0.00 H new ATOM 1156 N VAL A 82 -10.397 -5.439 17.222 1.00 0.00 N ATOM 1157 CA VAL A 82 -10.255 -4.735 15.953 1.00 0.00 C ATOM 1158 C VAL A 82 -9.057 -5.256 15.167 1.00 0.00 C ATOM 1159 O VAL A 82 -7.917 -5.166 15.622 1.00 0.00 O ATOM 1160 CB VAL A 82 -10.095 -3.219 16.167 1.00 0.00 C ATOM 1161 CG1 VAL A 82 -9.985 -2.499 14.832 1.00 0.00 C ATOM 1162 CG2 VAL A 82 -11.256 -2.671 16.983 1.00 0.00 C ATOM 0 H VAL A 82 -9.564 -5.421 17.810 1.00 0.00 H new ATOM 0 HA VAL A 82 -11.167 -4.919 15.385 1.00 0.00 H new ATOM 0 HB VAL A 82 -9.174 -3.044 16.724 1.00 0.00 H new ATOM 0 HG11 VAL A 82 -9.873 -1.429 15.004 1.00 0.00 H new ATOM 0 HG12 VAL A 82 -9.117 -2.872 14.288 1.00 0.00 H new ATOM 0 HG13 VAL A 82 -10.886 -2.680 14.246 1.00 0.00 H new ATOM 0 HG21 VAL A 82 -11.127 -1.598 17.125 1.00 0.00 H new ATOM 0 HG22 VAL A 82 -12.191 -2.857 16.455 1.00 0.00 H new ATOM 0 HG23 VAL A 82 -11.283 -3.165 17.954 1.00 0.00 H new ATOM 1172 N ARG A 83 -9.324 -5.800 13.984 1.00 0.00 N ATOM 1173 CA ARG A 83 -8.267 -6.336 13.134 1.00 0.00 C ATOM 1174 C ARG A 83 -8.690 -6.321 11.668 1.00 0.00 C ATOM 1175 O ARG A 83 -9.872 -6.450 11.351 1.00 0.00 O ATOM 1176 CB ARG A 83 -7.915 -7.762 13.561 1.00 0.00 C ATOM 1177 CG ARG A 83 -9.116 -8.689 13.638 1.00 0.00 C ATOM 1178 CD ARG A 83 -8.691 -10.148 13.700 1.00 0.00 C ATOM 1179 NE ARG A 83 -9.611 -10.953 14.499 1.00 0.00 N ATOM 1180 CZ ARG A 83 -9.592 -10.990 15.827 1.00 0.00 C ATOM 1181 NH1 ARG A 83 -8.704 -10.272 16.501 1.00 0.00 N ATOM 1182 NH2 ARG A 83 -10.462 -11.747 16.483 1.00 0.00 N ATOM 0 H ARG A 83 -10.262 -5.881 13.593 1.00 0.00 H new ATOM 0 HA ARG A 83 -7.387 -5.703 13.247 1.00 0.00 H new ATOM 0 HB2 ARG A 83 -7.193 -8.175 12.857 1.00 0.00 H new ATOM 0 HB3 ARG A 83 -7.428 -7.731 14.536 1.00 0.00 H new ATOM 0 HG2 ARG A 83 -9.710 -8.444 14.519 1.00 0.00 H new ATOM 0 HG3 ARG A 83 -9.755 -8.532 12.769 1.00 0.00 H new ATOM 0 HD2 ARG A 83 -8.639 -10.553 12.690 1.00 0.00 H new ATOM 0 HD3 ARG A 83 -7.689 -10.216 14.123 1.00 0.00 H new ATOM 0 HE ARG A 83 -10.306 -11.518 14.011 1.00 0.00 H new ATOM 0 HH11 ARG A 83 -8.033 -9.689 16.000 1.00 0.00 H new ATOM 0 HH12 ARG A 83 -8.692 -10.302 17.520 1.00 0.00 H new ATOM 0 HH21 ARG A 83 -11.146 -12.301 15.968 1.00 0.00 H new ATOM 0 HH22 ARG A 83 -10.447 -11.775 17.503 1.00 0.00 H new ATOM 1196 N ARG A 84 -7.715 -6.163 10.778 1.00 0.00 N ATOM 1197 CA ARG A 84 -7.985 -6.131 9.346 1.00 0.00 C ATOM 1198 C ARG A 84 -7.801 -7.512 8.726 1.00 0.00 C ATOM 1199 O ARG A 84 -6.714 -8.090 8.782 1.00 0.00 O ATOM 1200 CB ARG A 84 -7.066 -5.122 8.655 1.00 0.00 C ATOM 1201 CG ARG A 84 -5.599 -5.290 9.015 1.00 0.00 C ATOM 1202 CD ARG A 84 -4.718 -4.341 8.217 1.00 0.00 C ATOM 1203 NE ARG A 84 -3.298 -4.562 8.479 1.00 0.00 N ATOM 1204 CZ ARG A 84 -2.325 -3.896 7.866 1.00 0.00 C ATOM 1205 NH1 ARG A 84 -2.618 -2.973 6.961 1.00 0.00 N ATOM 1206 NH2 ARG A 84 -1.057 -4.154 8.159 1.00 0.00 N ATOM 0 H ARG A 84 -6.731 -6.055 11.024 1.00 0.00 H new ATOM 0 HA ARG A 84 -9.021 -5.825 9.204 1.00 0.00 H new ATOM 0 HB2 ARG A 84 -7.180 -5.219 7.575 1.00 0.00 H new ATOM 0 HB3 ARG A 84 -7.383 -4.113 8.920 1.00 0.00 H new ATOM 0 HG2 ARG A 84 -5.461 -5.107 10.081 1.00 0.00 H new ATOM 0 HG3 ARG A 84 -5.292 -6.319 8.826 1.00 0.00 H new ATOM 0 HD2 ARG A 84 -4.915 -4.472 7.153 1.00 0.00 H new ATOM 0 HD3 ARG A 84 -4.976 -3.312 8.465 1.00 0.00 H new ATOM 0 HE ARG A 84 -3.039 -5.266 9.170 1.00 0.00 H new ATOM 0 HH11 ARG A 84 -3.592 -2.773 6.734 1.00 0.00 H new ATOM 0 HH12 ARG A 84 -1.870 -2.463 6.492 1.00 0.00 H new ATOM 0 HH21 ARG A 84 -0.829 -4.864 8.855 1.00 0.00 H new ATOM 0 HH22 ARG A 84 -0.311 -3.643 7.688 1.00 0.00 H new ATOM 1220 N LEU A 85 -8.869 -8.038 8.136 1.00 0.00 N ATOM 1221 CA LEU A 85 -8.825 -9.353 7.506 1.00 0.00 C ATOM 1222 C LEU A 85 -8.924 -9.233 5.988 1.00 0.00 C ATOM 1223 O LEU A 85 -9.756 -8.490 5.466 1.00 0.00 O ATOM 1224 CB LEU A 85 -9.960 -10.232 8.034 1.00 0.00 C ATOM 1225 CG LEU A 85 -10.105 -10.298 9.555 1.00 0.00 C ATOM 1226 CD1 LEU A 85 -11.008 -9.182 10.055 1.00 0.00 C ATOM 1227 CD2 LEU A 85 -10.646 -11.655 9.980 1.00 0.00 C ATOM 0 H LEU A 85 -9.776 -7.574 8.081 1.00 0.00 H new ATOM 0 HA LEU A 85 -7.870 -9.816 7.754 1.00 0.00 H new ATOM 0 HB2 LEU A 85 -10.899 -9.870 7.615 1.00 0.00 H new ATOM 0 HB3 LEU A 85 -9.813 -11.245 7.659 1.00 0.00 H new ATOM 0 HG LEU A 85 -9.119 -10.166 10.001 1.00 0.00 H new ATOM 0 HD11 LEU A 85 -11.099 -9.246 11.139 1.00 0.00 H new ATOM 0 HD12 LEU A 85 -10.579 -8.218 9.783 1.00 0.00 H new ATOM 0 HD13 LEU A 85 -11.994 -9.281 9.602 1.00 0.00 H new ATOM 0 HD21 LEU A 85 -10.743 -11.684 11.065 1.00 0.00 H new ATOM 0 HD22 LEU A 85 -11.623 -11.816 9.524 1.00 0.00 H new ATOM 0 HD23 LEU A 85 -9.960 -12.438 9.656 1.00 0.00 H new ATOM 1239 N THR A 86 -8.071 -9.971 5.284 1.00 0.00 N ATOM 1240 CA THR A 86 -8.063 -9.948 3.827 1.00 0.00 C ATOM 1241 C THR A 86 -8.926 -11.067 3.255 1.00 0.00 C ATOM 1242 O THR A 86 -8.573 -12.243 3.346 1.00 0.00 O ATOM 1243 CB THR A 86 -6.633 -10.082 3.271 1.00 0.00 C ATOM 1244 OG1 THR A 86 -5.688 -9.579 4.223 1.00 0.00 O ATOM 1245 CG2 THR A 86 -6.489 -9.327 1.959 1.00 0.00 C ATOM 0 H THR A 86 -7.377 -10.592 5.700 1.00 0.00 H new ATOM 0 HA THR A 86 -8.474 -8.985 3.524 1.00 0.00 H new ATOM 0 HB THR A 86 -6.436 -11.138 3.087 1.00 0.00 H new ATOM 0 HG1 THR A 86 -4.779 -9.784 3.921 1.00 0.00 H new ATOM 0 HG21 THR A 86 -5.471 -9.436 1.586 1.00 0.00 H new ATOM 0 HG22 THR A 86 -7.189 -9.732 1.228 1.00 0.00 H new ATOM 0 HG23 THR A 86 -6.704 -8.271 2.121 1.00 0.00 H new ATOM 1253 N ILE A 87 -10.056 -10.693 2.665 1.00 0.00 N ATOM 1254 CA ILE A 87 -10.968 -11.667 2.077 1.00 0.00 C ATOM 1255 C ILE A 87 -10.741 -11.794 0.574 1.00 0.00 C ATOM 1256 O ILE A 87 -10.892 -10.836 -0.185 1.00 0.00 O ATOM 1257 CB ILE A 87 -12.438 -11.287 2.332 1.00 0.00 C ATOM 1258 CG1 ILE A 87 -12.730 -11.272 3.834 1.00 0.00 C ATOM 1259 CG2 ILE A 87 -13.367 -12.256 1.616 1.00 0.00 C ATOM 1260 CD1 ILE A 87 -13.628 -10.132 4.264 1.00 0.00 C ATOM 0 H ILE A 87 -10.362 -9.724 2.581 1.00 0.00 H new ATOM 0 HA ILE A 87 -10.760 -12.624 2.556 1.00 0.00 H new ATOM 0 HB ILE A 87 -12.614 -10.287 1.937 1.00 0.00 H new ATOM 0 HG12 ILE A 87 -13.196 -12.217 4.115 1.00 0.00 H new ATOM 0 HG13 ILE A 87 -11.788 -11.207 4.378 1.00 0.00 H new ATOM 0 HG21 ILE A 87 -14.403 -11.974 1.806 1.00 0.00 H new ATOM 0 HG22 ILE A 87 -13.172 -12.222 0.544 1.00 0.00 H new ATOM 0 HG23 ILE A 87 -13.193 -13.267 1.985 1.00 0.00 H new ATOM 0 HD11 ILE A 87 -13.792 -10.184 5.340 1.00 0.00 H new ATOM 0 HD12 ILE A 87 -13.155 -9.182 4.015 1.00 0.00 H new ATOM 0 HD13 ILE A 87 -14.585 -10.207 3.747 1.00 0.00 H new ATOM 1272 N PRO A 88 -10.371 -13.005 0.132 1.00 0.00 N ATOM 1273 CA PRO A 88 -10.118 -13.287 -1.284 1.00 0.00 C ATOM 1274 C PRO A 88 -11.395 -13.265 -2.117 1.00 0.00 C ATOM 1275 O PRO A 88 -12.507 -13.201 -1.592 1.00 0.00 O ATOM 1276 CB PRO A 88 -9.518 -14.695 -1.264 1.00 0.00 C ATOM 1277 CG PRO A 88 -10.044 -15.313 -0.014 1.00 0.00 C ATOM 1278 CD PRO A 88 -10.172 -14.192 0.980 1.00 0.00 C ATOM 0 HA PRO A 88 -9.469 -12.538 -1.738 1.00 0.00 H new ATOM 0 HB2 PRO A 88 -9.817 -15.265 -2.144 1.00 0.00 H new ATOM 0 HB3 PRO A 88 -8.429 -14.661 -1.261 1.00 0.00 H new ATOM 0 HG2 PRO A 88 -11.008 -15.790 -0.190 1.00 0.00 H new ATOM 0 HG3 PRO A 88 -9.368 -16.085 0.354 1.00 0.00 H new ATOM 0 HD2 PRO A 88 -11.013 -14.348 1.656 1.00 0.00 H new ATOM 0 HD3 PRO A 88 -9.279 -14.099 1.598 1.00 0.00 H new ATOM 1286 N PRO A 89 -11.236 -13.318 -3.448 1.00 0.00 N ATOM 1287 CA PRO A 89 -12.366 -13.306 -4.382 1.00 0.00 C ATOM 1288 C PRO A 89 -13.175 -14.597 -4.328 1.00 0.00 C ATOM 1289 O PRO A 89 -14.397 -14.581 -4.475 1.00 0.00 O ATOM 1290 CB PRO A 89 -11.695 -13.152 -5.749 1.00 0.00 C ATOM 1291 CG PRO A 89 -10.325 -13.707 -5.563 1.00 0.00 C ATOM 1292 CD PRO A 89 -9.940 -13.395 -4.144 1.00 0.00 C ATOM 0 HA PRO A 89 -13.078 -12.514 -4.150 1.00 0.00 H new ATOM 0 HB2 PRO A 89 -12.240 -13.695 -6.521 1.00 0.00 H new ATOM 0 HB3 PRO A 89 -11.660 -12.107 -6.058 1.00 0.00 H new ATOM 0 HG2 PRO A 89 -10.312 -14.782 -5.743 1.00 0.00 H new ATOM 0 HG3 PRO A 89 -9.623 -13.257 -6.265 1.00 0.00 H new ATOM 0 HD2 PRO A 89 -9.302 -14.171 -3.721 1.00 0.00 H new ATOM 0 HD3 PRO A 89 -9.390 -12.457 -4.074 1.00 0.00 H new ATOM 1300 N GLN A 90 -12.486 -15.714 -4.117 1.00 0.00 N ATOM 1301 CA GLN A 90 -13.143 -17.014 -4.045 1.00 0.00 C ATOM 1302 C GLN A 90 -14.047 -17.100 -2.819 1.00 0.00 C ATOM 1303 O GLN A 90 -14.850 -18.025 -2.691 1.00 0.00 O ATOM 1304 CB GLN A 90 -12.101 -18.134 -4.004 1.00 0.00 C ATOM 1305 CG GLN A 90 -11.187 -18.071 -2.791 1.00 0.00 C ATOM 1306 CD GLN A 90 -9.909 -18.863 -2.981 1.00 0.00 C ATOM 1307 OE1 GLN A 90 -9.101 -18.560 -3.860 1.00 0.00 O ATOM 1308 NE2 GLN A 90 -9.718 -19.886 -2.156 1.00 0.00 N ATOM 0 H GLN A 90 -11.474 -15.745 -3.993 1.00 