USER MOD reduce.3.24.130724 H: found=0, std=0, add=748, rem=0, adj=22 USER MOD reduce.3.24.130724 removed 747 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 3 MET CE :methyl 172:sc= 0 (180deg=-0.0695) USER MOD Set 1.2: A 7 ASN : amide:sc=-0.00851 X(o=-0.0085,f=-0.07) USER MOD Single : A 1 GLY N :NH3+ -175:sc= -0.184 (180deg=-0.213) USER MOD Single : A 2 SER OG : rot 180:sc= 0 USER MOD Single : A 4 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 5 TYR OH : rot 180:sc= 0 USER MOD Single : A 11 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 14 TYR OH : rot 180:sc= 0 USER MOD Single : A 16 ASN : amide:sc= 1.33 K(o=1.3,f=-1.3) USER MOD Single : A 20 SER OG : rot 78:sc= 0.306 USER MOD Single : A 25 SER OG : rot 180:sc= 0.501 USER MOD Single : A 28 LYS NZ :NH3+ -162:sc= 0.685 (180deg=-0.0944!) USER MOD Single : A 32 MET CE :methyl -130:sc= -0.977 (180deg=-1.4) USER MOD Single : A 33 THR OG1 : rot 180:sc= 0 USER MOD Single : A 39 THR OG1 : rot 99:sc= 1.23 USER MOD Single : A 40 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 48 CYS SG : rot 57:sc= 0.141 USER MOD Single : A 49 SER OG : rot 180:sc= 0 USER MOD Single : A 51 HIS : no HD1:sc= -0.0179 X(o=-0.018,f=0) USER MOD Single : A 54 GLN : amide:sc= -0.0286 X(o=-0.029,f=-0.0088) USER MOD Single : A 60 ASN : amide:sc= -0.0349 K(o=-0.035,f=-1.1) USER MOD Single : A 63 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 68 MET CE :methyl -174:sc= 0 (180deg=-0.0283) USER MOD Single : A 69 TYR OH : rot 180:sc= 0 USER MOD Single : A 71 LYS NZ :NH3+ -161:sc= -0.0408 (180deg=-0.352) USER MOD Single : A 72 LYS NZ :NH3+ 147:sc= 0.486 (180deg=-0.481) USER MOD Single : A 76 SER OG : rot 109:sc= 0.0684 USER MOD Single : A 79 SER OG : rot 180:sc= 0 USER MOD Single : A 81 SER OG : rot 180:sc= 0 USER MOD Single : A 84 THR OG1 : rot 180:sc= -0.0369 USER MOD Single : A 91 LYS NZ :NH3+ 159:sc= 1.12 (180deg=0.545) USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 1 3.039 4.803 -2.680 1.00 25.00 N ATOM 2 CA GLY A 1 3.387 3.791 -1.622 1.00 25.00 C ATOM 3 C GLY A 1 4.559 4.167 -0.739 1.00 25.00 C ATOM 4 O GLY A 1 4.869 3.552 0.256 1.00 25.00 O ATOM 0 H1 GLY A 1 2.177 4.502 -3.178 1.00 25.00 H new ATOM 0 H2 GLY A 1 2.876 5.729 -2.235 1.00 25.00 H new ATOM 0 H3 GLY A 1 3.823 4.878 -3.359 1.00 25.00 H new ATOM 0 HA2 GLY A 1 2.512 3.631 -0.991 1.00 25.00 H new ATOM 0 HA3 GLY A 1 3.607 2.840 -2.108 1.00 25.00 H new ATOM 9 N SER A 2 5.225 5.253 -1.174 1.00 25.00 N ATOM 10 CA SER A 2 6.373 5.876 -0.497 1.00 25.00 C ATOM 11 C SER A 2 7.536 4.923 -0.209 1.00 25.00 C ATOM 12 O SER A 2 8.349 5.189 0.676 1.00 25.00 O ATOM 13 CB SER A 2 5.913 6.521 0.809 1.00 25.00 C ATOM 14 OG SER A 2 4.851 7.427 0.560 1.00 25.00 O ATOM 0 H SER A 2 4.969 5.735 -2.035 1.00 25.00 H new ATOM 0 HA SER A 2 6.757 6.621 -1.193 1.00 25.00 H new ATOM 0 HB2 SER A 2 5.587 5.751 1.508 1.00 25.00 H new ATOM 0 HB3 SER A 2 6.746 7.045 1.277 1.00 25.00 H new ATOM 0 HG SER A 2 4.563 7.833 1.404 1.00 25.00 H new ATOM 20 N MET A 3 7.616 3.824 -0.947 1.00 25.00 N ATOM 21 CA MET A 3 8.672 2.844 -0.727 1.00 25.00 C ATOM 22 C MET A 3 10.015 3.488 -1.029 1.00 25.00 C ATOM 23 O MET A 3 10.214 4.085 -2.091 1.00 25.00 O ATOM 24 CB MET A 3 8.469 1.607 -1.607 1.00 25.00 C ATOM 25 CG MET A 3 7.193 0.834 -1.280 1.00 25.00 C ATOM 26 SD MET A 3 6.984 -0.605 -2.367 1.00 25.00 S ATOM 27 CE MET A 3 8.249 -1.749 -1.694 1.00 25.00 C ATOM 0 H MET A 3 6.967 3.589 -1.698 1.00 25.00 H new ATOM 0 HA MET A 3 8.642 2.519 0.313 1.00 25.00 H new ATOM 0 HB2 MET A 3 8.441 1.914 -2.652 1.00 25.00 H new ATOM 0 HB3 MET A 3 9.326 0.944 -1.492 1.00 25.00 H new ATOM 0 HG2 MET A 3 7.223 0.504 -0.241 1.00 25.00 H new ATOM 0 HG3 MET A 3 6.332 1.494 -1.380 1.00 25.00 H new ATOM 0 HE1 MET A 3 8.144 -2.726 -2.166 1.00 25.00 H new ATOM 0 HE2 MET A 3 9.244 -1.353 -1.898 1.00 25.00 H new ATOM 0 HE3 MET A 3 8.113 -1.850 -0.617 1.00 25.00 H new ATOM 37 N LYS A 4 10.922 3.398 -0.068 1.00 25.00 N ATOM 38 CA LYS A 4 12.257 3.982 -0.197 1.00 25.00 C ATOM 39 C LYS A 4 13.309 2.926 0.049 1.00 25.00 C ATOM 40 O LYS A 4 14.493 3.207 0.066 1.00 25.00 O ATOM 41 CB LYS A 4 12.411 5.133 0.801 1.00 25.00 C ATOM 42 CG LYS A 4 13.175 6.334 0.244 1.00 25.00 C ATOM 43 CD LYS A 4 12.389 7.038 -0.859 1.00 25.00 C ATOM 44 CE LYS A 4 13.211 8.166 -1.464 1.00 25.00 C ATOM 45 NZ LYS A 4 12.450 8.833 -2.576 1.00 25.00 N ATOM 0 H LYS A 4 10.759 2.922 0.819 1.00 25.00 H new ATOM 0 HA LYS A 4 12.386 4.370 -1.207 1.00 25.00 H new ATOM 0 HB2 LYS A 4 11.421 5.460 1.120 1.00 25.00 H new ATOM 0 HB3 LYS A 4 12.927 4.766 1.688 1.00 25.00 H new ATOM 0 HG2 LYS A 4 13.384 7.038 1.049 1.00 25.00 H new ATOM 0 HG3 LYS A 4 14.137 6.004 -0.148 1.00 25.00 H new ATOM 0 HD2 LYS A 4 12.118 6.321 -1.634 1.00 25.00 H new ATOM 0 HD3 LYS A 4 11.459 7.435 -0.453 1.00 25.00 H new ATOM 0 HE2 LYS A 4 13.458 8.897 -0.694 1.00 25.00 H new ATOM 0 HE3 LYS A 4 14.154 7.773 -1.845 1.00 25.00 H new ATOM 0 HZ1 LYS A 4 13.025 9.601 -2.978 1.00 25.00 H new ATOM 0 HZ2 LYS A 4 12.236 8.136 -3.317 1.00 25.00 H new ATOM 0 HZ3 LYS A 4 11.562 9.225 -2.203 1.00 25.00 H new ATOM 59 N TYR A 5 12.835 1.711 0.259 1.00 25.00 N ATOM 60 CA TYR A 5 13.685 0.583 0.590 1.00 25.00 C ATOM 61 C TYR A 5 13.222 -0.632 -0.187 1.00 25.00 C ATOM 62 O TYR A 5 12.154 -0.614 -0.798 1.00 25.00 O ATOM 63 CB TYR A 5 13.592 0.331 2.091 1.00 25.00 C ATOM 64 CG TYR A 5 14.409 1.328 2.881 1.00 25.00 C ATOM 65 CD1 TYR A 5 15.815 1.374 2.745 1.00 25.00 C ATOM 66 CD2 TYR A 5 13.794 2.236 3.766 1.00 25.00 C ATOM 67 CE1 TYR A 5 16.595 2.290 3.490 1.00 25.00 C ATOM 68 CE2 TYR A 5 14.572 3.159 4.511 1.00 25.00 C ATOM 69 CZ TYR A 5 15.971 3.176 4.366 1.00 25.00 C ATOM 70 OH TYR A 5 16.726 4.065 5.089 1.00 25.00 O ATOM 0 H TYR A 5 11.843 1.479 0.204 1.00 25.00 H new ATOM 0 HA TYR A 5 14.722 0.790 0.325 1.00 25.00 H new ATOM 0 HB2 TYR A 5 12.550 0.386 2.405 1.00 25.00 H new ATOM 0 HB3 TYR A 5 13.938 -0.679 2.312 1.00 25.00 H new ATOM 0 HD1 TYR A 5 16.303 0.697 2.060 1.00 25.00 H new ATOM 0 HD2 TYR A 5 12.720 2.229 3.878 1.00 25.00 H new ATOM 0 HE1 TYR A 5 17.669 2.302 3.380 1.00 25.00 H new ATOM 0 HE2 TYR A 5 14.091 3.848 5.189 1.00 25.00 H new ATOM 0 HH TYR A 5 16.138 4.612 5.651 1.00 25.00 H new ATOM 80 N LEU A 6 14.035 -1.675 -0.163 1.00 25.00 N ATOM 81 CA LEU A 6 13.749 -2.920 -0.864 1.00 25.00 C ATOM 82 C LEU A 6 12.530 -3.622 -0.258 1.00 25.00 C ATOM 83 O LEU A 6 11.710 -4.182 -0.976 1.00 25.00 O ATOM 84 CB LEU A 6 14.967 -3.847 -0.774 1.00 25.00 C ATOM 85 CG LEU A 6 16.326 -3.347 -1.282 1.00 25.00 C ATOM 86 CD1 LEU A 6 17.420 -4.381 -0.931 1.00 25.00 C ATOM 87 CD2 LEU A 6 16.328 -3.096 -2.781 1.00 25.00 C ATOM 0 H LEU A 6 14.919 -1.684 0.346 1.00 25.00 H new ATOM 0 HA LEU A 6 13.532 -2.688 -1.907 1.00 25.00 H new ATOM 0 HB2 LEU A 6 15.090 -4.127 0.272 1.00 25.00 H new ATOM 0 HB3 LEU A 6 14.727 -4.759 -1.321 1.00 25.00 H new ATOM 0 HG LEU A 6 16.528 -2.395 -0.791 1.00 25.00 H new ATOM 0 HD11 LEU A 6 18.385 -4.026 -1.292 1.00 25.00 H new ATOM 0 HD12 LEU A 6 17.463 -4.513 0.150 1.00 25.00 H new ATOM 0 HD13 LEU A 6 17.184 -5.335 -1.404 1.00 25.00 H new ATOM 0 HD21 LEU A 6 17.312 -2.744 -3.090 1.00 25.00 H new ATOM 0 HD22 LEU A 6 16.093 -4.022 -3.305 1.00 25.00 H new ATOM 0 HD23 LEU A 6 15.580 -2.342 -3.025 1.00 25.00 H new ATOM 99 N ASN A 7 12.439 -3.575 1.070 1.00 25.00 N ATOM 100 CA ASN A 7 11.322 -4.159 1.845 1.00 25.00 C ATOM 101 C ASN A 7 11.071 -5.650 1.510 1.00 25.00 C ATOM 102 O ASN A 7 9.932 -6.066 1.301 1.00 25.00 O ATOM 103 CB ASN A 7 10.039 -3.327 1.647 1.00 25.00 C ATOM 104 CG ASN A 7 10.179 -1.912 2.156 1.00 25.00 C ATOM 105 OD1 ASN A 7 10.047 -0.952 1.422 1.00 25.00 O ATOM 106 ND2 ASN A 7 10.425 -1.780 3.432 1.00 25.00 N ATOM 0 H ASN A 7 13.144 -3.126 1.655 1.00 25.00 H new ATOM 0 HA ASN A 7 11.611 -4.125 2.895 1.00 25.00 H new ATOM 0 HB2 ASN A 7 9.785 -3.304 0.587 1.00 25.00 H new ATOM 0 HB3 ASN A 7 9.211 -3.814 2.163 1.00 25.00 H new ATOM 0 HD21 ASN A 7 10.512 -0.850 3.841 1.00 25.00 H new ATOM 0 HD22 ASN A 7 10.530 -2.607 4.019 1.00 25.00 H new ATOM 113 N VAL A 8 12.135 -6.449 1.486 1.00 25.00 N ATOM 114 CA VAL A 8 12.039 -7.881 1.160 1.00 25.00 C ATOM 115 C VAL A 8 12.202 -8.673 2.454 1.00 25.00 C ATOM 116 O VAL A 8 12.699 -8.149 3.428 1.00 25.00 O ATOM 117 CB VAL A 8 13.131 -8.309 0.085 1.00 25.00 C ATOM 118 CG1 VAL A 8 13.658 -7.099 -0.654 1.00 25.00 C ATOM 119 CG2 VAL A 8 14.319 -9.047 0.708 1.00 25.00 C ATOM 0 H VAL A 8 13.083 -6.132 1.689 1.00 25.00 H new ATOM 0 HA VAL A 8 11.067 -8.090 0.714 1.00 25.00 H new ATOM 0 HB VAL A 8 12.625 -8.987 -0.602 1.00 25.00 H new