0.00 H new ATOM 0 HA GLN A 90 -13.758 -17.132 -4.937 1.00 0.00 H new ATOM 0 HB2 GLN A 90 -12.613 -19.096 -4.013 1.00 0.00 H new ATOM 0 HB3 GLN A 90 -11.494 -18.088 -4.908 1.00 0.00 H new ATOM 0 HG2 GLN A 90 -10.937 -17.031 -2.583 1.00 0.00 H new ATOM 0 HG3 GLN A 90 -11.720 -18.452 -1.920 1.00 0.00 H new ATOM 0 HE21 GLN A 90 -10.413 -20.102 -1.442 1.00 0.00 H new ATOM 0 HE22 GLN A 90 -8.876 -20.456 -2.237 1.00 0.00 H new ATOM 1317 N LEU A 91 -13.910 -16.131 -1.921 1.00 0.00 N ATOM 1318 CA LEU A 91 -14.715 -16.097 -0.704 1.00 0.00 C ATOM 1319 C LEU A 91 -15.419 -14.752 -0.555 1.00 0.00 C ATOM 1320 O LEU A 91 -16.007 -14.460 0.486 1.00 0.00 O ATOM 1321 CB LEU A 91 -13.836 -16.365 0.519 1.00 0.00 C ATOM 1322 CG LEU A 91 -12.922 -17.587 0.435 1.00 0.00 C ATOM 1323 CD1 LEU A 91 -12.284 -17.871 1.785 1.00 0.00 C ATOM 1324 CD2 LEU A 91 -13.699 -18.801 -0.055 1.00 0.00 C ATOM 0 H LEU A 91 -13.250 -15.359 -2.012 1.00 0.00 H new ATOM 0 HA LEU A 91 -15.473 -16.877 -0.776 1.00 0.00 H new ATOM 0 HB2 LEU A 91 -13.217 -15.485 0.696 1.00 0.00 H new ATOM 0 HB3 LEU A 91 -14.483 -16.480 1.388 1.00 0.00 H new ATOM 0 HG LEU A 91 -12.128 -17.374 -0.281 1.00 0.00 H new ATOM 0 HD11 LEU A 91 -11.637 -18.744 1.705 1.00 0.00 H new ATOM 0 HD12 LEU A 91 -11.694 -17.009 2.097 1.00 0.00 H new ATOM 0 HD13 LEU A 91 -13.063 -18.063 2.523 1.00 0.00 H new ATOM 0 HD21 LEU A 91 -13.033 -19.662 -0.109 1.00 0.00 H new ATOM 0 HD22 LEU A 91 -14.514 -19.015 0.637 1.00 0.00 H new ATOM 0 HD23 LEU A 91 -14.108 -18.596 -1.044 1.00 0.00 H new ATOM 1336 N GLY A 92 -15.357 -13.937 -1.604 1.00 0.00 N ATOM 1337 CA GLY A 92 -15.994 -12.634 -1.569 1.00 0.00 C ATOM 1338 C GLY A 92 -16.558 -12.229 -2.917 1.00 0.00 C ATOM 1339 O GLY A 92 -17.665 -12.627 -3.279 1.00 0.00 O ATOM 0 H GLY A 92 -14.877 -14.156 -2.477 1.00 0.00 H new ATOM 0 HA2 GLY A 92 -16.796 -12.645 -0.831 1.00 0.00 H new ATOM 0 HA3 GLY A 92 -15.270 -11.888 -1.242 1.00 0.00 H new ATOM 1343 N TYR A 93 -15.797 -11.434 -3.660 1.00 0.00 N ATOM 1344 CA TYR A 93 -16.228 -10.971 -4.973 1.00 0.00 C ATOM 1345 C TYR A 93 -16.202 -12.110 -5.988 1.00 0.00 C ATOM 1346 O TYR A 93 -17.241 -12.523 -6.502 1.00 0.00 O ATOM 1347 CB TYR A 93 -15.335 -9.825 -5.452 1.00 0.00 C ATOM 1348 CG TYR A 93 -15.793 -8.463 -4.981 1.00 0.00 C ATOM 1349 CD1 TYR A 93 -16.459 -8.312 -3.771 1.00 0.00 C ATOM 1350 CD2 TYR A 93 -15.557 -7.327 -5.746 1.00 0.00 C ATOM 1351 CE1 TYR A 93 -16.879 -7.070 -3.337 1.00 0.00 C ATOM 1352 CE2 TYR A 93 -15.972 -6.080 -5.319 1.00 0.00 C ATOM 1353 CZ TYR A 93 -16.633 -5.957 -4.114 1.00 0.00 C ATOM 1354 OH TYR A 93 -17.049 -4.718 -3.685 1.00 0.00 O ATOM 0 H TYR A 93 -14.878 -11.096 -3.375 1.00 0.00 H new ATOM 0 HA TYR A 93 -17.253 -10.611 -4.884 1.00 0.00 H new ATOM 0 HB2 TYR A 93 -14.317 -9.998 -5.102 1.00 0.00 H new ATOM 0 HB3 TYR A 93 -15.303 -9.832 -6.542 1.00 0.00 H new ATOM 0 HD1 TYR A 93 -16.652 -9.181 -3.159 1.00 0.00 H new ATOM 0 HD2 TYR A 93 -15.041 -7.420 -6.690 1.00 0.00 H new ATOM 0 HE1 TYR A 93 -17.397 -6.971 -2.395 1.00 0.00 H new ATOM 0 HE2 TYR A 93 -15.780 -5.207 -5.925 1.00 0.00 H new ATOM 0 HH TYR A 93 -17.992 -4.762 -3.422 1.00 0.00 H new ATOM 1364 N GLY A 94 -15.005 -12.614 -6.271 1.00 0.00 N ATOM 1365 CA GLY A 94 -14.864 -13.701 -7.223 1.00 0.00 C ATOM 1366 C GLY A 94 -14.146 -13.274 -8.488 1.00 0.00 C ATOM 1367 O GLY A 94 -13.554 -12.197 -8.540 1.00 0.00 O ATOM 0 H GLY A 94 -14.130 -12.289 -5.858 1.00 0.00 H new ATOM 0 HA2 GLY A 94 -14.316 -14.520 -6.757 1.00 0.00 H new ATOM 0 HA3 GLY A 94 -15.851 -14.084 -7.481 1.00 0.00 H new ATOM 1371 N ALA A 95 -14.198 -14.122 -9.510 1.00 0.00 N ATOM 1372 CA ALA A 95 -13.548 -13.827 -10.781 1.00 0.00 C ATOM 1373 C ALA A 95 -14.440 -12.963 -11.666 1.00 0.00 C ATOM 1374 O ALA A 95 -14.095 -12.667 -12.810 1.00 0.00 O ATOM 1375 CB ALA A 95 -13.181 -15.118 -11.498 1.00 0.00 C ATOM 0 H ALA A 95 -14.683 -15.019 -9.483 1.00 0.00 H new ATOM 0 HA ALA A 95 -12.636 -13.268 -10.573 1.00 0.00 H new ATOM 0 HB1 ALA A 95 -12.696 -14.883 -12.446 1.00 0.00 H new ATOM 0 HB2 ALA A 95 -12.499 -15.698 -10.876 1.00 0.00 H new ATOM 0 HB3 ALA A 95 -14.084 -15.699 -11.687 1.00 0.00 H new ATOM 1381 N ARG A 96 -15.589 -12.563 -11.130 1.00 0.00 N ATOM 1382 CA ARG A 96 -16.531 -11.735 -11.872 1.00 0.00 C ATOM 1383 C ARG A 96 -15.930 -10.366 -12.175 1.00 0.00 C ATOM 1384 O ARG A 96 -16.258 -9.742 -13.184 1.00 0.00 O ATOM 1385 CB ARG A 96 -17.830 -11.570 -11.082 1.00 0.00 C ATOM 1386 CG ARG A 96 -18.964 -10.965 -11.894 1.00 0.00 C ATOM 1387 CD ARG A 96 -19.343 -11.852 -13.069 1.00 0.00 C ATOM 1388 NE ARG A 96 -19.518 -13.246 -12.668 1.00 0.00 N ATOM 1389 CZ ARG A 96 -20.554 -13.683 -11.961 1.00 0.00 C ATOM 1390 NH1 ARG A 96 -21.503 -12.840 -11.579 1.00 0.00 N ATOM 1391 NH2 ARG A 96 -20.642 -14.967 -11.635 1.00 0.00 N ATOM 0 H ARG A 96 -15.889 -12.799 -10.184 1.00 0.00 H new ATOM 0 HA ARG A 96 -16.749 -12.234 -12.816 1.00 0.00 H new ATOM 0 HB2 ARG A 96 -18.143 -12.544 -10.706 1.00 0.00 H new ATOM 0 HB3 ARG A 96 -17.640 -10.939 -10.214 1.00 0.00 H new ATOM 0 HG2 ARG A 96 -19.833 -10.817 -11.253 1.00 0.00 H new ATOM 0 HG3 ARG A 96 -18.667 -9.982 -12.260 1.00 0.00 H new ATOM 0 HD2 ARG A 96 -20.266 -11.485 -13.517 1.00 0.00 H new ATOM 0 HD3 ARG A 96 -18.570 -11.789 -13.835 1.00 0.00 H new ATOM 0 HE ARG A 96 -18.805 -13.921 -12.946 1.00 0.00 H new ATOM 0 HH11 ARG A 96 -21.439 -11.853 -11.828 1.00 0.00 H new ATOM 0 HH12 ARG A 96 -22.297 -13.178 -11.036 1.00 0.00 H new ATOM 0 HH21 ARG A 96 -19.914 -15.619 -11.927 1.00 0.00 H new ATOM 0 HH22 ARG A 96 -21.438 -15.302 -11.092 1.00 0.00 H new ATOM 1405 N GLY A 97 -15.048 -9.904 -11.294 1.00 0.00 N ATOM 1406 CA GLY A 97 -14.416 -8.612 -11.484 1.00 0.00 C ATOM 1407 C GLY A 97 -15.359 -7.458 -11.208 1.00 0.00 C ATOM 1408 O GLY A 97 -16.558 -7.551 -11.472 1.00 0.00 O ATOM 0 H GLY A 97 -14.760 -10.402 -10.452 1.00 0.00 H new ATOM 0 HA2 GLY A 97 -13.550 -8.535 -10.826 1.00 0.00 H new ATOM 0 HA3 GLY A 97 -14.047 -8.539 -12.507 1.00 0.00 H new ATOM 1412 N ALA A 98 -14.818 -6.369 -10.672 1.00 0.00 N ATOM 1413 CA ALA A 98 -15.620 -5.192 -10.360 1.00 0.00 C ATOM 1414 C ALA A 98 -15.179 -3.991 -11.188 1.00 0.00 C ATOM 1415 O ALA A 98 -15.942 -3.046 -11.386 1.00 0.00 O ATOM 1416 CB ALA A 98 -15.533 -4.873 -8.875 1.00 0.00 C ATOM 0 H ALA A 98 -13.828 -6.277 -10.445 1.00 0.00 H new ATOM 0 HA ALA A 98 -16.657 -5.412 -10.613 1.00 0.00 H new ATOM 0 HB1 ALA A 98 -16.136 -3.992 -8.656 1.00 0.00 H new ATOM 0 HB2 ALA A 98 -15.905 -5.720 -8.299 1.00 0.00 H new ATOM 0 HB3 ALA A 98 -14.495 -4.678 -8.605 1.00 0.00 H new ATOM 1422 N GLY A 99 -13.940 -4.033 -11.670 1.00 0.00 N ATOM 1423 CA GLY A 99 -13.418 -2.941 -12.471 1.00 0.00 C ATOM 1424 C GLY A 99 -12.122 -3.302 -13.169 1.00 0.00 C ATOM 1425 O GLY A 99 -11.629 -4.422 -13.039 1.00 0.00 O ATOM 0 H GLY A 99 -13.289 -4.804 -11.520 1.00 0.00 H new ATOM 0 HA2 GLY A 99 -14.160 -2.654 -13.216 1.00 0.00 H new ATOM 0 HA3 GLY A 99 -13.254 -2.073 -11.833 1.00 0.00 H new ATOM 1429 N GLY A 100 -11.568 -2.351 -13.915 1.00 0.00 N ATOM 1430 CA GLY A 100 -10.328 -2.595 -14.628 1.00 0.00 C ATOM 1431 C GLY A 100 -9.179 -2.925 -13.695 1.00 0.00 C ATOM 1432 O GLY A 100 -8.469 -3.910 -13.897 1.00 0.00 O ATOM 0 H GLY A 100 -11.956 -1.416 -14.038 1.00 0.00 H new ATOM 0 HA2 GLY A 100 -10.471 -3.418 -15.329 1.00 0.00 H new ATOM 0 HA3 GLY A 100 -10.072 -1.715 -15.218 1.00 0.00 H new ATOM 1436 N VAL A 101 -8.994 -2.098 -12.671 1.00 0.00 N ATOM 1437 CA VAL A 101 -7.923 -2.307 -11.704 1.00 0.00 C ATOM 1438 C VAL A 101 -8.248 -3.462 -10.765 1.00 0.00 C ATOM 1439 O VAL A 101 -7.411 -3.878 -9.963 1.00 0.00 O ATOM 1440 CB VAL A 101 -7.665 -1.038 -10.870 1.00 0.00 C ATOM 1441 CG1 VAL A 101 -7.101 0.071 -11.745 1.00 0.00 C ATOM 1442 CG2 VAL A 101 -8.943 -0.586 -10.179 1.00 0.00 C ATOM 0 H VAL A 101 -9.572 -1.277 -12.490 1.00 0.00 H new ATOM 0 HA VAL A 101 -7.025 -2.548 -12.273 1.00 0.00 H new ATOM 0 HB VAL A 101 -6.927 -1.272 -10.102 1.00 0.00 H new ATOM 0 HG11 VAL A 101 -6.925 0.959 -11.138 1.00 0.00 H new ATOM 0 HG12 VAL A 101 -6.161 -0.258 -12.188 1.00 0.00 H new ATOM 0 HG13 VAL A 101 -7.812 0.307 -12.537 1.00 0.00 H new ATOM 0 HG21 VAL A 101 -8.742 0.312 -9.594 1.00 0.00 H new ATOM 0 HG22 VAL A 101 -9.704 -0.369 -10.928 1.00 0.00 H new ATOM 0 HG23 VAL A 101 -9.299 -1.377 -9.519 1.00 0.00 H new ATOM 1452 N ILE A 102 -9.468 -3.977 -10.870 1.00 0.00 N ATOM 1453 CA ILE A 102 -9.904 -5.087 -10.030 1.00 0.00 C ATOM 1454 C ILE A 102 -10.026 -6.373 -10.839 1.00 0.00 C ATOM 1455 O ILE A 102 -11.082 -6.696 -11.383 1.00 0.00 O ATOM 1456 CB ILE A 102 -11.256 -4.786 -9.357 1.00 0.00 C ATOM 1457 CG1 ILE A 102 -11.144 -3.546 -8.469 1.00 0.00 C ATOM 1458 CG2 ILE A 102 -11.721 -5.986 -8.545 1.00 0.00 C ATOM 1459 CD1 ILE A 102 -12.457 -3.130 -7.844 1.00 0.00 C ATOM 0 H ILE A 102 -10.173 -3.644 -11.528 1.00 0.00 H new ATOM 0 HA ILE A 102 -9.145 -5.217 -9.259 1.00 0.00 H new ATOM 0 HB ILE A 102 -11.996 -4.588 -10.133 1.00 0.00 H new ATOM 0 HG12 ILE A 102 -10.420 -3.740 -7.678 1.00 0.00 H new ATOM 0 HG13 ILE A 102 -10.755 -2.718 -9.062 1.00 0.00 H new ATOM 0 HG21 ILE A 102 -12.678 -5.759 -8.075 1.00 0.00 H new ATOM 0 HG22 ILE A 102 -11.835 -6.848 -9.202 1.00 0.00 H new ATOM 0 HG23 ILE A 102 -10.983 -6.212 -7.775 1.00 0.00 H new ATOM 0 HD11 ILE A 102 -12.302 -2.244 -7.228 1.00 0.00 H new ATOM 0 HD12 ILE A 102 -13.178 -2.904 -8.629 1.00 0.00 H new ATOM 0 HD13 ILE A 102 -12.838 -3.941 -7.224 1.00 0.00 H new ATOM 1471 N PRO A 103 -8.920 -7.128 -10.920 1.00 0.00 N ATOM 1472 CA PRO A 103 -8.878 -8.394 -11.659 1.00 0.00 C ATOM 1473 C PRO A 103 -9.694 -9.489 -10.980 1.00 0.00 C ATOM 1474 O PRO A 103 -10.110 -9.362 -9.828 1.00 0.00 O ATOM 1475 CB PRO A 103 -7.391 -8.757 -11.656 1.00 0.00 C ATOM 1476 CG PRO A 103 -6.836 -8.075 -10.453 1.00 0.00 C ATOM 1477 CD PRO A 103 -7.626 -6.805 -10.296 1.00 0.00 C ATOM 0 HA PRO A 103 -9.306 -8.298 -12.657 1.00 0.00 H new ATOM 0 HB2 PRO A 103 -7.247 -9.836 -11.601 1.00 0.00 H new ATOM 0 HB3 PRO A 103 -6.899 -8.416 -12.567 1.00 0.00 H new ATOM 0 HG2 PRO A 103 -6.930 -8.705 -9.569 1.00 0.00 H new ATOM 0 HG3 PRO A 103 -5.775 -7.861 -10.580 1.00 0.00 H new ATOM 0 HD2 PRO A 103 -7.743 -6.532 -9.247 1.00 0.00 H new ATOM 0 HD3 PRO A 103 -7.139 -5.965 -10.792 1.00 0.00 H new ATOM 1485 N PRO A 104 -9.929 -10.590 -11.708 1.00 0.00 N ATOM 1486 CA PRO A 104 -10.697 -11.729 -11.195 1.00 0.00 C ATOM 1487 C PRO A 104 -9.948 -12.490 -10.106 1.00 0.00 C ATOM 1488 O PRO A 104 -10.507 -13.372 -9.456 1.00 0.00 O ATOM 1489 CB PRO A 104 -10.888 -12.613 -12.430 1.00 0.00 C ATOM 1490 CG PRO A 104 -9.747 -12.267 -13.324 1.00 0.00 C ATOM 1491 CD PRO A 104 -9.464 -10.809 -13.087 1.00 0.00 C ATOM 0 HA PRO A 104 -11.631 -11.414 -10.730 1.00 0.00 H new ATOM 0 HB2 PRO A 104 -10.877 -13.670 -12.165 1.00 0.00 H new ATOM 0 HB3 PRO A 104 -11.844 -12.415 -12.914 1.00 0.00 H new ATOM 0 HG2 PRO A 104 -8.873 -12.877 -13.095 1.00 0.00 H new ATOM 0 HG3 PRO A 104 -9.999 -12.451 -14.368 1.00 0.00 H new ATOM 0 HD2 PRO A 104 -8.403 -10.583 -13.194 1.00 0.00 H new ATOM 0 HD3 PRO A 104 -9.997 -10.176 -13.796 1.00 0.00 H new ATOM 1499 N ASN A 105 -8.680 -12.141 -9.912 1.00 0.00 N ATOM 1500 CA ASN A 105 -7.855 -12.792 -8.901 1.00 0.00 C ATOM 1501 C ASN A 105 -7.419 -11.796 -7.831 1.00 0.00 C ATOM 1502 O ASN A 105 -6.533 -12.081 -7.027 1.00 0.00 O ATOM 1503 CB ASN A 105 -6.625 -13.430 -9.551 1.00 0.00 C ATOM 1504 CG ASN A 105 -5.498 -12.436 -9.756 1.00 0.00 C ATOM 1505 OD1 ASN A 105 -5.727 -11.298 -10.169 1.00 0.00 O ATOM 1506 ND2 ASN A 105 -4.274 -12.861 -9.468 1.00 0.00 N ATOM 0 H ASN A 105 -8.202 -11.412 -10.441 1.00 0.00 H new ATOM 0 HA ASN A 105 -8.452 -13.570 -8.426 1.00 0.00 H new ATOM 0 HB2 ASN A 105 -6.272 -14.251 -8.927 1.00 0.00 H new ATOM 0 HB3 ASN A 105 -6.907 -13.859 -10.513 1.00 0.00 H new ATOM 0 HD21 ASN A 105 -3.476 -12.236 -9.586 1.00 0.00 H new ATOM 0 HD22 ASN A 105 -4.131 -13.812 -9.128 1.00 0.00 H new ATOM 1513 N ALA A 106 -8.050 -10.626 -7.827 1.00 0.00 N ATOM 1514 CA ALA A 106 -7.730 -9.588 -6.855 1.00 0.00 C ATOM 1515 C ALA A 106 -8.353 -9.897 -5.497 1.00 0.00 C ATOM 1516 O ALA A 106 -9.379 -10.574 -5.412 1.00 0.00 O ATOM 1517 CB ALA A 106 -8.201 -8.231 -7.357 1.00 0.00 C ATOM 0 H ALA A 106 -8.786 -10.374 -8.486 1.00 0.00 H new ATOM 0 HA ALA A 106 -6.647 -9.562 -6.732 1.00 0.00 H new ATOM 0 HB1 ALA A 106 -7.955 -7.465 -6.621 1.00 0.00 H new ATOM 0 HB2 ALA A 106 -7.706 -8.000 -8.300 1.00 0.00 H new ATOM 0 HB3 ALA A 106 -9.280 -8.254 -7.510 1.00 0.00 H new ATOM 1523 N THR A 107 -7.726 -9.398 -4.436 1.00 0.00 N ATOM 1524 CA THR A 107 -8.218 -9.623 -3.083 1.00 0.00 C ATOM 1525 C THR A 107 -8.712 -8.325 -2.455 1.00 0.00 C ATOM 1526 O THR A 107 -8.193 -7.246 -2.745 1.00 0.00 O ATOM 1527 CB THR A 107 -7.126 -10.232 -2.183 1.00 0.00 C ATOM 1528 OG1 THR A 107 -6.658 -11.463 -2.745 1.00 0.00 O ATOM 1529 CG2 THR A 107 -7.658 -10.480 -0.779 1.00 0.00 C ATOM 0 H THR A 107 -6.877 -8.836 -4.488 1.00 0.00 H new ATOM 0 HA THR A 107 -9.048 -10.325 -3.161 1.00 0.00 H new ATOM 0 HB THR A 107 -6.300 -9.524 -2.122 1.00 0.00 H new ATOM 0 HG1 THR A 107 -5.963 -11.843 -2.168 1.00 0.00 H new ATOM 0 HG21 THR A 107 -6.869 -10.910 -0.162 1.00 0.00 H new ATOM 0 HG22 THR A 107 -7.987 -9.537 -0.343 1.00 0.00 H new ATOM 0 HG23 THR A 107 -8.500 -11.171 -0.826 1.00 0.00 H new ATOM 1537 N LEU A 108 -9.717 -8.435 -1.593 1.00 0.00 N ATOM 1538 CA LEU A 108 -10.281 -7.269 -0.923 1.00 0.00 C ATOM 1539 C LEU A 108 -10.085 -7.360 0.587 1.00 0.00 C ATOM 1540 O LEU A 108 -10.360 -8.393 1.198 1.00 0.00 O ATOM 1541 CB LEU A 108 -11.770 -7.140 -1.248 1.00 0.00 C ATOM 1542 CG LEU A 108 -12.125 -7.004 -2.729 1.00 0.00 C ATOM 1543 CD1 LEU A 108 -13.630 -7.081 -2.927 1.00 0.00 C ATOM 1544 CD2 LEU A 108 -11.577 -5.700 -3.291 1.00 0.00 C ATOM 0 H LEU A 108 -10.158 -9.320 -1.342 1.00 0.00 H new ATOM 0 HA LEU A 108 -9.758 -6.384 -1.286 1.00 0.00 H new ATOM 0 HB2 LEU A 108 -12.285 -8.014 -0.850 1.00 0.00 H new ATOM 0 HB3 LEU A 108 -12.163 -6.271 -0.720 1.00 0.00 H new ATOM 0 HG LEU A 108 -11.666 -7.831 -3.270 1.00 0.00 H new ATOM 0 HD11 LEU A 108 -13.863 -6.982 -3.987 1.00 0.00 H new ATOM 0 HD12 LEU A 108 -13.996 -8.041 -2.563 1.00 0.00 H new ATOM 0 HD13 LEU A 108 -14.112 -6.275 -2.373 1.00 0.00 H new ATOM 0 HD21 LEU A 108 -11.839 -5.620 -4.346 1.00 0.00 H new ATOM 0 HD22 LEU A 108 -12.007 -4.860 -2.746 1.00 0.00 H new ATOM 0 HD23 LEU A 108 -10.492 -5.685 -3.184 1.00 0.00 H new ATOM 1556 N VAL A 109 -9.609 -6.272 1.184 1.00 0.00 N ATOM 1557 CA VAL A 109 -9.379 -6.228 2.623 1.00 0.00 C ATOM 1558 C VAL A 109 -10.468 -5.429 3.329 1.00 0.00 C ATOM 1559 O VAL A 109 -11.029 -4.489 2.765 1.00 0.00 O ATOM 1560 CB VAL A 109 -8.007 -5.610 2.953 1.00 0.00 C ATOM 1561 CG1 VAL A 109 -7.431 -6.232 4.216 1.00 0.00 C ATOM 1562 CG2 VAL A 109 -7.051 -5.778 1.782 1.00 0.00 C ATOM 0 H VAL A 109 -9.375 -5.409 0.693 1.00 0.00 H new ATOM 0 HA VAL A 109 -9.400 -7.258 2.979 1.00 0.00 H new ATOM 0 HB VAL A 109 -8.142 -4.543 3.131 1.00 0.00 H new ATOM 0 HG11 VAL A 109 -6.462 -5.783 4.433 1.00 0.00 H new ATOM 0 HG12 VAL A 109 -8.109 -6.054 5.051 1.00 0.00 H new ATOM 0 HG13 VAL A 109 -7.309 -7.305 4.070 1.00 0.00 H new ATOM 0 HG21 VAL A 109 -6.087 -5.336 2.033 1.00 0.00 H new ATOM 0 HG22 VAL A 109 -6.919 -6.839 1.569 1.00 0.00 H new ATOM 0 HG23 VAL A 109 -7.461 -5.280 0.903 1.00 0.00 H new ATOM 1572 N PHE A 110 -10.763 -5.808 4.569 1.00 0.00 N ATOM 1573 CA PHE A 110 -11.786 -5.126 5.354 1.00 0.00 C ATOM 1574 C PHE A 110 -11.424 -5.127 6.836 1.00 0.00 C ATOM 1575 O PHE A 110 -11.034 -6.155 7.389 1.00 0.00 O ATOM 1576 CB PHE A 110 -13.146 -5.796 5.148 1.00 0.00 C ATOM 1577 CG PHE A 110 -13.885 -5.294 3.941 1.00 0.00 C ATOM 1578 CD1 PHE A 110 -13.608 -5.801 2.682 1.00 0.00 C ATOM 1579 CD2 PHE A 110 -14.858 -4.315 4.066 1.00 0.00 C ATOM 1580 CE1 PHE A 110 -14.287 -5.340 1.570 1.00 0.00 C ATOM 1581 CE2 PHE A 110 -15.540 -3.850 2.957 1.00 0.00 C ATOM 1582 CZ PHE A 110 -15.255 -4.364 1.708 1.00 0.00 C ATOM 0 H PHE A 110 -10.308 -6.583 5.051 1.00 0.00 H new ATOM 0 HA PHE A 110 -11.843 -4.092 5.013 1.00 0.00 H new ATOM 0 HB2 PHE A 110 -13.001 -6.872 5.054 1.00 0.00 H new ATOM 0 HB3 PHE A 110 -13.760 -5.633 6.034 1.00 0.00 H new ATOM 0 HD1 PHE A 110 -12.853 -6.565 2.568 1.00 0.00 H new ATOM 0 HD2 PHE A 110 -15.086 -3.911 5.041 1.00 0.00 H new ATOM 0 HE1 PHE A 110 -14.061 -5.743 0.594 1.00 0.00 H new ATOM 0 HE2 PHE A 110 -16.295 -3.086 3.068 1.00 0.00 H new ATOM 0 HZ PHE A 110 -15.788 -4.004 0.840 1.00 0.00 H new ATOM 1592 N GLU A 111 -11.557 -3.967 7.472 1.00 0.00 N ATOM 1593 CA GLU A 111 -11.243 -3.834 8.890 1.00 0.00 C ATOM 1594 C GLU A 111 -12.468 -4.131 9.749 1.00 0.00 C ATOM 1595 O GLU A 111 -13.432 -3.366 9.761 1.00 0.00 O ATOM 1596 CB GLU A 111 -10.725 -2.426 9.190 1.00 0.00 C ATOM 1597 CG GLU A 111 -10.164 -2.270 10.593 1.00 0.00 C ATOM 1598 CD GLU A 111 -10.562 -0.957 11.238 1.00 0.00 C ATOM 1599 OE1 GLU A 111 -10.823 0.013 10.496 1.00 0.00 O ATOM 1600 OE2 GLU A 111 -10.613 -0.899 12.485 1.00 0.00 O ATOM 0 H GLU A 111 -11.880 -3.107 7.028 1.00 0.00 H new ATOM 0 HA GLU A 111 -10.466 -4.559 9.133 1.00 0.00 H new ATOM 0 HB2 GLU A 111 -9.950 -2.172 8.467 1.00 0.00 H new ATOM 0 HB3 GLU A 111 -11.537 -1.712 9.051 1.00 0.00 H new ATOM 0 HG2 GLU A 111 -10.513 -3.096 11.213 1.00 0.00 H new ATOM 0 HG3 GLU A 111 -9.077 -2.337 10.555 1.00 0.00 H new ATOM 1607 N VAL A 112 -12.424 -5.249 10.466 1.00 0.00 N ATOM 1608 CA VAL A 112 -13.529 -5.649 11.329 1.00 0.00 C ATOM 1609 C VAL A 112 -13.261 -5.263 12.779 1.00 0.00 C ATOM 1610 O VAL A 112 -12.259 -5.671 13.365 1.00 0.00 O ATOM 1611 CB VAL A 112 -13.782 -7.166 11.251 1.00 0.00 C ATOM 1612 CG1 VAL A 112 -15.089 -7.526 11.941 1.00 0.00 C ATOM 1613 CG2 VAL A 112 -13.788 -7.631 9.803 1.00 0.00 C ATOM 0 H VAL A 112 -11.634 -5.894 10.466 1.00 0.00 H new ATOM 0 HA VAL A 112 -14.415 -5.122 10.974 1.00 0.00 H new ATOM 0 HB VAL A 112 -12.972 -7.679 11.770 1.00 0.00 H new ATOM 0 HG11 VAL A 112 -15.251 -8.602 11.876 1.00 0.00 H new ATOM 0 HG12 VAL A 112 -15.041 -7.229 12.989 1.00 0.00 H new ATOM 0 HG13 VAL A 112 -15.913 -7.005 11.454 1.00 0.00 H new ATOM 0 HG21 VAL A 112 -13.968 -8.705 9.767 1.00 0.00 H new ATOM 0 HG22 VAL A 112 -14.576 -7.112 9.258 1.00 0.00 H new ATOM 0 HG23 VAL A 112 -12.824 -7.409 9.346 1.00 0.00 H new ATOM 1623 N GLU A 113 -14.165 -4.474 13.353 1.00 0.00 N ATOM 1624 CA GLU A 113 -14.026 -4.033 14.736 1.00 0.00 C ATOM 1625 C GLU A 113 -15.342 -4.189 15.492 1.00 0.00 C ATOM 1626 O GLU A 113 -16.317 -3.490 15.215 1.00 0.00 O ATOM 1627 CB GLU A 113 -13.566 -2.575 14.785 1.00 0.00 C ATOM 1628 CG GLU A 113 -14.418 -1.639 13.943 1.00 0.00 C ATOM 1629 CD GLU A 113 -13.649 -1.034 12.785 1.00 0.00 C ATOM 1630 OE1 GLU A 113 -13.637 -1.646 11.697 1.00 0.00 O ATOM 1631 OE2 GLU A 113 -13.058 0.051 12.968 1.00 0.00 O ATOM 0 H GLU A 113 -15.001 -4.128 12.882 1.00 0.00 H new ATOM 0 HA GLU A 113 -13.275 -4.660 15.217 1.00 0.00 H new ATOM 0 HB2 GLU A 113 -13.580 -2.233 15.820 1.00 0.00 H new ATOM 0 HB3 GLU A 113 -12.532 -2.517 14.444 1.00 0.00 H new ATOM 0 HG2 GLU A 113 -15.278 -2.185 13.557 1.00 0.00 H new ATOM 0 HG3 GLU A 113 -14.805 -0.839 14.574 1.00 0.00 H new ATOM 1638 N LEU A 114 -15.362 -5.112 16.448 1.00 0.00 N ATOM 1639 CA LEU A 114 -16.558 -5.362 17.245 1.00 0.00 C ATOM 1640 C LEU A 114 -16.765 -4.258 18.277 1.00 0.00 C ATOM 1641 O LEU A 114 -15.882 -3.982 19.091 1.00 0.00 O ATOM 1642 CB LEU A 114 -16.454 -6.718 17.945 1.00 0.00 C ATOM 1643 CG LEU A 114 -17.756 -7.511 18.067 1.00 0.00 C ATOM 1644 CD1 LEU A 114 -17.465 -8.966 18.402 1.00 0.00 C ATOM 1645 CD2 LEU A 114 -18.662 -6.891 19.120 1.00 0.00 C ATOM 0 H LEU A 114 -14.564 -5.699 16.690 1.00 0.00 H new ATOM 0 HA LEU A 114 -17.417 -5.372 16.574 1.00 0.00 H new ATOM 0 HB2 LEU A 114 -15.729 -7.328 17.406 1.00 0.00 H new ATOM 0 HB3 LEU A 114 -16.054 -6.558 18.946 1.00 0.00 H new ATOM 0 HG LEU A 114 -18.271 -7.476 17.107 1.00 0.00 H new ATOM 0 HD11 LEU A 114 -18.403 -9.515 18.485 1.00 0.00 H new ATOM 0 HD12 LEU A 114 -16.856 -9.406 17.613 1.00 0.00 H new ATOM 0 HD13 LEU A 114 -16.928 -9.021 19.349 1.00 0.00 H new ATOM 0 HD21 LEU A 114 -19.584 -7.469 19.193 1.00 0.00 H new ATOM 0 HD22 LEU A 114 -18.154 -6.895 20.085 1.00 0.00 H new ATOM 0 HD23 LEU A 114 -18.898 -5.865 18.838 1.00 0.00 H new ATOM 1657 N LEU A 115 -17.935 -3.631 18.240 1.00 0.00 N ATOM 1658 CA LEU A 115 -18.259 -2.559 19.174 1.00 0.00 C ATOM 1659 C LEU A 115 -19.031 -3.097 20.374 1.00 0.00 C ATOM 1660 O LEU A 115 -18.658 -2.857 21.523 1.00 0.00 O ATOM 1661 CB LEU A 115 -19.078 -1.474 18.471 1.00 0.00 C ATOM 1662 CG LEU A 115 -18.301 -0.545 17.538 1.00 0.00 C ATOM 1663 CD1 LEU A 115 -18.410 -1.023 16.098 1.00 0.00 C ATOM 1664 CD2 LEU A 115 -18.806 0.884 17.667 1.00 0.00 C ATOM 0 H LEU A 115 -18.676 -3.847 17.573 1.00 0.00 H new ATOM 0 HA LEU A 115 -17.324 -2.127 19.531 1.00 0.00 H new ATOM 0 HB2 LEU A 115 -19.866 -1.958 17.895 1.00 0.00 H new ATOM 0 HB3 LEU A 115 -19.567 -0.866 19.232 1.00 0.00 H new ATOM 0 HG LEU A 115 -17.250 -0.565 17.828 1.00 0.00 H new ATOM 0 HD11 LEU A 115 -17.851 -0.350 15.448 1.00 0.00 H new ATOM 0 HD12 LEU A 115 -18.000 -2.030 16.017 1.00 0.00 H new ATOM 0 HD13 LEU A 115 -19.457 -1.032 15.796 1.00 0.00 H new ATOM 0 HD21 LEU A 115 -18.242 1.531 16.996 1.00 0.00 H new ATOM 0 HD22 LEU A 115 -19.863 0.922 17.404 1.00 0.00 H new ATOM 0 HD23 LEU A 115 -18.676 1.225 18.694 1.00 0.00 H new ATOM 1676 N ASP A 116 -20.107 -3.827 20.101 1.00 0.00 N ATOM 1677 CA ASP A 116 -20.929 -4.402 21.159 1.00 0.00 C ATOM 1678 C ASP A 116 -21.643 -5.659 20.670 1.00 0.00 C ATOM 1679 O ASP A 116 -21.633 -5.967 19.478 1.00 0.00 O ATOM 1680 CB ASP A 116 -21.953 -3.378 21.652 1.00 0.00 C ATOM 1681 CG ASP A 116 -22.342 -3.600 23.100 1.00 0.00 C ATOM 1682 OD1 ASP A 116 -21.556 -3.214 23.991 1.00 0.00 O ATOM 1683 OD2 ASP A 116 -23.432 -4.158 23.343 1.00 0.00 O ATOM 0 H ASP A 116 -20.430 -4.034 19.156 1.00 0.00 H new ATOM 0 HA ASP A 116 -20.274 -4.676 21.986 1.00 0.00 H new ATOM 0 HB2 ASP A 116 -21.543 -2.375 