ATOM 0 HG11 VAL A 8 14.403 -7.415 -1.384 1.00 25.00 H new ATOM 0 HG12 VAL A 8 12.836 -6.600 -1.167 1.00 25.00 H new ATOM 0 HG13 VAL A 8 14.115 -6.410 0.056 1.00 25.00 H new ATOM 0 HG21 VAL A 8 15.031 -9.314 -0.073 1.00 25.00 H new ATOM 0 HG22 VAL A 8 14.806 -8.401 1.438 1.00 25.00 H new ATOM 0 HG23 VAL A 8 13.966 -9.952 1.203 1.00 25.00 H new ATOM 129 N LEU A 9 11.809 -9.933 2.474 1.00 25.00 N ATOM 130 CA LEU A 9 11.982 -10.758 3.674 1.00 25.00 C ATOM 131 C LEU A 9 13.239 -11.618 3.567 1.00 25.00 C ATOM 132 O LEU A 9 13.570 -12.125 2.493 1.00 25.00 O ATOM 133 CB LEU A 9 10.757 -11.653 3.882 1.00 25.00 C ATOM 134 CG LEU A 9 9.420 -10.913 4.077 1.00 25.00 C ATOM 135 CD1 LEU A 9 8.301 -11.939 4.234 1.00 25.00 C ATOM 136 CD2 LEU A 9 9.448 -9.993 5.297 1.00 25.00 C ATOM 0 H LEU A 9 11.372 -10.411 1.686 1.00 25.00 H new ATOM 0 HA LEU A 9 12.090 -10.092 4.530 1.00 25.00 H new ATOM 0 HB2 LEU A 9 10.663 -12.316 3.022 1.00 25.00 H new ATOM 0 HB3 LEU A 9 10.933 -12.284 4.753 1.00 25.00 H new ATOM 0 HG LEU A 9 9.247 -10.290 3.200 1.00 25.00 H new ATOM 0 HD11 LEU A 9 7.351 -11.423 4.373 1.00 25.00 H new ATOM 0 HD12 LEU A 9 8.249 -12.561 3.340 1.00 25.00 H new ATOM 0 HD13 LEU A 9 8.502 -12.567 5.102 1.00 25.00 H new ATOM 0 HD21 LEU A 9 8.485 -9.491 5.397 1.00 25.00 H new ATOM 0 HD22 LEU A 9 9.644 -10.582 6.193 1.00 25.00 H new ATOM 0 HD23 LEU A 9 10.234 -9.248 5.173 1.00 25.00 H new ATOM 148 N ALA A 10 13.922 -11.807 4.683 1.00 25.00 N ATOM 149 CA ALA A 10 15.103 -12.668 4.739 1.00 25.00 C ATOM 150 C ALA A 10 15.066 -13.524 6.015 1.00 25.00 C ATOM 151 O ALA A 10 14.603 -13.063 7.049 1.00 25.00 O ATOM 152 CB ALA A 10 16.366 -11.824 4.689 1.00 25.00 C ATOM 0 H ALA A 10 13.680 -11.373 5.574 1.00 25.00 H new ATOM 0 HA ALA A 10 15.104 -13.335 3.877 1.00 25.00 H new ATOM 0 HB1 ALA A 10 17.240 -12.474 4.731 1.00 25.00 H new ATOM 0 HB2 ALA A 10 16.384 -11.251 3.762 1.00 25.00 H new ATOM 0 HB3 ALA A 10 16.381 -11.141 5.538 1.00 25.00 H new ATOM 158 N LYS A 11 15.564 -14.754 5.928 1.00 25.00 N ATOM 159 CA LYS A 11 15.609 -15.671 7.081 1.00 25.00 C ATOM 160 C LYS A 11 17.020 -15.801 7.626 1.00 25.00 C ATOM 161 O LYS A 11 17.968 -15.953 6.854 1.00 25.00 O ATOM 162 CB LYS A 11 15.122 -17.074 6.672 1.00 25.00 C ATOM 163 CG LYS A 11 15.235 -18.127 7.793 1.00 25.00 C ATOM 164 CD LYS A 11 14.426 -19.396 7.519 1.00 25.00 C ATOM 165 CE LYS A 11 12.932 -19.167 7.791 1.00 25.00 C ATOM 166 NZ LYS A 11 12.126 -20.434 7.805 1.00 25.00 N ATOM 0 H LYS A 11 15.946 -15.148 5.068 1.00 25.00 H new ATOM 0 HA LYS A 11 14.959 -15.253 7.850 1.00 25.00 H new ATOM 0 HB2 LYS A 11 14.082 -17.008 6.353 1.00 25.00 H new ATOM 0 HB3 LYS A 11 15.699 -17.411 5.811 1.00 25.00 H new ATOM 0 HG2 LYS A 11 16.283 -18.395 7.925 1.00 25.00 H new ATOM 0 HG3 LYS A 11 14.898 -17.686 8.731 1.00 25.00 H new ATOM 0 HD2 LYS A 11 14.567 -19.705 6.483 1.00 25.00 H new ATOM 0 HD3 LYS A 11 14.793 -20.208 8.147 1.00 25.00 H new ATOM 0 HE2 LYS A 11 12.818 -18.663 8.751 1.00 25.00 H new ATOM 0 HE3 LYS A 11 12.530 -18.498 7.030 1.00 25.00 H new ATOM 0 HZ1 LYS A 11 11.128 -20.209 7.994 1.00 25.00 H new ATOM 0 HZ2 LYS A 11 12.206 -20.906 6.882 1.00 25.00 H new ATOM 0 HZ3 LYS A 11 12.485 -21.066 8.549 1.00 25.00 H new ATOM 180 N ALA A 12 17.136 -15.808 8.939 1.00 25.00 N ATOM 181 CA ALA A 12 18.412 -16.005 9.611 1.00 25.00 C ATOM 182 C ALA A 12 18.836 -17.482 9.518 1.00 25.00 C ATOM 183 O ALA A 12 18.054 -18.368 9.854 1.00 25.00 O ATOM 184 CB ALA A 12 18.266 -15.588 11.065 1.00 25.00 C ATOM 0 H ALA A 12 16.349 -15.677 9.574 1.00 25.00 H new ATOM 0 HA ALA A 12 19.181 -15.399 9.132 1.00 25.00 H new ATOM 0 HB1 ALA A 12 19.215 -15.730 11.581 1.00 25.00 H new ATOM 0 HB2 ALA A 12 17.980 -14.538 11.115 1.00 25.00 H new ATOM 0 HB3 ALA A 12 17.498 -16.197 11.543 1.00 25.00 H new ATOM 190 N LEU A 13 20.059 -17.743 9.080 1.00 25.00 N ATOM 191 CA LEU A 13 20.581 -19.112 9.015 1.00 25.00 C ATOM 192 C LEU A 13 21.266 -19.476 10.311 1.00 25.00 C ATOM 193 O LEU A 13 21.485 -20.634 10.590 1.00 25.00 O ATOM 194 CB LEU A 13 21.628 -19.266 7.915 1.00 25.00 C ATOM 195 CG LEU A 13 21.245 -19.140 6.445 1.00 25.00 C ATOM 196 CD1 LEU A 13 19.800 -19.582 6.155 1.00 25.00 C ATOM 197 CD2 LEU A 13 21.488 -17.735 5.960 1.00 25.00 C ATOM 0 H LEU A 13 20.714 -17.028 8.763 1.00 25.00 H new ATOM 0 HA LEU A 13 19.726 -19.758 8.817 1.00 25.00 H new ATOM 0 HB2 LEU A 13 22.405 -18.526 8.107 1.00 25.00 H new ATOM 0 HB3 LEU A 13 22.084 -20.248 8.043 1.00 25.00 H new ATOM 0 HG LEU A 13 21.887 -19.826 5.892 1.00 25.00 H new ATOM 0 HD11 LEU A 13 19.591 -19.468 5.091 1.00 25.00 H new ATOM 0 HD12 LEU A 13 19.675 -20.627 6.439 1.00 25.00 H new ATOM 0 HD13 LEU A 13 19.109 -18.965 6.729 1.00 25.00 H new ATOM 0 HD21 LEU A 13 21.210 -17.660 4.909 1.00 25.00 H new ATOM 0 HD22 LEU A 13 20.887 -17.039 6.545 1.00 25.00 H new ATOM 0 HD23 LEU A 13 22.543 -17.488 6.075 1.00 25.00 H new ATOM 209 N TYR A 14 21.619 -18.461 11.080 1.00 25.00 N ATOM 210 CA TYR A 14 22.314 -18.623 12.349 1.00 25.00 C ATOM 211 C TYR A 14 21.747 -17.547 13.252 1.00 25.00 C ATOM 212 O TYR A 14 21.141 -16.602 12.750 1.00 25.00 O ATOM 213 CB TYR A 14 23.817 -18.384 12.177 1.00 25.00 C ATOM 214 CG TYR A 14 24.437 -19.113 11.007 1.00 25.00 C ATOM 215 CD1 TYR A 14 24.521 -18.500 9.743 1.00 25.00 C ATOM 216 CD2 TYR A 14 24.939 -20.417 11.148 1.00 25.00 C ATOM 217 CE1 TYR A 14 25.082 -19.175 8.636 1.00 25.00 C ATOM 218 CE2 TYR A 14 25.514 -21.101 10.034 1.00 25.00 C ATOM 219 CZ TYR A 14 25.576 -20.470 8.794 1.00 25.00 C ATOM 220 OH TYR A 14 26.124 -21.114 7.721 1.00 25.00 O ATOM 0 H TYR A 14 21.430 -17.488 10.839 1.00 25.00 H new ATOM 0 HA TYR A 14 22.181 -19.629 12.748 1.00 25.00 H new ATOM 0 HB2 TYR A 14 23.991 -17.315 12.056 1.00 25.00 H new ATOM 0 HB3 TYR A 14 24.328 -18.689 13.091 1.00 25.00 H new ATOM 0 HD1 TYR A 14 24.149 -17.494 9.617 1.00 25.00 H new ATOM 0 HD2 TYR A 14 24.890 -20.908 12.109 1.00 25.00 H new ATOM 0 HE1 TYR A 14 25.128 -18.691 7.672 1.00 25.00 H new ATOM 0 HE2 TYR A 14 25.899 -22.103 10.153 1.00 25.00 H new ATOM 0 HH TYR A 14 26.423 -22.007 7.993 1.00 25.00 H new ATOM 230 N ASP A 15 21.953 -17.654 14.553 1.00 25.00 N ATOM 231 CA ASP A 15 21.535 -16.586 15.466 1.00 25.00 C ATOM 232 C ASP A 15 22.583 -15.474 15.464 1.00 25.00 C ATOM 233 O ASP A 15 23.668 -15.609 14.886 1.00 25.00 O ATOM 234 CB ASP A 15 21.319 -17.124 16.886 1.00 25.00 C ATOM 235 CG ASP A 15 22.262 -18.233 17.235 1.00 25.00 C ATOM 236 OD1 ASP A 15 23.416 -17.969 17.613 1.00 25.00 O ATOM 237 OD2 ASP A 15 21.813 -19.396 17.154 1.00 25.00 O ATOM 0 H ASP A 15 22.399 -18.453 15.003 1.00 25.00 H new ATOM 0 HA ASP A 15 20.583 -16.183 15.120 1.00 25.00 H new ATOM 0 HB2 ASP A 15 21.442 -16.310 17.601 1.00 25.00 H new ATOM 0 HB3 ASP A 15 20.294 -17.481 16.982 1.00 25.00 H new ATOM 242 N ASN A 16 22.242 -14.358 16.083 1.00 25.00 N ATOM 243 CA ASN A 16 23.124 -13.207 16.152 1.00 25.00 C ATOM 244 C ASN A 16 22.881 -12.442 17.435 1.00 25.00 C ATOM 245 O ASN A 16 21.737 -12.250 17.840 1.00 25.00 O ATOM 246 CB ASN A 16 22.869 -12.266 14.977 1.00 25.00 C ATOM 247 CG ASN A 16 24.002 -11.291 14.778 1.00 25.00 C ATOM 248 OD1 ASN A 16 25.148 -11.689 14.639 1.00 25.00 O ATOM 249 ND2 ASN A 16 23.705 -10.029 14.806 1.00 25.00 N ATOM 0 H ASN A 16 21.346 -14.224 16.552 1.00 25.00 H new ATOM 0 HA ASN A 16 24.152 -13.569 16.118 1.00 25.00 H new ATOM 0 HB2 ASN A 16 22.730 -12.851 14.068 1.00 25.00 H new ATOM 0 HB3 ASN A 16 21.943 -11.716 15.147 1.00 25.00 H new ATOM 0 HD21 ASN A 16 24.441 -9.330 14.710 1.00 25.00 H new ATOM 0 HD22 ASN A 16 22.735 -9.736 14.924 1.00 25.00 H new ATOM 256 N VAL A 17 23.954 -11.956 18.030 1.00 25.00 N ATOM 257 CA VAL A 17 23.873 -11.098 19.197 1.00 25.00 C ATOM 258 C VAL A 17 24.408 -9.772 18.711 1.00 25.00 C ATOM 259 O VAL A 17 25.446 -9.714 18.050 1.00 25.00 O ATOM 260 CB VAL A 17 24.722 -11.639 20.384 1.00 25.00 C ATOM 261 CG1 VAL A 17 24.677 -10.666 21.577 1.00 25.00 C ATOM 262 CG2 VAL A 17 24.196 -13.019 20.818 1.00 25.00 C ATOM 0 H VAL A 17 24.907 -12.145 17.718 1.00 25.00 H new ATOM 0 HA VAL A 17 22.856 -11.033 19.584 1.00 25.00 H new ATOM 0 HB VAL A 17 25.756 -11.732 20.052 1.00 25.00 H new ATOM 0 HG11 VAL A 17 25.277 -11.065 22.395 1.00 25.00 H new ATOM 0 HG12 VAL A 17 25.076 -9.698 21.273 1.00 25.00 H new ATOM 0 HG13 VAL A 17 23.646 -10.545 21.909 1.00 25.00 H new ATOM 0 HG21 VAL A 17 24.795 -13.392 21.649 1.00 25.00 H new ATOM 0 HG22 VAL A 17 23.156 -12.930 21.131 1.00 25.00 H new ATOM 0 HG23 VAL A 17 24.264 -13.714 19.981 1.00 25.00 H new ATOM 272 N ALA A 18 23.654 -8.724 18.964 1.00 25.00 N ATOM 273 CA ALA A 18 24.005 -7.390 18.529 1.00 25.00 C ATOM 274 C ALA A 18 25.119 -6.851 19.420 1.00 25.00 C ATOM 275 O ALA A 18 24.908 -6.573 20.599 1.00 25.00 O ATOM 276 CB ALA A 18 22.792 -6.517 18.597 1.00 25.00 C ATOM 0 H ALA A 18 22.776 -8.774 19.480 1.00 25.00 H new ATOM 0 HA ALA A 18 24.362 -7.406 17.499 1.00 25.00 H new ATOM 0 HB1 ALA A 18 23.050 -5.510 18.270 1.00 25.00 H new ATOM 0 HB2 ALA A 18 22.016 -6.922 17.948 1.00 25.00 H new ATOM 0 HB3 ALA A 18 22.425 -6.483 19.623 1.00 25.00 H new ATOM 282 N GLU A 19 26.306 -6.733 18.851 1.00 25.00 N ATOM 283 CA GLU A 19 27.468 -6.238 19.583 1.00 25.00 C ATOM 284 C GLU A 19 27.638 -4.766 19.269 1.00 25.00 C ATOM 285 O GLU A 19 28.215 -4.008 20.039 1.00 25.00 O ATOM 286 CB GLU A 19 28.714 -7.003 19.143 1.00 25.00 C ATOM 287 CG GLU A 19 28.668 -8.480 19.500 1.00 25.00 C ATOM 288 CD GLU A 19 29.879 -9.246 18.985 1.00 25.00 C ATOM 289 OE1 GLU A 19 29.684 -10.101 18.088 1.00 25.00 O ATOM 290 OE2 GLU A 19 31.007 -8.990 19.435 1.00 25.00 O ATOM 0 H GLU A 19 26.495 -6.974 17.878 1.00 25.00 H new ATOM 0 HA GLU A 19 27.326 -6.380 20.654 1.00 25.00 H new ATOM 0 HB2 GLU A 19 28.833 -6.900 18.064 1.00 25.00 H new ATOM 0 HB3 GLU A 19 29.592 -6.551 19.605 1.00 25.00 H new ATOM 0 HG2 GLU A 19 28.610 -8.586 20.583 1.00 25.00 H new ATOM 0 HG3 GLU A 19 27.761 -8.922 19.087 1.00 25.00 H new ATOM 297 N SER A 20 27.095 -4.367 18.130 1.00 25.00 N ATOM 298 CA SER A 20 27.138 -2.979 17.700 1.00 25.00 C ATOM 299 C SER A 20 25.821 -2.340 18.109 1.00 25.00 C ATOM 300 O SER A 20 24.781 -3.008 18.113 1.00 25.00 O ATOM 301 CB SER A 20 27.300 -2.915 16.182 1.00 25.00 C ATOM 302 OG SER A 20 27.979 -4.066 15.702 1.00 25.00 O ATOM 0 H SER A 20 26.615 -4.991 17.482 1.00 25.00 H new ATOM 0 HA SER A 20 27.978 -2.455 18.156 1.00 25.00 H new ATOM 0 HB2 SER A 20 26.321 -2.841 15.709 1.00 25.00 H new ATOM 0 HB3 SER A 20 27.855 -2.018 15.908 1.00 25.00 H new ATOM 0 HG SER A 20 27.357 -4.822 15.667 1.00 25.00 H new ATOM 308 N PRO A 21 25.829 -1.035 18.407 1.00 25.00 N ATOM 309 CA PRO A 21 24.564 -0.390 18.784 1.00 25.00 C ATOM 310 C PRO A 21 23.605 -0.286 17.606 1.00 25.00 C ATOM 311 O PRO A 21 22.404 -0.072 17.778 1.00 25.00 O ATOM 312 CB PRO A 21 25.019 0.982 19.283 1.00 25.00 C ATOM 313 CG PRO A 21 26.276 1.243 18.528 1.00 25.00 C ATOM 314 CD PRO A 21 26.953 -0.078 18.427 1.00 25.00 C ATOM 0 HA PRO A 21 24.002 -0.949 19.532 1.00 25.00 H new ATOM 0 HB2 PRO A 21 24.269 1.747 19.085 1.00 25.00 H new ATOM 0 HB3 PRO A 21 25.194 0.977 20.359 1.00 25.00 H new ATOM 0 HG2 PRO A 21 26.064 1.653 17.541 1.00 25.00 H new ATOM 0 HG3 PRO A 21 26.903 1.968 19.047 1.00 25.00 H new ATOM 0 HD2 PRO A 21 27.560 -0.151 17.524 1.00 25.00 H new ATOM 0 HD3 PRO A 21 27.617 -0.255 19.273 1.00 25.00 H new ATOM 322 N ASP A 22 24.127 -0.482 16.406 1.00 25.00 N ATOM 323 CA ASP A 22 23.332 -0.414 15.188 1.00 25.00 C ATOM 324 C ASP A 22 22.851 -1.787 14.760 1.00 25.00 C ATOM 325 O ASP A 22 22.191 -1.909 13.758 1.00 25.00 O ATOM 326 CB ASP A 22 24.180 0.164 14.051 1.00 25.00 C ATOM 327 CG ASP A 22 24.485 1.631 14.241 1.00 25.00 C ATOM 328 OD1 ASP A 22 23.828 2.468 13.588 1.00 25.00 O ATOM 329 OD2 ASP A 22 25.380 1.947 15.049 1.00 25.00 O ATOM 0 H ASP A 22 25.112 -0.693 16.248 1.00 25.00 H new ATOM 0 HA ASP A 22 22.470 0.219 15.395 1.00 25.00 H new ATOM 0 HB2 ASP A 22 25.115 -0.392 13.982 1.00 25.00 H new ATOM 0 HB3 ASP A 22 23.656 0.025 13.105 1.00 25.00 H new ATOM 334 N GLU A 23 23.248 -2.830 15.466 1.00 25.00 N ATOM 335 CA GLU A 23 23.005 -4.197 15.019 1.00 25.00 C ATOM 336 C GLU A 23 21.730 -4.808 15.619 1.00 25.00 C ATOM 337 O GLU A 23 21.263 -4.392 16.683 1.00 25.00 O ATOM 338 CB GLU A 23 24.243 -5.024 15.381 1.00 25.00 C ATOM 339 CG GLU A 23 24.352 -6.367 14.695 1.00 25.00 C ATOM 340 CD GLU A 23 25.637 -7.088 15.033 1.00 25.00 C ATOM 341 OE1 GLU A 23 26.379 -6.654 15.954 1.00 25.00 O ATOM 342 OE2 GLU A 23 25.896 -8.127 14.405 1.00 25.00 O ATOM 0 H GLU A 23 23.742 -2.760 16.355 1.00 25.00 H new ATOM 0 HA GLU A 23 22.838 -4.197 13.942 1.00 25.00 H new ATOM 0 HB2 GLU A 23 25.131 -4.440 15.141 1.00 25.00 H new ATOM 0 HB3 GLU A 23 24.249 -5.185 16.459 1.00 25.00 H new ATOM 0 HG2 GLU A 23 23.504 -6.988 14.983 1.00 25.00 H new ATOM 0 HG3 GLU A 23 24.292 -6.226 13.616 1.00 25.00 H new ATOM 349 N LEU A 24 21.172 -5.795 14.926 1.00 25.00 N ATOM 350 CA LEU A 24 19.999 -6.525 15.416 1.00 25.00 C ATOM 351 C LEU A 24 20.379 -7.857 16.049 1.00 25.00 C ATOM 352 O LEU A 24 21.265 -8.561 15.571 1.00 25.00 O ATOM 353 CB LEU A 24 19.013 -6.798 14.279 1.00 25.00 C ATOM 354 CG LEU A 24 18.281 -5.562 13.732 1.00 25.00 C ATOM 355 CD1 LEU A 24 17.374 -5.970 12.584 1.00 25.00 C ATOM 356 CD2 LEU A 24 17.458 -4.878 14.832 1.00 25.00 C ATOM 0 H LEU A 24 21.512 -6.112 14.018 1.00 25.00 H new ATOM 0 HA LEU A 24 19.536 -5.891 16.172 1.00 25.00 H new ATOM 0 HB2 LEU A 24 19.552 -7.273 13.459 1.00 25.00 H new ATOM 0 HB3 LEU A 24 18.270 -7.514 14.629 1.00 25.00 H new ATOM 0 HG LEU A 24 19.026 -4.852 13.373 1.00 25.00 H new ATOM 0 HD11 LEU A 24 16.857 -5.091 12.199 1.00 25.00 H new ATOM 0 HD12 LEU A 24 17.972 -6.417 11.789 1.00 25.00 H new ATOM 0 HD13 LEU A 24 16.642 -6.695 12.939 1.00 25.00 H new ATOM 0 HD21 LEU A 24 16.950 -4.007 14.418 1.00 25.00 H new ATOM 0 HD22 LEU A 24 16.719 -5.578 15.221 1.00 25.00 H new ATOM 0 HD23 LEU A 24 18.120 -4.563 15.639 1.00 25.00 H new ATOM 368 N SER A 25 19.646 -8.215 17.092 1.00 25.00 N ATOM 369 CA SER A 25 19.802 -9.511 17.742 1.00 25.00 C ATOM 370 C SER A 25 18.626 -10.360 17.324 1.00 25.00 C ATOM 371 O SER A 25 17.483 -9.920 17.400 1.00 25.00 O ATOM 372 CB SER A 25 19.781 -9.373 19.269 1.00 25.00 C ATOM 373 OG SER A 25 20.823 -8.551 19.741 1.00 25.00 O ATOM 0 H SER A 25 18.930 -7.621 17.511 1.00 25.00 H new ATOM 0 HA SER A 25 20.756 -9.952 17.452 1.00 25.00 H new ATOM 0 HB2 SER A 25 18.823 -8.958 19.582 1.00 25.00 H new ATOM 0 HB3 SER A 25 19.865 -10.360 19.723 1.00 25.00 H new ATOM 0 HG SER A 25 20.773 -8.488 20.718 1.00 25.00 H new ATOM 379 N PHE A 26 18.906 -11.577 16.900 1.00 25.00 N ATOM 380 CA PHE A 26 17.861 -12.522 16.479 1.00 25.00 C ATOM 381 C PHE A 26 18.324 -13.973 16.588 1.00 25.00 C ATOM 382 O PHE A 26 19.494 -14.240 16.845 1.00 25.00 O ATOM 383 CB PHE A 26 17.436 -12.226 15.039 1.00 25.00 C ATOM 384 CG PHE A 26 18.574 -12.174 14.070 1.00 25.00 C ATOM 385 CD1 PHE A 26 19.046 -10.936 13.607 1.00 25.00 C ATOM 386 CD2 PHE A 26 19.167 -13.355 13.586 1.00 25.00 C ATOM 387 CE1 PHE A 26 20.073 -10.871 12.665 1.00 25.00 C ATOM 388 CE2 PHE A 26 20.212 -13.301 12.640 1.00 25.00 C ATOM 389 CZ PHE A 26 20.659 -12.068 12.169 1.00 25.00 C ATOM 0 H PHE A 26 19.854 -11.948 16.834 1.00 25.00 H new ATOM 0 HA PHE A 26 17.013 -12.390 17.151 1.00 25.00 H new ATOM 0 HB2 PHE A 26 16.730 -12.990 14.715 1.00 25.00 H new ATOM 0 HB3 PHE A 26 16.907 -11.273 15.015 1.00 25.00 H new ATOM 0 HD1 PHE A 26 18.609 -10.023 13.984 1.00 25.00 H new ATOM 0 HD2 PHE A 26 18.818 -14.313 13.943 1.00 25.00 H new ATOM 0 HE1 PHE A 26 20.423 -9.912 12.313 1.00 25.00 H new ATOM 0 HE2 PHE A 26 20.665 -14.214 12.281 1.00 25.00 H new ATOM 0 HZ PHE A 26 21.446 -12.022 11.431 1.00 25.00 H new ATOM 399 N ARG A 27 17.408 -14.903 16.373 1.00 25.00 N ATOM 400 CA ARG A 27 17.695 -16.328 16.449 1.00 25.00 C ATOM 401 C ARG A 27 17.668 -16.947 15.048 1.00 25.00 C ATOM 402 O ARG A 27 17.019 -16.427 14.144 1.00 25.00 O ATOM 403 CB ARG A 27 16.638 -16.988 17.357 1.00 25.00 C ATOM 404 CG ARG A 27 16.993 -18.381 17.848 1.00 25.00 C ATOM 405 CD ARG A 27 18.088 -18.339 18.915 1.00 25.00 C ATOM 406 NE ARG A 27 18.599 -19.683 19.233 1.00 25.00 N ATOM 407 CZ ARG A 27 18.038 -20.541 20.077 1.00 25.00 C ATOM 408 NH1 ARG A 27 16.929 -20.269 20.723 1.00 25.00 N ATOM 409 NH2 ARG A 27 18.603 -21.700 20.277 1.00 25.00 N ATOM 0 H ARG A 27 16.438 -14.690 16.139 1.00 25.00 H new ATOM 0 HA ARG A 27 18.689 -16.490 16.866 1.00 25.00 H new ATOM 0 HB2 ARG A 27 16.472 -16.346 18.222 1.00 25.00 H new ATOM 0 HB3 ARG A 27 15.695 -17.040 16.813 1.00 25.00 H new ATOM 0 HG2 ARG A 27 16.104 -18.861 18.257 1.00 25.00 H new ATOM 0 HG3 ARG A 27 17.326 -18.990 17.008 1.00 25.00 H new ATOM 0 HD2 ARG A 27 18.909 -17.712 18.568 1.00 25.00 H new ATOM 0 HD3 ARG A 27 17.695 -17.877 19.820 1.00 25.00 H new ATOM 0 HE ARG A 27 19.456 -19.980 18.766 1.00 25.00 H new ATOM 0 HH11 ARG A 27 16.466 -19.371 20.585 1.00 25.00 H new ATOM 0 HH12 ARG A 27 16.530 -20.956 21.363 1.00 25.00 H new ATOM 0 HH21 ARG A 27 19.466 -21.938 19.788 1.00 25.00 H new ATOM 0 HH22 ARG A 27 18.182 -22.368 20.923 1.00 25.00 H new ATOM 423 N LYS A 28 18.354 -18.072 14.881 1.00 25.00 N ATOM 424 CA LYS A 28 18.302 -18.849 13.640 1.00 25.00 C ATOM 425 C LYS A 28 16.840 -19.164 13.331 1.00 25.00 C ATOM 426 O LYS A 28 16.103 -19.627 14.197 1.00 25.00 O ATOM 427 CB LYS A 28 19.097 -20.144 13.841 1.00 25.00 C ATOM 428 CG LYS A 28 19.050 -21.128 12.677 1.00 25.00 C ATOM 429 CD LYS A 28 20.033 -22.274 12.918 1.00 25.00 C ATOM 430 CE LYS A 28 20.029 -23.296 11.779 1.00 25.00 C ATOM 431 NZ LYS A 28 21.060 -24.365 12.035 1.00 25.00 N ATOM 0 H LYS A 28 18.960 -18.473 15.596 1.00 25.00 H new ATOM 0 HA LYS A 28 18.734 -18.291 12.809 1.00 25.00 H new ATOM 0 HB2 LYS A 28 20.138 -19.885 14.034 1.00 25.00 H new ATOM 0 HB3 LYS A 28 18.723 -20.645 14.734 1.00 25.00 H new ATOM 0 HG2 LYS A 28 18.040 -21.522 12.565 1.00 25.00 H new ATOM 0 HG3 LYS A 28 19.297 -20.616 11.747 1.00 25.00 H new ATOM 0 HD2 LYS A 28 21.038 -21.868 13.035 1.00 25.00 H new ATOM 0 HD3 LYS A 28 19.781 -22.775 13.853 1.00 25.00 H new ATOM 0 HE2 LYS A 28 19.041 -23.748 11.689 1.00 25.00 H new ATOM 0 HE3 LYS A 28 20.239 -22.797 10.833 1.00 25.00 H new ATOM 0 HZ1 LYS A 28 21.267 -24.867 11.148 1.00 25.00 H new ATOM 0 HZ2 LYS A 28 21.931 -23.927 12.397 1.00 25.00 H new ATOM 0 HZ3 LYS A 28 20.694 -25.039 12.737 1.00 25.00 H new ATOM 445 N GLY A 29 16.433 -18.898 12.096 1.00 25.00 N ATOM 446 CA GLY A 29 15.065 -19.139 11.662 1.00 25.00 C ATOM 447 C GLY A 29 14.190 -17.897 11.641 1.00 25.00 C ATOM 448 O GLY A 29 13.123 -17.925 11.012 1.00 25.00 O ATOM 0 H GLY A 29 17.039 -18.512 11.372 1.00 25.00 H new ATOM 0 HA2 GLY A 29 15.084 -19.573 10.662 1.00 25.00 H new ATOM 0 HA3 GLY A 29 14.611 -19.878 12.322 1.00 25.00 H new ATOM 452 N ASP A 30 14.624 -16.818 12.277 1.00 25.00 N ATOM 453 CA ASP A 30 13.819 -15.599 12.357 1.00 25.00 C ATOM 454 C ASP A 30 13.732 -14.919 11.005 1.00 25.00 C ATOM 455 O ASP A 30 14.610 -15.091 10.155 1.00 25.00 O ATOM 456 CB ASP A 30 14.415 -14.602 13.356 1.00 25.00 C ATOM 457 CG ASP A 30 14.120 -14.971 14.804 1.00 25.00 C ATOM 458 OD1 ASP A 30 13.261 -15.845 15.042 1.00 25.00 O ATOM 459 OD2 ASP A 30 14.748 -14.380 15.707 1.00 25.00 O ATOM 0 H ASP A 30 15.528 -16.758 12.746 1.00 25.00 H new ATOM 0 HA ASP A 30 12.825 -15.899 12.689 1.00 25.00 H new ATOM 0 HB2 ASP A 30 15.494 -14.551 13.211 1.00 25.00 H new ATOM 0 HB3 ASP A 30 14.018 -13.608 13.151 1.00 25.00 H new ATOM 464 N ILE A 31 12.686 -14.130 10.814 1.00 25.00 N ATOM 465 CA ILE A 31 12.473 -13.389 9.575 1.00 25.00 C ATOM 466 C ILE A 31 12.574 -11.910 9.868 1.00 25.00 C ATOM 467 O ILE A 31 11.899 -11.411 10.765 1.00 25.00 O ATOM 468 CB ILE A 31 11.072 -13.665 8.968 1.00 25.00 C ATOM 469 CG1 ILE A 31 10.879 -15.162 8.684 1.00 25.00 C ATOM 470 CG2 ILE A 31 10.864 -12.844 7.659 1.00 25.00 C ATOM 471 CD1 ILE A 31 11.930 -15.781 7.773 1.00 25.00 C ATOM 0 H ILE A 31 11.958 -13.983 11.513 1.00 25.00 H new ATOM 0 HA ILE A 31 13.230 -13.711 8.860 1.00 25.00 H new ATOM 0 HB ILE A 31 10.328 -13.353 9.700 1.00 25.00 H new ATOM 0 HG12 ILE A 31 10.878 -15.700 9.632 1.00 25.00 H new ATOM 0 HG13 ILE A 31 9.897 -15.308 8.234 1.00 25.00 H new ATOM 0 HG21 ILE A 31 9.875 -13.054 7.251 1.00 25.00 H new ATOM 0 HG22 ILE A 31 10.947 -11.780 7.880 1.00 25.00 H new ATOM 0 HG23 ILE A 31 11.624 -13.124 6.929 1.00 25.00 H new ATOM 0 HD11 ILE A 31 11.710 -16.839 7.631 1.00 25.00 H new ATOM 0 HD12 ILE A 31 11.918 -15.275 6.808 1.00 25.00 H new ATOM 0 HD13 ILE A 31 12.915 -15.673 8.228 1.00 25.00 H new ATOM 483 N MET A 32 13.373 -11.207 9.085 1.00 25.00 N ATOM 484 CA MET A 32 13.479 -9.759 9.194 1.00 25.00 C ATOM 485 C MET A 32 13.276 -9.143 7.826 1.00 25.00 C ATOM 486 O MET A 32 13.494 -9.781 6.792 1.00 25.00 O ATOM 487 CB MET A 32 14.829 -9.354 9.780 1.00 25.00 C ATOM 488 CG MET A 32 16.031 -9.910 9.048 1.00 25.00 C ATOM 489 SD MET A 32 17.315 -10.324 10.232 1.00 25.00 S ATOM 490 CE MET A 32 16.637 -11.870 10.965 1.00 25.00 C ATOM 0 H MET A 32 13.963 -11.617 8.361 1.00 25.00 H new ATOM 0 HA MET A 32 12.708 -9.392 9.871 1.00 25.00 H new ATOM 0 HB2 MET A 32 14.895 -8.266 9.785 1.00 25.00 H new ATOM 0 HB3 MET A 32 14.871 -9.681 10.819 1.00 25.00 H new ATOM 0 HG2 MET A 32 15.746 -10.796 8.480 1.00 25.00 H new ATOM 0 HG3 MET A 32 16.404 -9.178 8.332 1.00 25.00 H new ATOM 0 HE1 MET A 32 16.661 -11.798 12.052 1.00 25.00 H new ATOM 0 HE2 MET A 32 15.608 -12.009 10.634 1.00 25.00 H new ATOM 0 HE3 MET A 32 17.240 -12.720 10.644 1.00 25.00 H new ATOM 500 N THR A 33 12.829 -7.901 7.838 1.00 25.00 N ATOM 501 CA THR A 33 12.554 -7.152 6.612 1.00 25.00 C ATOM 502 C THR A 33 13.810 -6.418 6.180 1.00 25.00 C ATOM 503 O THR A 33 14.242 -5.507 6.855 1.00 25.00 O ATOM 504 CB THR A 33 11.444 -6.122 6.851 1.00 25.00 C ATOM 505 OG1 THR A 33 10.248 -6.795 7.251 1.00 25.00 O ATOM 506 CG2 THR A 33 11.153 -5.320 5.594 1.00 25.00 C ATOM 0 H THR A 33 12.644 -7.378 8.694 1.00 25.00 H new ATOM 0 HA THR A 33 12.237 -7.853 5.840 1.00 25.00 H new ATOM 0 HB THR A 33 11.781 -5.440 7.631 1.00 25.00 H new ATOM 0 HG1 THR A 33 9.538 -6.137 7.406 1.00 25.00 H new ATOM 0 HG21 THR A 33 10.361 -4.599 5.798 1.00 25.00 H new ATOM 0 HG22 THR A 33 12.054 -4.791 5.283 1.00 25.00 H new ATOM 0 HG23 THR A 33 10.834 -5.993 4.798 1.00 25.00 H new ATOM 514 N VAL A 34 14.396 -6.817 5.060 1.00 25.00 N ATOM 515 CA VAL A 34 15.598 -6.176 4.538 1.00 25.00 C ATOM 516 C VAL A 34 15.191 -4.887 3.867 1.00 25.00 C ATOM 517 O VAL A 34 14.353 -4.865 2.958 1.00 25.00 O ATOM 518 CB VAL A 34 16.324 -7.055 3.508 1.00 25.00 C ATOM 519 CG1 VAL A 34 17.642 -6.404 3.043 1.00 25.00 C ATOM 520 CG2 VAL A 34 16.609 -8.417 4.106 1.00 25.00 C ATOM 0 H VAL A 34 14.055 -7.590 4.489 1.00 25.00 H new ATOM 0 HA VAL A 34 16.281 -6.003 5.370 1.00 25.00 H new ATOM 0 HB VAL A 34 15.675 -7.163 2.639 1.00 25.00 H new ATOM 0 HG11 VAL A 34 18.131 -7.052 2.315 1.00 25.00 H new ATOM 0 HG12 VAL A 34 17.429 -5.438 2.585 1.00 25.00 H new ATOM 0 HG13 VAL A 34 18.300 -6.261 3.900 1.00 25.00 H new ATOM 0 HG21 VAL A 34 17.124 -9.036 3.372 1.00 25.00 H new ATOM 0 HG22 VAL A 34 17.238 -8.302 4.989 1.00 25.00 H new ATOM 0 HG23 VAL A 34 15.670 -8.894 4.389 1.00 25.00 H new ATOM 530 N LEU A 35 15.773 -3.809 4.347 1.00 25.00 N ATOM 531 CA LEU A 35 15.489 -2.492 3.837 1.00 25.00 C ATOM 532 C LEU A 35 16.500 -2.138 2.771 1.00 25.00 C ATOM 533 O LEU A 35 16.130 -1.742 1.678 1.00 25.00 O ATOM 534 CB LEU A 35 15.533 -1.494 4.986 1.00 25.00 C ATOM 535 CG LEU A 35 14.509 -1.771 6.095 1.00 25.00 C ATOM 536 CD1 LEU A 35 14.744 -0.809 7.213 1.00 25.00 C ATOM 537 CD2 LEU A 35 13.075 -1.644 5.588 1.00 25.00 C ATOM 0 H LEU A 35 16.457 -3.825 5.103 1.00 25.00 H new ATOM 0 HA LEU A 35 14.496 -2.465 3.389 1.00 25.00 H new ATOM 0 HB2 LEU A 35 16.533 -1.499 5.420 1.00 25.00 H new ATOM 0 HB3 LEU A 35 15.362 -0.493 4.590 1.00 25.00 H new ATOM 0 HG LEU A 35 14.639 -2.796 6.441 1.00 25.00 H new ATOM 0 HD11 LEU A 35 14.023 -0.994 8.009 1.00 25.00 H new ATOM 0 HD12 LEU A 35 15.754 -0.941 7.600 1.00 25.00 H new ATOM 0 HD13 LEU A 35 14.626 0.211 6.846 1.00 25.00 H new ATOM 0 HD21 LEU A 35 12.381 -1.848 6.404 1.00 25.00 H new ATOM 0 HD22 LEU A 35 12.909 -0.633 5.215 1.00 25.00 H new ATOM 0 HD23 LEU A 35 12.909 -2.360 4.783 1.00 25.00 H new ATOM 549 N GLU A 36 17.771 -2.361 3.052 1.00 25.00 N ATOM 550 CA GLU A 36 18.809 -2.174 2.037 1.00 25.00 C ATOM 551 C GLU A 36 19.975 -3.087 2.369 1.00 25.00 C ATOM 552 O GLU A 36 19.987 -3.730 3.415 1.00 25.00 O ATOM 553 CB GLU A 36 19.244 -0.704 1.929 1.00 25.00 C ATOM 554 CG GLU A 36 20.145 -0.202 2.977 1.00 25.00 C ATOM 555 CD GLU A 36 20.338 1.305 2.901 1.00 25.00 C ATOM 556 OE1 GLU A 36 20.729 1.892 3.925 1.00 25.00 O ATOM 557 OE2 GLU A 36 20.076 1.901 1.837 1.00 25.00 O ATOM 0 H GLU A 36 18.114 -2.669 3.962 1.00 25.00 H new ATOM 0 HA GLU A 36 18.411 -2.438 1.057 1.00 25.00 H new ATOM 0 HB2 GLU A 36 19.733 -0.564 0.965 1.00 25.00 H new ATOM 0 HB3 GLU A 36 18.348 -0.084 1.925 1.00 25.00 H new ATOM 0 HG2 GLU A 36 19.743 -0.465 3.955 1.00 25.00 H new ATOM 0 HG3 GLU A 36 21.113 -0.695 2.887 1.00 25.00 H new ATOM 564 N ARG A 37 20.941 -3.173 1.469 1.00 25.00 N ATOM 565 CA ARG A 37 22.111 -4.025 1.676 1.00 25.00 C ATOM 566 C ARG A 37 23.309 -3.154 1.432 1.00 25.00 C ATOM 567 O ARG A 37 23.197 -2.196 0.679 1.00 25.00 O ATOM 568 CB ARG A 37 22.112 -5.192 0.696 1.00 25.00 C ATOM 569 CG ARG A 37 20.868 -6.068 0.811 1.00 25.00 C ATOM 570 CD ARG A 37 21.015 -7.344 0.018 1.00 25.00 C ATOM 571 NE ARG A 37 21.371 -7.074 -1.385 1.00 25.00 N ATOM 572 CZ ARG A 37 21.773 -7.989 -2.258 1.00 25.00 C ATOM 573 NH1 ARG A 37 21.874 -9.263 -1.944 1.00 25.00 N ATOM 574 NH2 ARG A 37 22.093 -7.617 -3.463 1.00 25.00 N ATOM 0 H ARG A 37 20.942 -2.664 0.585 1.00 25.00 H new ATOM 0 