21.539 1.00 0.00 H new ATOM 0 HB3 ASP A 116 -22.845 -3.430 21.027 1.00 0.00 H new ATOM 1688 N VAL A 117 -22.260 -6.382 21.598 1.00 0.00 N ATOM 1689 CA VAL A 117 -22.979 -7.605 21.262 1.00 0.00 C ATOM 1690 C VAL A 117 -24.453 -7.321 20.994 1.00 0.00 C ATOM 1691 O VAL A 117 -25.077 -6.598 21.769 1.00 0.00 O ATOM 1692 CB VAL A 117 -22.865 -8.650 22.387 1.00 0.00 C ATOM 1693 CG1 VAL A 117 -22.971 -10.058 21.822 1.00 0.00 C ATOM 1694 CG2 VAL A 117 -21.561 -8.471 23.151 1.00 0.00 C ATOM 0 H VAL A 117 -22.277 -6.142 22.589 1.00 0.00 H new ATOM 0 HA VAL A 117 -22.519 -8.004 20.358 1.00 0.00 H new ATOM 0 HB VAL A 117 -23.691 -8.500 23.082 1.00 0.00 H new ATOM 0 HG11 VAL A 117 -22.888 -10.782 22.632 1.00 0.00 H new ATOM 0 HG12 VAL A 117 -23.933 -10.179 21.324 1.00 0.00 H new ATOM 0 HG13 VAL A 117 -22.168 -10.223 21.104 1.00 0.00 H new ATOM 0 HG21 VAL A 117 -21.497 -9.218 23.942 1.00 0.00 H new ATOM 0 HG22 VAL A 117 -20.720 -8.593 22.469 1.00 0.00 H new ATOM 0 HG23 VAL A 117 -21.531 -7.474 23.590 1.00 0.00 H new TER 1704 VAL A 117 HETATM 1705 N1 JZF A 130 -20.167 -5.738 1.189 1.00 0.00 N HETATM 1706 O1 JZF A 130 -19.738 -2.861 -4.840 1.00 0.00 O HETATM 1707 C2 JZF A 130 -20.837 -4.595 0.841 1.00 0.00 C HETATM 1708 O2 JZF A 130 -21.926 -4.331 1.308 1.00 0.00 O HETATM 1709 C3 JZF A 130 -20.223 -3.633 -0.161 1.00 0.00 C HETATM 1710 O3 JZF A 130 -18.344 -7.065 1.062 1.00 0.00 O HETATM 1711 C4 JZF A 130 -18.689 -3.660 -0.106 1.00 0.00 C HETATM 1712 O4 JZF A 130 -20.581 -9.075 2.167 1.00 0.00 O HETATM 1713 C5 JZF A 130 -18.214 -5.116 -0.246 1.00 0.00 C HETATM 1714 O5 JZF A 130 -21.548 -8.092 0.365 1.00 0.00 O HETATM 1715 C6 JZF A 130 -18.912 -6.042 0.730 1.00 0.00 C HETATM 1716 C7 JZF A 130 -18.008 -2.637 -1.068 1.00 0.00 C HETATM 1717 C8 JZF A 130 -18.746 -2.080 -2.326 1.00 0.00 C HETATM 1718 C9 JZF A 130 -17.893 -1.874 -3.628 1.00 0.00 C HETATM 1719 OH JZF A 130 -19.523 -0.924 -1.998 1.00 0.00 O HETATM 1720 C10 JZF A 130 -18.589 -2.460 -4.859 1.00 0.00 C HETATM 1721 C11 JZF A 130 -17.796 -2.357 -6.158 1.00 0.00 C HETATM 1722 C12 JZF A 130 -17.424 -0.879 -6.435 1.00 0.00 C HETATM 1723 C13 JZF A 130 -16.716 -0.210 -5.233 1.00 0.00 C HETATM 1724 C14 JZF A 130 -17.561 -0.384 -3.947 1.00 0.00 C HETATM 1725 C15 JZF A 130 -20.819 -6.678 2.139 1.00 0.00 C HETATM 1726 C16 JZF A 130 -20.723 -8.068 -0.822 1.00 0.00 C HETATM 1727 C17 JZF A 130 -21.040 -9.325 -1.648 1.00 0.00 C HETATM 1728 C18 JZF A 130 -18.568 -2.937 -7.366 1.00 0.00 C HETATM 1729 C19 JZF A 130 -15.264 -0.717 -5.057 1.00 0.00 C HETATM 1730 C21 JZF A 130 -20.961 -8.079 1.581 1.00 0.00 C HETATM 0 H319 JZF A 130 -15.272 -1.794 -4.889 1.00 0.00 H new HETATM 0 H318 JZF A 130 -18.786 -3.990 -7.187 1.00 0.00 H new HETATM 0 H317 JZF A 130 -20.821 -10.214 -1.056 1.00 0.00 H new HETATM 0 H219 JZF A 130 -14.689 -0.494 -5.956 1.00 0.00 H new HETATM 0 H218 JZF A 130 -19.502 -2.390 -7.497 1.00 0.00 H new HETATM 0 H217 JZF A 130 -22.095 -9.323 -1.923 1.00 0.00 H new HETATM 0 H216 JZF A 130 -20.921 -7.169 -1.405 1.00 0.00 H new HETATM 0 H215 JZF A 130 -20.237 -6.717 3.060 1.00 0.00 H new HETATM 0 H214 JZF A 130 -18.491 0.174 -4.053 1.00 0.00 H new HETATM 0 H212 JZF A 130 -16.774 -0.829 -7.309 1.00 0.00 H new HETATM 0 H1OH JZF A 130 -20.096 -0.688 -2.758 1.00 0.00 H new HETATM 0 H13A JZF A 130 -16.636 0.858 -5.438 1.00 0.00 H new HETATM 0 H119 JZF A 130 -14.806 -0.220 -4.202 1.00 0.00 H new HETATM 0 H118 JZF A 130 -17.961 -2.840 -8.266 1.00 0.00 H new HETATM 0 H117 JZF A 130 -20.429 -9.331 -2.551 1.00 0.00 H new HETATM 0 H116 JZF A 130 -19.667 -8.046 -0.552 1.00 0.00 H new HETATM 0 H115 JZF A 130 -21.805 -6.295 2.401 1.00 0.00 H new HETATM 0 H114 JZF A 130 -17.023 0.050 -3.105 1.00 0.00 H new HETATM 0 H112 JZF A 130 -18.328 -0.320 -6.677 1.00 0.00 H new HETATM 0 H9 JZF A 130 -16.961 -2.398 -3.415 1.00 0.00 H new HETATM 0 H8 JZF A 130 -19.409 -2.896 -2.614 1.00 0.00 H new HETATM 0 H4 JZF A 130 -18.356 -3.301 0.868 1.00 0.00 H new HETATM 0 H27 JZF A 130 -17.721 -1.777 -0.463 1.00 0.00 H new HETATM 0 H25 JZF A 130 -18.396 -5.460 -1.264 1.00 0.00 H new HETATM 0 H23 JZF A 130 -20.556 -3.892 -1.166 1.00 0.00 H new HETATM 0 H17 JZF A 130 -17.087 -3.100 -1.421 1.00 0.00 H new HETATM 0 H15 JZF A 130 -17.137 -5.163 -0.082 1.00 0.00 H new HETATM 0 H13 JZF A 130 -20.577 -2.622 0.041 1.00 0.00 H new HETATM 0 H11 JZF A 130 -16.891 -2.951 -6.032 1.00 0.00 H new