HA ARG A 37 22.113 -4.446 2.681 1.00 25.00 H new ATOM 0 HB2 ARG A 37 22.185 -4.806 -0.321 1.00 25.00 H new ATOM 0 HB3 ARG A 37 22.998 -5.804 0.869 1.00 25.00 H new ATOM 0 HG2 ARG A 37 20.686 -6.308 1.859 1.00 25.00 H new ATOM 0 HG3 ARG A 37 19.998 -5.515 0.455 1.00 25.00 H new ATOM 0 HD2 ARG A 37 21.782 -7.970 0.474 1.00 25.00 H new ATOM 0 HD3 ARG A 37 20.081 -7.905 0.055 1.00 25.00 H new ATOM 0 HE ARG A 37 21.303 -6.110 -1.711 1.00 25.00 H new ATOM 0 HH11 ARG A 37 21.639 -9.576 -1.002 1.00 25.00 H new ATOM 0 HH12 ARG A 37 22.187 -9.937 -2.643 1.00 25.00 H new ATOM 0 HH21 ARG A 37 22.033 -6.633 -3.726 1.00 25.00 H new ATOM 0 HH22 ARG A 37 22.404 -8.309 -4.145 1.00 25.00 H new ATOM 588 N ASP A 38 24.410 -3.481 2.096 1.00 25.00 N ATOM 589 CA ASP A 38 25.668 -2.738 1.994 1.00 25.00 C ATOM 590 C ASP A 38 25.375 -1.305 2.456 1.00 25.00 C ATOM 591 O ASP A 38 25.853 -0.300 1.923 1.00 25.00 O ATOM 592 CB ASP A 38 26.236 -2.880 0.585 1.00 25.00 C ATOM 593 CG ASP A 38 26.212 -4.343 0.122 1.00 25.00 C ATOM 594 OD1 ASP A 38 25.609 -4.634 -0.939 1.00 25.00 O ATOM 595 OD2 ASP A 38 26.619 -5.227 0.923 1.00 25.00 O ATOM 0 H ASP A 38 24.459 -4.279 2.729 1.00 25.00 H new ATOM 0 HA ASP A 38 26.457 -3.127 2.638 1.00 25.00 H new ATOM 0 HB2 ASP A 38 25.658 -2.267 -0.107 1.00 25.00 H new ATOM 0 HB3 ASP A 38 27.259 -2.506 0.563 1.00 25.00 H new ATOM 600 N THR A 39 24.507 -1.260 3.458 1.00 25.00 N ATOM 601 CA THR A 39 23.967 -0.026 4.018 1.00 25.00 C ATOM 602 C THR A 39 25.048 0.815 4.670 1.00 25.00 C ATOM 603 O THR A 39 25.982 0.288 5.233 1.00 25.00 O ATOM 604 CB THR A 39 22.885 -0.360 5.079 1.00 25.00 C ATOM 605 OG1 THR A 39 22.409 0.832 5.701 1.00 25.00 O ATOM 606 CG2 THR A 39 23.380 -1.281 6.136 1.00 25.00 C ATOM 0 H THR A 39 24.150 -2.099 3.915 1.00 25.00 H new ATOM 0 HA THR A 39 23.533 0.544 3.197 1.00 25.00 H new ATOM 0 HB THR A 39 22.078 -0.860 4.542 1.00 25.00 H new ATOM 0 HG1 THR A 39 21.564 1.103 5.285 1.00 25.00 H new ATOM 0 HG21 THR A 39 22.580 -1.479 6.850 1.00 25.00 H new ATOM 0 HG22 THR A 39 23.700 -2.218 5.681 1.00 25.00 H new ATOM 0 HG23 THR A 39 24.223 -0.822 6.653 1.00 25.00 H new ATOM 614 N GLN A 40 24.912 2.129 4.555 1.00 25.00 N ATOM 615 CA GLN A 40 25.880 3.108 5.094 1.00 25.00 C ATOM 616 C GLN A 40 27.305 2.913 4.547 1.00 25.00 C ATOM 617 O GLN A 40 28.258 3.460 5.089 1.00 25.00 O ATOM 618 CB GLN A 40 25.897 3.088 6.636 1.00 25.00 C ATOM 619 CG GLN A 40 24.524 2.924 7.284 1.00 25.00 C ATOM 620 CD GLN A 40 24.526 3.337 8.743 1.00 25.00 C ATOM 621 OE1 GLN A 40 24.541 4.513 9.059 1.00 25.00 O ATOM 622 NE2 GLN A 40 24.470 2.376 9.629 1.00 25.00 N ATOM 0 H GLN A 40 24.120 2.563 4.081 1.00 25.00 H new ATOM 0 HA GLN A 40 25.536 4.085 4.753 1.00 25.00 H new ATOM 0 HB2 GLN A 40 26.541 2.274 6.969 1.00 25.00 H new ATOM 0 HB3 GLN A 40 26.345 4.015 6.994 1.00 25.00 H new ATOM 0 HG2 GLN A 40 23.793 3.523 6.740 1.00 25.00 H new ATOM 0 HG3 GLN A 40 24.208 1.884 7.203 1.00 25.00 H new ATOM 0 HE21 GLN A 40 24.459 1.402 9.325 1.00 25.00 H new ATOM 0 HE22 GLN A 40 24.437 2.600 10.623 1.00 25.00 H new ATOM 631 N GLY A 41 27.440 2.129 3.485 1.00 25.00 N ATOM 632 CA GLY A 41 28.745 1.833 2.921 1.00 25.00 C ATOM 633 C GLY A 41 29.425 0.704 3.667 1.00 25.00 C ATOM 634 O GLY A 41 30.614 0.446 3.487 1.00 25.00 O ATOM 0 H GLY A 41 26.660 1.688 2.999 1.00 25.00 H new ATOM 0 HA2 GLY A 41 28.637 1.564 1.870 1.00 25.00 H new ATOM 0 HA3 GLY A 41 29.370 2.725 2.959 1.00 25.00 H new ATOM 638 N LEU A 42 28.667 0.021 4.511 1.00 25.00 N ATOM 639 CA LEU A 42 29.179 -1.091 5.283 1.00 25.00 C ATOM 640 C LEU A 42 28.970 -2.338 4.446 1.00 25.00 C ATOM 641 O LEU A 42 27.905 -2.958 4.489 1.00 25.00 O ATOM 642 CB LEU A 42 28.411 -1.199 6.600 1.00 25.00 C ATOM 643 CG LEU A 42 28.417 0.053 7.484 1.00 25.00 C ATOM 644 CD1 LEU A 42 27.362 -0.090 8.561 1.00 25.00 C ATOM 645 CD2 LEU A 42 29.765 0.262 8.124 1.00 25.00 C ATOM 0 H LEU A 42 27.681 0.225 4.677 1.00 25.00 H new ATOM 0 HA LEU A 42 30.235 -0.959 5.521 1.00 25.00 H new ATOM 0 HB2 LEU A 42 27.376 -1.456 6.374 1.00 25.00 H new ATOM 0 HB3 LEU A 42 28.827 -2.027 7.174 1.00 25.00 H new ATOM 0 HG LEU A 42 28.200 0.918 6.858 1.00 25.00 H new ATOM 0 HD11 LEU A 42 27.363 0.799 9.192 1.00 25.00 H new ATOM 0 HD12 LEU A 42 26.382 -0.205 8.098 1.00 25.00 H new ATOM 0 HD13 LEU A 42 27.580 -0.967 9.170 1.00 25.00 H new ATOM 0 HD21 LEU A 42 29.738 1.158 8.745 1.00 25.00 H new ATOM 0 HD22 LEU A 42 30.012 -0.601 8.742 1.00 25.00 H new ATOM 0 HD23 LEU A 42 30.522 0.381 7.348 1.00 25.00 H new ATOM 657 N ASP A 43 29.962 -2.675 3.646 1.00 25.00 N ATOM 658 CA ASP A 43 29.852 -3.820 2.747 1.00 25.00 C ATOM 659 C ASP A 43 29.576 -5.068 3.553 1.00 25.00 C ATOM 660 O ASP A 43 30.164 -5.294 4.618 1.00 25.00 O ATOM 661 CB ASP A 43 31.141 -4.028 1.968 1.00 25.00 C ATOM 662 CG ASP A 43 30.897 -4.613 0.581 1.00 25.00 C ATOM 663 OD1 ASP A 43 31.427 -4.046 -0.399 1.00 25.00 O ATOM 664 OD2 ASP A 43 30.201 -5.645 0.469 1.00 25.00 O ATOM 0 H ASP A 43 30.852 -2.179 3.596 1.00 25.00 H new ATOM 0 HA ASP A 43 29.039 -3.624 2.048 1.00 25.00 H new ATOM 0 HB2 ASP A 43 31.661 -3.075 1.871 1.00 25.00 H new ATOM 0 HB3 ASP A 43 31.798 -4.693 2.529 1.00 25.00 H new ATOM 669 N GLY A 44 28.647 -5.866 3.070 1.00 25.00 N ATOM 670 CA GLY A 44 28.295 -7.095 3.749 1.00 25.00 C ATOM 671 C GLY A 44 27.250 -6.934 4.842 1.00 25.00 C ATOM 672 O GLY A 44 26.643 -7.932 5.240 1.00 25.00 O ATOM 0 H GLY A 44 28.124 -5.687 2.213 1.00 25.00 H new ATOM 0 HA2 GLY A 44 27.926 -7.809 3.013 1.00 25.00 H new ATOM 0 HA3 GLY A 44 29.196 -7.525 4.186 1.00 25.00 H new ATOM 676 N TRP A 45 27.018 -5.725 5.331 1.00 25.00 N ATOM 677 CA TRP A 45 26.016 -5.474 6.350 1.00 25.00 C ATOM 678 C TRP A 45 24.691 -5.121 5.676 1.00 25.00 C ATOM 679 O TRP A 45 24.642 -4.300 4.776 1.00 25.00 O ATOM 680 CB TRP A 45 26.492 -4.308 7.205 1.00 25.00 C ATOM 681 CG TRP A 45 27.571 -4.703 8.168 1.00 25.00 C ATOM 682 CD1 TRP A 45 28.907 -4.466 8.069 1.00 25.00 C ATOM 683 CD2 TRP A 45 27.406 -5.411 9.410 1.00 25.00 C ATOM 684 NE1 TRP A 45 29.584 -4.933 9.158 1.00 25.00 N ATOM 685 CE2 TRP A 45 28.696 -5.538 10.006 1.00 25.00 C ATOM 686 CE3 TRP A 45 26.296 -5.938 10.088 1.00 25.00 C ATOM 687 CZ2 TRP A 45 28.894 -6.173 11.248 1.00 25.00 C ATOM 688 CZ3 TRP A 45 26.488 -6.571 11.338 1.00 25.00 C ATOM 689 CH2 TRP A 45 27.785 -6.686 11.900 1.00 25.00 C ATOM 0 H TRP A 45 27.521 -4.890 5.030 1.00 25.00 H new ATOM 0 HA TRP A 45 25.870 -6.356 6.973 1.00 25.00 H new ATOM 0 HB2 TRP A 45 26.862 -3.514 6.557 1.00 25.00 H new ATOM 0 HB3 TRP A 45 25.647 -3.900 7.759 1.00 25.00 H new ATOM 0 HD1 TRP A 45 29.374 -3.969 7.232 1.00 25.00 H new ATOM 0 HE1 TRP A 45 30.588 -4.845 9.315 1.00 25.00 H new ATOM 0 HE3 TRP A 45 25.307 -5.861 9.660 1.00 25.00 H new ATOM 0 HZ2 TRP A 45 29.881 -6.257 11.679 1.00 25.00 H new ATOM 0 HZ3 TRP A 45 25.638 -6.971 11.870 1.00 25.00 H new ATOM 0 HH2 TRP A 45 27.910 -7.181 12.851 1.00 25.00 H new ATOM 700 N TRP A 46 23.612 -5.765 6.084 1.00 25.00 N ATOM 701 CA TRP A 46 22.298 -5.521 5.485 1.00 25.00 C ATOM 702 C TRP A 46 21.399 -4.835 6.496 1.00 25.00 C ATOM 703 O TRP A 46 21.249 -5.322 7.608 1.00 25.00 O ATOM 704 CB TRP A 46 21.665 -6.846 5.024 1.00 25.00 C ATOM 705 CG TRP A 46 22.453 -7.551 3.915 1.00 25.00 C ATOM 706 CD1 TRP A 46 23.582 -7.117 3.291 1.00 25.00 C ATOM 707 CD2 TRP A 46 22.164 -8.832 3.308 1.00 25.00 C ATOM 708 NE1 TRP A 46 24.023 -8.001 2.361 1.00 25.00 N ATOM 709 CE2 TRP A 46 23.189 -9.080 2.345 1.00 25.00 C ATOM 710 CE3 TRP A 46 21.146 -9.796 3.480 1.00 25.00 C ATOM 711 CZ2 TRP A 46 23.218 -10.249 1.560 1.00 25.00 C ATOM 712 CZ3 TRP A 46 21.182 -10.983 2.699 1.00 25.00 C ATOM 713 CH2 TRP A 46 22.219 -11.188 1.744 1.00 25.00 C ATOM 0 H TRP A 46 23.613 -6.463 6.828 1.00 25.00 H new ATOM 0 HA TRP A 46 22.418 -4.876 4.615 1.00 25.00 H new ATOM 0 HB2 TRP A 46 21.581 -7.516 5.880 1.00 25.00 H new ATOM 0 HB3 TRP A 46 20.652 -6.651 4.671 1.00 25.00 H new ATOM 0 HD1 TRP A 46 24.070 -6.179 3.510 1.00 25.00 H new ATOM 0 HE1 TRP A 46 24.845 -7.878 1.770 1.00 25.00 H new ATOM 0 HE3 TRP A 46 20.352 -9.634 4.194 1.00 25.00 H new ATOM 0 HZ2 TRP A 46 24.000 -10.408 0.833 1.00 25.00 H new ATOM 0 HZ3 TRP A 46 20.418 -11.735 2.830 1.00 25.00 H new ATOM 0 HH2 TRP A 46 22.225 -12.092 1.153 1.00 25.00 H new ATOM 724 N LEU A 47 20.808 -3.709 6.125 1.00 25.00 N ATOM 725 CA LEU A 47 19.892 -2.985 7.003 1.00 25.00 C ATOM 726 C LEU A 47 18.592 -3.736 6.998 1.00 25.00 C ATOM 727 O LEU A 47 17.993 -3.928 5.949 1.00 25.00 O ATOM 728 CB LEU A 47 19.647 -1.564 6.481 1.00 25.00 C ATOM 729 CG LEU A 47 18.664 -0.704 7.282 1.00 25.00 C ATOM 730 CD1 LEU A 47 19.107 -0.512 8.729 1.00 25.00 C ATOM 731 CD2 LEU A 47 18.496 0.651 6.598 1.00 25.00 C ATOM 0 H LEU A 47 20.946 -3.271 5.214 1.00 25.00 H new ATOM 0 HA LEU A 47 20.315 -2.912 8.005 1.00 25.00 H new ATOM 0 HB2 LEU A 47 20.604 -1.044 6.444 1.00 25.00 H new ATOM 0 HB3 LEU A 47 19.283 -1.635 5.456 1.00 25.00 H new ATOM 0 HG LEU A 47 17.709 -1.229 7.308 1.00 25.00 H new ATOM 0 HD11 LEU A 47 18.377 0.104 9.254 1.00 25.00 H new ATOM 0 HD12 LEU A 47 19.181 -1.483 9.219 1.00 25.00 H new ATOM 0 HD13 LEU A 47 20.079 -0.020 8.750 1.00 25.00 H new ATOM 0 HD21 LEU A 47 17.797 1.262 7.168 1.00 25.00 H new ATOM 0 HD22 LEU A 47 19.461 1.155 6.548 1.00 25.00 H new ATOM 0 HD23 LEU A 47 18.110 0.504 5.589 1.00 25.00 H new ATOM 743 N CYS A 48 18.146 -4.152 8.167 1.00 25.00 N ATOM 744 CA CYS A 48 16.888 -4.864 8.287 1.00 25.00 C ATOM 745 C CYS A 48 16.062 -4.310 9.431 1.00 25.00 C ATOM 746 O CYS A 48 16.540 -3.507 10.225 1.00 25.00 O ATOM 747 CB CYS A 48 17.147 -6.357 8.497 1.00 25.00 C ATOM 748 SG CYS A 48 18.364 -7.062 7.347 1.00 25.00 S ATOM 0 H CYS A 48 18.637 -4.009 9.049 1.00 25.00 H new ATOM 0 HA CYS A 48 16.326 -4.727 7.363 1.00 25.00 H new ATOM 0 HB2 CYS A 48 17.493 -6.516 9.519 1.00 25.00 H new ATOM 0 HB3 CYS A 48 16.206 -6.897 8.391 1.00 25.00 H new ATOM 0 HG CYS A 48 19.486 -6.413 7.451 1.00 25.00 H new ATOM 754 N SER A 49 14.828 -4.774 9.524 1.00 25.00 N ATOM 755 CA SER A 49 13.947 -4.413 10.618 1.00 25.00 C ATOM 756 C SER A 49 13.361 -5.696 11.189 1.00 25.00 C ATOM 757 O SER A 49 12.937 -6.587 10.450 1.00 25.00 O ATOM 758 CB SER A 49 12.863 -3.458 10.126 1.00 25.00 C ATOM 759 OG SER A 49 11.565 -4.028 10.186 1.00 25.00 O ATOM 0 H SER A 49 14.410 -5.410 8.845 1.00 25.00 H new ATOM 0 HA SER A 49 14.493 -3.891 11.403 1.00 25.00 H new ATOM 0 HB2 SER A 49 12.885 -2.549 10.727 1.00 25.00 H new ATOM 0 HB3 SER A 49 13.080 -3.166 9.099 1.00 25.00 H new ATOM 0 HG SER A 49 10.907 -3.378 9.862 1.00 25.00 H new ATOM 765 N LEU A 50 13.416 -5.809 12.508 1.00 25.00 N ATOM 766 CA LEU A 50 12.956 -6.990 13.225 1.00 25.00 C ATOM 767 C LEU A 50 12.375 -6.521 14.550 1.00 25.00 C ATOM 768 O LEU A 50 12.983 -5.701 15.220 1.00 25.00 O ATOM 769 CB LEU A 50 14.137 -7.918 13.495 1.00 25.00 C ATOM 770 CG LEU A 50 13.798 -9.213 14.239 1.00 25.00 C ATOM 771 CD1 LEU A 50 13.925 -10.395 13.328 1.00 25.00 C ATOM 772 CD2 LEU A 50 14.709 -9.365 15.450 1.00 25.00 C ATOM 0 H LEU A 50 13.784 -5.078 13.116 1.00 25.00 H new ATOM 0 HA LEU A 50 12.211 -7.528 12.640 1.00 25.00 H new ATOM 0 HB2 LEU A 50 14.599 -8.177 12.542 1.00 25.00 H new ATOM 0 HB3 LEU A 50 14.882 -7.371 14.073 1.00 25.00 H new ATOM 0 HG LEU A 50 12.764 -9.163 14.581 1.00 25.00 H new ATOM 0 HD11 LEU A 50 13.680 -11.305 13.876 1.00 25.00 H new ATOM 0 HD12 LEU A 50 13.240 -10.282 12.488 1.00 25.00 H new ATOM 0 HD13 LEU A 50 14.948 -10.460 12.956 1.00 25.00 H new ATOM 0 HD21 LEU A 50 14.464 -10.288 15.976 1.00 25.00 H new ATOM 0 HD22 LEU A 50 15.748 -9.399 15.122 1.00 25.00 H new ATOM 0 HD23 LEU A 50 14.568 -8.517 16.120 1.00 25.00 H new ATOM 784 N HIS A 51 11.183 -7.011 14.887 1.00 25.00 N ATOM 785 CA HIS A 51 10.494 -6.661 16.148 1.00 25.00 C ATOM 786 C HIS A 51 10.302 -5.142 16.324 1.00 25.00 C ATOM 787 O HIS A 51 10.267 -4.634 17.436 1.00 25.00 O ATOM 788 CB HIS A 51 11.252 -7.227 17.363 1.00 25.00 C ATOM 789 CG HIS A 51 11.420 -8.718 17.329 1.00 25.00 C ATOM 790 ND1 HIS A 51 12.339 -9.411 18.082 1.00 25.00 N ATOM 791 CD2 HIS A 51 10.772 -9.676 16.609 1.00 25.00 C ATOM 792 CE1 HIS A 51 12.216 -10.707 17.801 1.00 25.00 C ATOM 793 NE2 HIS A 51 11.268 -10.924 16.915 1.00 25.00 N ATOM 0 H HIS A 51 10.660 -7.662 14.301 1.00 25.00 H new ATOM 0 HA HIS A 51 9.504 -7.114 16.088 1.00 25.00 H new ATOM 0 HB2 HIS A 51 12.236 -6.761 17.416 1.00 25.00 H new ATOM 0 HB3 HIS A 51 10.719 -6.951 18.273 1.00 25.00 H new ATOM 0 HD2 HIS A 51 9.981 -9.484 15.899 1.00 25.00 H new ATOM 0 HE1 HIS A 51 12.820 -11.484 18.246 1.00 25.00 H new ATOM 0 HE2 HIS A 51 10.966 -11.822 16.537 1.00 25.00 H new ATOM 801 N GLY A 52 10.181 -4.427 15.211 1.00 25.00 N ATOM 802 CA GLY A 52 10.008 -2.975 15.264 1.00 25.00 C ATOM 803 C GLY A 52 11.298 -2.202 15.506 1.00 25.00 C ATOM 804 O GLY A 52 11.263 -1.000 15.729 1.00 25.00 O ATOM 0 H GLY A 52 10.199 -4.821 14.270 1.00 25.00 H new ATOM 0 HA2 GLY A 52 9.566 -2.638 14.326 1.00 25.00 H new ATOM 0 HA3 GLY A 52 9.299 -2.733 16.055 1.00 25.00 H new ATOM 808 N ARG A 53 12.439 -2.880 15.452 1.00 25.00 N ATOM 809 CA ARG A 53 13.737 -2.249 15.669 1.00 25.00 C ATOM 810 C ARG A 53 14.481 -2.375 14.362 1.00 25.00 C ATOM 811 O ARG A 53 14.437 -3.420 13.719 1.00 25.00 O ATOM 812 CB ARG A 53 14.484 -2.983 16.791 1.00 25.00 C ATOM 813 CG ARG A 53 15.413 -2.112 17.656 1.00 25.00 C ATOM 814 CD ARG A 53 16.737 -1.772 16.980 1.00 25.00 C ATOM 815 NE ARG A 53 17.773 -1.442 17.971 1.00 25.00 N ATOM 816 CZ ARG A 53 19.035 -1.117 17.696 1.00 25.00 C ATOM 817 NH1 ARG A 53 19.493 -1.008 16.478 1.00 25.00 N ATOM 818 NH2 ARG A 53 19.848 -0.882 18.681 1.00 25.00 N ATOM 0 H ARG A 53 12.491 -3.880 15.257 1.00 25.00 H new ATOM 0 HA ARG A 53 13.642 -1.205 15.967 1.00 25.00 H new ATOM 0 HB2 ARG A 53 13.749 -3.456 17.443 1.00 25.00 H new ATOM 0 HB3 ARG A 53 15.076 -3.782 16.346 1.00 25.00 H new ATOM 0 HG2 ARG A 53 14.896 -1.186 17.910 1.00 25.00 H new ATOM 0 HG3 ARG A 53 15.616 -2.631 18.593 1.00 25.00 H new ATOM 0 HD2 ARG A 53 17.066 -2.616 16.374 1.00 25.00 H new ATOM 0 HD3 ARG A 53 16.596 -0.929 16.303 1.00 25.00 H new ATOM 0 HE ARG A 53 17.501 -1.464 18.954 1.00 25.00 H new ATOM 0 HH11 ARG A 53 18.875 -1.175 15.684 1.00 25.00 H new ATOM 0 HH12 ARG A 53 20.469 -0.756 16.321 1.00 25.00 H new ATOM 0 HH21 ARG A 53 19.516 -0.948 19.643 1.00 25.00 H new ATOM 0 HH22 ARG A 53 20.819 -0.632 18.492 1.00 25.00 H new ATOM 832 N GLN A 54 15.142 -1.313 13.951 1.00 25.00 N ATOM 833 CA GLN A 54 15.907 -1.316 12.716 1.00 25.00 C ATOM 834 C GLN A 54 17.381 -1.451 13.041 1.00 25.00 C ATOM 835 O GLN A 54 17.828 -0.944 14.066 1.00 25.00 O ATOM 836 CB GLN A 54 15.662 -0.012 11.960 1.00 25.00 C ATOM 837 CG GLN A 54 14.923 -0.218 10.676 1.00 25.00 C ATOM 838 CD GLN A 54 14.534 1.081 9.998 1.00 25.00 C ATOM 839 OE1 GLN A 54 13.382 1.279 9.662 1.00 25.00 O ATOM 840 NE2 GLN A 54 15.486 1.957 9.782 1.00 25.00 N ATOM 0 H GLN A 54 15.166 -0.428 14.458 1.00 25.00 H new ATOM 0 HA GLN A 54 15.595 -2.154 12.093 1.00 25.00 H new ATOM 0 HB2 GLN A 54 15.096 0.670 12.595 1.00 25.00 H new ATOM 0 HB3 GLN A 54 16.619 0.467 11.751 1.00 25.00 H new ATOM 0 HG2 GLN A 54 15.543 -0.804 9.997 1.00 25.00 H new ATOM 0 HG3 GLN A 54 14.024 -0.802 10.871 1.00 25.00 H new ATOM 0 HE21 GLN A 54 16.441 1.756 10.078 1.00 25.00 H new ATOM 0 HE22 GLN A 54 15.271 2.840 9.318 1.00 25.00 H new ATOM 849 N GLY A 55 18.131 -2.127 12.190 1.00 25.00 N ATOM 850 CA GLY A 55 19.557 -2.264 12.414 1.00 25.00 C ATOM 851 C GLY A 55 20.261 -3.092 11.360 1.00 25.00 C ATOM 852 O GLY A 55 19.612 -3.696 10.516 1.00 25.00 O ATOM 0 H GLY A 55 17.782 -2.584 11.348 1.00 25.00 H new ATOM 0 HA2 GLY A 55 20.008 -1.272 12.445 1.00 25.00 H new ATOM 0 HA3 GLY A 55 19.720 -2.720 13.391 1.00 25.00 H new ATOM 856 N ILE A 56 21.584 -3.102 11.391 1.00 25.00 N ATOM 857 CA ILE A 56 22.387 -3.845 10.431 1.00 25.00 C ATOM 858 C ILE A 56 22.512 -5.294 10.879 1.00 25.00 C ATOM 859 O ILE A 56 22.348 -5.621 12.059 1.00 25.00 O ATOM 860 CB ILE A 56 23.805 -3.201 10.232 1.00 25.00 C ATOM 861 CG1 ILE A 56 24.628 -3.281 11.535 1.00 25.00 C ATOM 862 CG2 ILE A 56 23.631 -1.728 9.807 1.00 25.00 C ATOM 863 CD1 ILE A 56 26.028 -2.684 11.452 1.00 25.00 C ATOM 0 H ILE A 56 22.133 -2.594 12.084 1.00 25.00 H new ATOM 0 HA ILE A 56 21.881 -3.808 9.466 1.00 25.00 H new ATOM 0 HB ILE A 56 24.342 -3.749 9.458 1.00 25.00 H new ATOM 0 HG12 ILE A 56 24.078 -2.771 12.326 1.00 25.00 H new ATOM 0 HG13 ILE A 56 24.713 -4.327 11.830 1.00 25.00 H new ATOM 0 HG21 ILE A 56 24.611 -1.272 9.666 1.00 25.00 H new ATOM 0 HG22 ILE A 56 23.072 -1.683 8.872 1.00 25.00 H new ATOM 0 HG23 ILE A 56 23.087 -1.188 10.582 1.00 25.00 H new ATOM 0 HD11 ILE A 56 26.526 -2.788 12.416 1.00 25.00 H new ATOM 0 HD12 ILE A 56 26.602 -3.208 10.688 1.00 25.00 H new ATOM 0 HD13 ILE A 56 25.958 -1.628 11.192 1.00 25.00 H new ATOM 875 N VAL A 57 22.740 -6.162 9.915 1.00 25.00 N ATOM 876 CA VAL A 57 22.860 -7.595 10.148 1.00 25.00 C ATOM 877 C VAL A 57 23.937 -8.121 9.209 1.00 25.00 C ATOM 878 O VAL A 57 23.999 -7.706 8.054 1.00 25.00 O ATOM 879 CB VAL A 57 21.527 -8.314 9.779 1.00 25.00 C ATOM 880 CG1 VAL A 57 21.632 -9.801 9.941 1.00 25.00 C ATOM 881 CG2 VAL A 57 20.368 -7.762 10.611 1.00 25.00 C ATOM 0 H VAL A 57 22.849 -5.895 8.937 1.00 25.00 H new ATOM 0 HA VAL A 57 23.098 -7.778 11.196 1.00 25.00 H new ATOM 0 HB VAL A 57 21.329 -8.113 8.726 1.00 25.00 H new ATOM 0 HG11 VAL A 57 20.682 -10.264 9.674 1.00 25.00 H new ATOM 0 HG12 VAL A 57 22.418 -10.183 9.290 1.00 25.00 H new ATOM 0 HG13 VAL A 57 21.872 -10.038 10.977 1.00 25.00 H new ATOM 0 HG21 VAL A 57 19.447 -8.277 10.338 1.00 25.00 H new ATOM 0 HG22 VAL A 57 20.572 -7.920 11.670 1.00 25.00 H new ATOM 0 HG23 VAL A 57 20.258 -6.695 10.418 1.00 25.00 H new ATOM 891 N PRO A 58 24.790 -9.050 9.667 1.00 25.00 N ATOM 892 CA PRO A 58 25.765 -9.590 8.721 1.00 25.00 C ATOM 893 C PRO A 58 25.087 -10.457 7.644 1.00 25.00 C ATOM 894 O PRO A 58 24.413 -11.441 7.952 1.00 25.00 O ATOM 895 CB PRO A 58 26.693 -10.410 9.623 1.00 25.00 C ATOM 896 CG PRO A 58 25.826 -10.831 10.767 1.00 25.00 C ATOM 897 CD PRO A 58 24.899 -9.673 10.997 1.00 25.00 C ATOM 0 HA PRO A 58 26.293 -8.822 8.156 1.00 25.00 H new ATOM 0 HB2 PRO A 58 27.100 -11.272 9.095 1.00 25.00 H new ATOM 0 HB3 PRO A 58 27.541 -9.816 9.965 1.00 25.00 H new ATOM 0 HG2 PRO A 58 25.272 -11.739 10.529 1.00 25.00 H new ATOM 0 HG3 PRO A 58 26.420 -11.044 11.656 1.00 25.00 H new ATOM 0 HD2 PRO A 58 23.928 -10.003 11.366 1.00 25.00 H new ATOM 0 HD3 PRO A 58 25.301 -8.978 11.734 1.00 25.00 H new ATOM 905 N GLY A 59 25.274 -10.097 6.380 1.00 25.00 N ATOM 906 CA GLY A 59 24.660 -10.820 5.275 1.00 25.00 C ATOM 907 C GLY A 59 25.072 -12.274 5.196 1.00 25.00 C ATOM 908 O GLY A 59 24.323 -13.116 4.720 1.00 25.00 O ATOM 0 H GLY A 59 25.849 -9.304 6.095 1.00 25.00 H new ATOM 0 HA2 GLY A 59 23.576 -10.764 5.373 1.00 25.00 H new ATOM 0 HA3 GLY A 59 24.921 -10.326 4.339 1.00 25.00 H new ATOM 912 N ASN A 60 26.242 -12.587 5.741 1.00 25.00 N ATOM 913 CA ASN A 60 26.754 -13.963 5.791 1.00 25.00 C ATOM 914 C ASN A 60 25.863 -14.884 6.645 1.00 25.00 C ATOM 915 O ASN A 60 25.964 -16.105 6.574 1.00 25.00 O ATOM 916 CB ASN A 60 28.178 -13.945 6.372 1.00 25.00 C ATOM 917 CG ASN A 60 29.052 -15.056 5.825 1.00 25.00 C ATOM 918 OD1 ASN A 60 28.596 -15.944 5.131 1.00 25.00 O ATOM 919 ND2 ASN A 60 30.325 -14.978 6.106 1.00 25.00 N ATOM 0 H ASN A 60 26.866 -11.899 6.162 1.00 25.00 H new ATOM 0 HA ASN A 60 26.755 -14.359 4.775 1.00 25.00 H new ATOM 0 HB2 ASN A 60 28.642 -12.983 6.153 1.00 25.00 H new ATOM 0 HB3 ASN A 60 28.123 -14.033 7.457 1.00 25.00 H new ATOM 0 HD21 ASN A 60 30.972 -15.676 5.740 1.00 25.00 H new ATOM 0 HD22 ASN A 60 30.672 -14.219 6.692 1.00 25.00 H new ATOM 926 N ARG A 61 24.978 -14.301 7.448 1.00 25.00 N ATOM 927 CA ARG A 61 24.076 -15.075 8.295 1.00 25.00 C ATOM 928 C ARG A 61 22.623 -14.940 7.858 1.00 25.00 C ATOM 929 O ARG A 61 21.715 -15.397 8.563 1.00 25.00 O ATOM 930 CB ARG A 61 24.235 -14.649 9.759 1.00 25.00 C ATOM 931 CG ARG A 61 25.646 -14.850 10.311 1.00 25.00 C ATOM 932 CD ARG A 61 25.676 -14.623 11.812 1.00 25.00 C ATOM 933 NE ARG A 61 27.031 -14.828 12.359 1.00 25.00 N ATOM 934 CZ ARG A 61 27.354 -14.798 13.649 1.00 25.00 C ATOM 935 NH1 ARG A 61 26.478 -14.587 14.594 1.00 25.00 N ATOM 936 NH2 ARG A 61 28.594 -15.000 13.990 1.00 25.00 N ATOM 0 H ARG A 61 24.866 -13.290 7.530 1.00 25.00 H new ATOM 0 HA ARG A 61 24.348 -16.126 8.192 1.00 25.00 H new ATOM 0 HB2 ARG A 61 23.965 -13.597 9.853 1.00 25.00 H new ATOM 0 HB3 ARG A 61 23.532 -15.215 10.370 1.00 25.00 H new ATOM 0 HG2 ARG A 61 25.989 -15.859 10.085 1.00 25.00 H new ATOM 0 HG3 ARG A 61 26.334 -14.162 9.821 1.00 25.00 H new ATOM 0 HD2 ARG A 61 25.341 -13.610 12.035 1.00 25.00 H new ATOM 0 HD3 ARG A 61 24.978 -15.304 12.299 1.00 25.00 H new ATOM 0 HE ARG A 61 27.782 -15.008 11.693 1.00 25.00 H new ATOM 0 HH11 ARG A 61 25.498 -14.436 14.356 1.00 25.00 H new ATOM 0 HH12 ARG A 61 26.774 -14.573 15.570 1.00 25.00 H new ATOM 0 HH21 ARG A 61 29.298 -15.177 13.273 1.00 25.00 H new ATOM 0 HH22 ARG A 61 28.862 -14.981 14.974 1.00 25.00 H new ATOM 950 N LEU A 62 22.388 -14.341 6.697 1.00 25.00 N ATOM 951 CA LEU A 62 21.030 -14.137 6.196 1.00 25.00 C ATOM 952 C LEU A 62 20.787 -14.701 4.817 1.00 25.00 C ATOM 953 O LEU A 62 21.665 -14.762 3.972 1.00 25.00 O ATOM 954 CB LEU A 62 20.711 -12.651 6.130 1.00 25.00 C ATOM 955 CG LEU A 62 19.988 -12.068 7.344 1.00 25.00 C ATOM 956 CD1 LEU A 62 19.759 -10.605 7.083 1.00 25.00 C ATOM 957 CD2 LEU A 62 18.659 -12.748 7.627 1.00 25.00 C ATOM 0 H LEU A 62 23.120 -13.987 6.082 1.00 25.00 H new ATOM 0 HA LEU A 62 20.390 -14.669 6.900 1.00 25.00 H new ATOM 0 HB2 LEU A 62 21.644 -12.105 5.990 1.00 25.00 H new ATOM 0 HB3 LEU A 62 20.100 -12.469 5.246 1.00 25.00 H new ATOM 0 HG LEU A 62 20.611 -12.230 8.223 1.00 25.00 H new ATOM 0 HD11 LEU A 62 19.243 -10.160 7.934 1.00 25.00 H new ATOM 0 HD12 LEU A 62 20.718 -10.107 6.938 1.00 25.00 H new ATOM 0 HD13 LEU A 62 19.150 -10.486 6.187 1.00 25.00 H new ATOM 0 HD21 LEU A 62 18.194 -12.290 8.500 1.00 25.00 H new ATOM 0 HD22 LEU A 62 18.002 -12.635 6.765 1.00 25.00 H new ATOM 0 HD23 LEU A 62 18.826 -13.808 7.819 1.00 25.00 H new ATOM 969 N LYS A 63 19.537 -15.067 4.585 1.00 25.00 N ATOM 970 CA LYS A 63 19.120 -15.566 3.278 1.00 25.00 C ATOM 971 C LYS A 63 17.913 -14.825 2.779 1.00 25.00 C ATOM 972 O LYS A 63 16.850 -14.908 3.374 1.00 25.00 O ATOM 973 CB LYS A 63 18.795 -17.057 3.363 1.00 25.00 C ATOM 974 CG LYS A 63 18.356 -17.685 2.031 1.00 25.00 C ATOM 975 CD LYS A 63 18.299 -19.213 2.109 1.00 25.00 C ATOM 976 CE LYS A 63 19.707 -19.804 2.138 1.00 25.00 C ATOM 977 NZ LYS A 63 19.723 -21.310 2.212 1.00 25.00 N ATOM 0 H LYS A 63 18.792 -15.029 5.281 1.00 25.00 H new ATOM 0 HA LYS A 63 19.943 -15.408 2.581 1.00 25.00 H new ATOM 0 HB2 LYS A 63 19.673 -17.588 3.730 1.00 25.00 H new ATOM 0 HB3 LYS A 63 18.004 -17.203 4.098 1.00 25.00 H new ATOM 0 HG2 LYS A 63 17.375 -17.299 1.754 1.00 25.00 H new ATOM 0 HG3 LYS A 63 19.049 -17.388 1.244 1.00 25.00 H new ATOM 0 HD2 LYS A 63 17.753 -19.517 3.002 1.00 25.00 H new ATOM 0 HD3 LYS A 63 17.752 -19.606 1.252 1.00 25.00 H new ATOM 0 HE2 LYS A 63 20.245 -19.486 1.245 1.00 25.00 H new ATOM 0 HE3 LYS A 63 20.245 -19.400 2.995 1.00 25.00 H new ATOM 0 HZ1 LYS A 63 20.707 -21.646 2.228 1.00 25.00 H new ATOM 0 HZ2 LYS A 63 19.237 -21.620 3.077 1.00 25.00 H new ATOM 0 HZ3 LYS A 63 19.237 -21.704 1.381 1.00 25.00 H new ATOM 991 N ILE A 64 18.073 -14.158 1.651 1.00 25.00 N ATOM 992 CA ILE A 64 16.981 -13.423 1.041 1.00 25.00 C ATOM 993 C ILE A 64 15.957 -14.428 0.525 1.00 25.00 C ATOM 994 O ILE A 64 16.285 -15.358 -0.234 1.00 25.00 O ATOM 995 CB ILE A 64 17.480 -12.551 -0.140 1.00 25.00 C ATOM 996 CG1 ILE A 64 18.603 -11.589 0.299 1.00 25.00 C ATOM 997 CG2 ILE A 64 16.337 -11.754 -0.738 1.00 25.00 C ATOM 998 CD1 ILE A 64 18.194 -10.497 1.313 1.00 25.00 C ATOM 0 H ILE A 64 18.953 -14.110 1.137 1.00 25.00 H new ATOM 0 HA ILE A 64 16.539 -12.761 1.786 1.00 25.00 H new ATOM 0 HB ILE A 64 17.882 -13.229 -0.893 1.00 25.00 H new ATOM 0 HG12 ILE A 64 19.411 -12.178 0.734 1.00 25.00 H new ATOM 0 HG13 ILE A 64 19.006 -11.101 -0.589 1.00 25.00 H new ATOM 0 HG21 ILE A 64 16.709 -11.149 -1.565 1.00 25.00 H new ATOM 0 HG22 ILE A 64 15.570 -12.436 -1.104 1.00 25.00 H new ATOM 0 HG23 ILE A 64 15.910 -11.103 0.024 1.00 25.00 H new ATOM 0 HD11 ILE A 64 19.060 -9.879 1.551 1.00 25.00 H new ATOM 0 HD12 ILE A 64 17.411 -9.874 0.881 1.00 25.00 H new ATOM 0 HD13 ILE A 64 17.822 -10.967 2.224 1.00 25.00 H new ATOM 1010 N LEU A 65 14.718 -14.269 0.949 1.00 25.00 N ATOM 1011 CA LEU A 65 13.655 -15.191 0.561 1.00 25.00 C ATOM 1012 C LEU A 65 12.912 -14.675 -0.669 1.00 25.00 C ATOM 1013 O LEU A 65 11.785 -14.225 -0.586 1.00 25.00 O ATOM 1014 CB LEU A 65 12.693 -15.408 1.734 1.00 25.00 C ATOM 1015 CG LEU A 65 13.327 -15.914 3.044 1.00 25.00 C ATOM 1016 CD1 LEU A 65 12.217 -16.094 4.073 1.00 25.00 C ATOM 1017 CD2 LEU A 65 14.126 -17.240 2.861 1.00 25.00 C ATOM 0 H LEU A 65 14.417 -13.512 1.562 1.00 25.00 H new ATOM 0 HA LEU A 65 14.102 -16.150 0.300 1.00 25.00 H new ATOM 0 HB2 LEU A 65 12.185 -14.466 1.940 1.00 25.00 H new ATOM 0 HB3 LEU A 65 11.929 -16.121 1.424 1.00 25.00 H new ATOM 0 HG LEU A 65 14.052 -15.174 3.382 1.00 25.00 H new ATOM 0 HD11 LEU A 65 12.644 -16.452 5.010 1.00 25.00 H new ATOM 0 HD12 LEU A 65 11.720 -15.139 4.243 1.00 25.00 H new ATOM 0 HD13 LEU A 65 11.492 -16.820 3.703 1.00 25.00 H new ATOM 0 HD21 LEU A 65 14.548 -17.545 3.818 1.00 25.00 H new ATOM 0 HD22 LEU A 65 13.458 -18.019 2.494 1.00 25.00 H new ATOM 0 HD23 LEU A 65 14.931 -17.084 2.143 1.00 25.00 H new ATOM 1029 N VAL A 66 13.570 -14.785 -1.819 1.00 25.00 N ATOM 1030 CA VAL A 66 12.983 -14.361 -3.101 1.00 25.00 C ATOM 1031 C VAL A 66 11.729 -15.195 -3.415 1.00 25.00 C ATOM 1032 O VAL A 66 10.780 -14.702 -4.005 1.00 25.00 O ATOM 1033 CB VAL A 66 14.021 -14.519 -4.266 1.00 25.00 C ATOM 1034 CG1 VAL A 66 13.465 -13.959 -5.584 1.00 25.00 C ATOM 1035 CG2 VAL A 66 15.335 -13.789 -3.919 1.00 25.00 C ATOM 0 H VAL A 66 14.514 -15.165 -1.897 1.00 25.00 H new ATOM 0 HA VAL A 66 12.706 -13.310 -3.015 1.00 25.00 H new ATOM 0 HB VAL A 66 14.216 -15.584 -4.391 1.00 25.00 H new ATOM 0 HG11 VAL A 66 14.207 -14.082 -6.373 1.00 25.00 H new ATOM 0 HG12 VAL A 66 12.556 -14.497 -5.853 1.00 25.00 H new ATOM 0 HG13 VAL A 66 13.238 -12.900 -5.462 1.00 25.00 H new ATOM 0 HG21 VAL A 66 16.045 -13.908 -4.738 1.00 25.00 H new ATOM 0 HG22 VAL A 66 15.133 -12.729 -3.766 1.00 25.00 H new ATOM 0 HG23 VAL A 66 15.757 -14.213 -3.008 1.00 25.00 H new ATOM 1045 N GLY A 67 11.730 -16.448 -2.973 1.00 25.00 N ATOM 1046 CA GLY A 67 10.584 -17.326 -3.171 1.00 25.00 C ATOM 1047 C GLY A 67 10.578 -18.009 -4.523 1.00 25.00 C ATOM 1048 O GLY A 67 10.464 -17.350 -5.544 1.00 25.00 O ATOM 0 H GLY A 67 12.511 -16.877 -2.476 1.00 25.00 H new ATOM 0 HA2 GLY A 67 10.577 -18.085 -2.389 1.00 25.00 H new ATOM 0 HA3 GLY A 67 9.668 -16.746 -3.061 1.00 25.00 H new ATOM 1052 N MET A 68 10.687 -19.339 -4.502 1.00 25.00 N ATOM 1053 CA MET A 68 10.680 -20.218 -5.697 1.00 25.00 C ATOM 1054 C MET A 68 11.814 -20.031 -6.731 1.00 25.00 C ATOM 1055 O MET A 68 12.446 -21.016 -7.124 1.00 25.00 O ATOM 1056 CB MET A 68 9.329 -20.149 -6.419 1.00 25.00 C ATOM 1057 CG MET A 68 8.138 -20.452 -5.512 1.00 25.00 C ATOM 1058 SD MET A 68 6.575 -20.446 -6.416 1.00 25.00 S ATOM 1059 CE MET A 68 6.323 -18.656 -6.709 1.00 25.00 C ATOM 0 H MET A 68 10.786 -19.860 -3.631 1.00 25.00 H new ATOM 0 HA MET A 68 10.865 -21.201 -5.264 1.00 25.00 H new ATOM 0 HB2 MET A 68 9.205 -19.155 -6.848 1.00 25.00 H new ATOM 0 HB3 MET A 68 9.333 -20.856 -7.249 1.00 25.00 H new ATOM 0 HG2 MET A 68 8.280 -21.425 -5.041 1.00 25.00 H new ATOM 0 HG3 MET A 68 8.096 -19.714 -4.711 1.00 25.00 H new ATOM 0 HE1 MET A 68 5.345 -18.496 -7.163 1.00 25.00 H new ATOM 0 HE2 MET A 68 6.375 -18.121 -5.761 1.00 25.00 H new ATOM 0 HE3 MET A 68 7.099 -18.284 -7.378 1.00 25.00 H new ATOM 1069 N TYR A 69 12.070 -18.802 -7.159 1.00 25.00 N ATOM 1070 CA TYR A 69 13.114 -18.500 -8.132 1.00 25.00 C ATOM 1071 C TYR A 69 14.453 -19.071 -7.691 1.00 25.00 C ATOM 1072 O TYR A 69 14.773 -19.066 -6.512 1.00 25.00 O ATOM 1073 CB TYR A 69 13.279 -16.986 -8.283 1.00 25.00 C ATOM 1074 CG TYR A 69 12.136 -16.301 -8.998 1.00 25.00 C ATOM 1075 CD1 TYR A 69 11.116 -15.647 -8.285 1.00 25.00 C ATOM 1076 CD2 TYR A 69 12.084 -16.280 -10.410 1.00 25.00 C ATOM 1077 CE1 TYR A 69 10.063 -14.982 -8.962 1.00 25.00 C ATOM 1078 CE2 TYR A 69 11.031 -15.621 -11.088 1.00 25.00 C ATOM 1079 CZ TYR A 69 10.029 -14.975 -10.360 1.00 25.00 C ATOM 1080 OH TYR A 69 9.019 -14.329 -11.031 1.00 25.00 O ATOM 0 H TYR A 69 11.556 -17.981 -6.839 1.00 25.00 H new ATOM 0 HA TYR A 69 12.813 -18.949 -9.079 1.00 25.00 H new ATOM 0 HB2 TYR A 69 13.389 -16.544 -7.293 1.00 25.00 H new ATOM 0 HB3 TYR A 69 14.203 -16.786 -8.826 1.00 25.00 H new ATOM 0 HD1 TYR A 69 11.135 -15.651 -7.205 1.00 25.00 H new ATOM 0 HD2 TYR A 69 12.858 -16.773 -10.979 1.00 25.00 H new ATOM 0 HE1 TYR A 69 9.289 -14.482 -8.399 1.00 25.00 H new ATOM 0 HE2 TYR A 69 11.002 -15.618 -12.168 1.00 25.00 H new ATOM 0 HH TYR A 69 9.154 -14.425 -11.997 1.00 25.00 H new ATOM 1090 N ASP A 70 15.238 -19.521 -8.664 1.00 25.00 N ATOM 1091 CA ASP A 70 16.583 -20.059 -8.437 1.00 25.00 C ATOM 1092 C ASP A 70 16.620 -21.229 -7.440 1.00 25.00 C ATOM 1093 O ASP A 70 17.155 -21.121 -6.335 1.00 25.00 O ATOM 1094 CB ASP A 70 17.555 -18.955 -8.023 1.00 25.00 C ATOM 1095 CG ASP A 70 18.982 -19.451 -7.937 1.00 25.00 C ATOM 1096 OD1 ASP A 70 19.728 -18.926 -7.089 1.00 25.00 O ATOM 1097 OD2 ASP A 70 19.338 -20.394 -8.681 1.00 25.00 O ATOM 0 H ASP A 70 14.959 -19.524 -9.645 1.00 25.00 H new ATOM 0 HA ASP A 70 16.905 -20.470 -9.394 1.00 25.00 H new ATOM 0 HB2 ASP A 70 17.499 -18.137 -8.741 1.00 25.00 H new ATOM 0 HB3 ASP A 70 17.254 -18.552 -7.056 1.00 25.00 H new ATOM 1102 N LYS A 71 16.068 -22.351 -7.890 1.00 25.00 N ATOM 1103 CA LYS A 71 16.196 -23.661 -7.218 1.00 25.00 C ATOM 1104 C LYS A 71 15.783 -23.700 -5.743 1.00 25.00 C ATOM 1105 O LYS A 71 16.303 -24.505 -4.975 1.00 25.00 O ATOM 1106 CB LYS A 71 17.658 -24.158 -7.335 1.00 25.00 C ATOM 1107 CG LYS A 71 18.236 -24.189 -8.775 1.00 25.00 C ATOM 1108 CD LYS A 71 17.716 -25.370 -9.613 1.00 25.00 C ATOM 1109 CE LYS A 71 18.447 -26.676 -9.279 1.00 25.00 C ATOM 1110 NZ LYS A 71 19.904 -26.613 -9.678 1.00 25.00 N ATOM 0 H LYS A 71 15.509 -22.388 -8.743 1.00 25.00 H new ATOM 0 HA LYS A 71 15.490 -24.309 -7.737 1.00 25.00 H new ATOM 0 HB2 LYS A 71 18.292 -23.518 -6.721 1.00 25.00 H new ATOM 0 HB3 LYS A 71 17.717 -25.162 -6.916 1.00 25.00 H new ATOM 0 HG2 LYS A 71 17.986 -23.256 -9.280 1.00 25.00 H new ATOM 0 HG3 LYS A 71 19.323 -24.241 -8.722 1.00 25.00 H new ATOM 0 HD2 LYS A 71 16.648 -25.497 -9.437 1.00 25.00 H new ATOM 0 HD3 LYS A 71 17.840 -25.146 -10.672 1.00 25.00 H new ATOM 0 HE2 LYS A 71 18.370 -26.874 -8.210 1.00 25.00 H new ATOM 0 HE3 LYS A 71 17.963 -27.507 -9.793 1.00 25.00 H new ATOM 0 HZ1 LYS A 71 20.288 -27.577 -9.745 1.00 25.00 H new ATOM 0 HZ2 LYS A 71 19.991 -26.141 -10.601 1.00 25.00 H new ATOM 0 HZ3 LYS A 71 20.437 -26.077 -8.963 1.00 25.00 H new ATOM 1124 N LYS A 72 14.850 -22.854 -5.335 1.00 25.00 N ATOM 1125 CA LYS A 72 14.404 -22.853 -3.937 1.00 25.00 C ATOM 1126 C LYS A 72 13.319 -23.918 -3.791 1.00 25.00 C ATOM 1127 O LYS A 72 12.563 -24.163 -4.731 1.00 25.00 O ATOM 1128 CB LYS A 72 13.933 -21.452 -3.531 1.00 25.00 C ATOM 1129 CG LYS A 72 15.113 -20.483 -3.468 1.00 25.00 C ATOM 1130 CD LYS A 72 14.713 -19.026 -3.267 1.00 25.00 C ATOM 1131 CE LYS A 72 15.966 -18.128 -3.307 1.00 25.00 C ATOM 1132 NZ LYS A 72 16.756 -18.285 -4.588 1.00 25.00 N ATOM 0 H LYS A 72 14.390 -22.168 -5.934 1.00 25.00 H new ATOM 0 HA LYS A 72 15.221 -23.100 -3.259 1.00 25.00 H new ATOM 0 HB2 LYS A 72 13.196 -21.089 -4.247 1.00 25.00 H new ATOM 0 HB3 LYS A 72 13.440 -21.496 -2.560 1.00 25.00 H new ATOM 0 HG2 LYS A 72 15.772 -20.783 -2.654 1.00 25.00 H new ATOM 0 HG3 LYS A 72 15.687 -20.567 -4.391 1.00 25.00 H new ATOM 0 HD2 LYS A 72 14.012 -18.722 -4.044 1.00 25.00 H new ATOM 0 HD3 LYS A 72 14.201 -18.909 -2.312 1.00 25.00 H new ATOM 0 HE2 LYS A 72 15.665 -17.086 -3.196 1.00 25.00 H new ATOM 0 HE3 LYS A 72 16.607 -18.367 -2.458 1.00 25.00 H new ATOM 0 HZ1 LYS A 72 17.195 -17.376 -4.839 1.00 25.00 H new ATOM 0 HZ2 LYS A 72 17.497 -19.002 -4.453 1.00 25.00 H new ATOM 0 HZ3 LYS A 72 16.120 -18.585 -5.354 1.00 25.00 H new ATOM 1146 N PRO A 73 13.288 -24.620 -2.645 1.00 25.00 N ATOM 1147 CA PRO A 73 12.366 -25.759 -2.551 1.00 25.00 C ATOM 1148 C PRO A 73 10.893 -25.375 -2.437 1.00 25.00 C ATOM 1149 O PRO A 73 10.542 -24.332 -1.882 1.00 25.00 O ATOM 1150 CB PRO A 73 12.847 -26.484 -1.287 1.00 25.00 C ATOM 1151 CG PRO A 73 13.423 -25.410 -0.449 1.00 25.00 C ATOM 1152 CD PRO A 73 14.106 -24.483 -1.424 1.00 25.00 C ATOM 0 HA PRO A 73 12.392 -26.362 -3.458 1.00 25.00 H new ATOM 0 HB2 PRO A 73 12.024 -26.987 -0.779 1.00 25.00 H new ATOM 0 HB3 PRO A 73 13.590 -27.246 -1.523 1.00 25.00 H new ATOM 0 HG2 PRO A 73 12.648 -24.890 0.115 1.00 25.00 H new ATOM 0 HG3 PRO A 73 14.130 -25.811 0.277 1.00 25.00 H new ATOM 0 HD2 PRO A 73 14.120 -23.455 -1.061 1.00 25.00 H new ATOM 0 HD3 PRO A 73 15.142 -24.773 -1.598 1.00 25.00 H new ATOM 1160 N ALA A 74 10.036 -26.235 -2.968 1.00 25.00 N ATOM 1161 CA ALA A 74 8.591 -26.047 -2.898 1.00 25.00 C ATOM 1162 C ALA A 74 8.097 -26.442 -1.502 1.00 25.00 C ATOM 1163 O ALA A 74 8.774 -27.172 -0.777 1.00 25.00 O ATOM 1164 CB ALA A 74 7.905 -26.900 -3.981 1.00 25.00 C ATOM 0 H ALA A 74 10.321 -27.082 -3.459 1.00 25.00 H new ATOM 0 HA ALA A 74 8.343 -25.000 -3.076 1.00 25.00 H new ATOM 0 HB1 ALA A 74 6.826 -26.758 -3.927 1.00 25.00 H new ATOM 0 HB2 ALA A 74 8.262 -26.595 -4.965 1.00 25.00 H new ATOM 0 HB3 ALA A 74 8.141 -27.952 -3.819 1.00 25.00 H new ATOM 1170 N GLY A 75 6.907 -25.976 -1.151 1.00 25.00 N ATOM 1171 CA GLY A 75 6.333 -26.280 0.150 1.00 25.00 C ATOM 1172 C GLY A 75 6.962 -25.436 1.238 1.00 25.00 C ATOM 1173 O GLY A 75 6.472 -24.355 1.537 1.00 25.00 O ATOM 0 H GLY A 75 6.323 -25.389 -1.746 1.00 25.00 H new ATOM 0 HA2 GLY A 75 5.258 -26.104 0.126 1.00 25.00 H new ATOM 0 HA3 GLY A 75 6.478 -27.336 0.376 1.00 25.00 H new ATOM 1177 N SER A 76 8.060 -25.925 1.795 1.00 25.00 N ATOM 1178 CA SER A 76 8.832 -25.212 2.825 1.00 25.00 C ATOM 1179 C SER A 76 8.011 -24.730 4.033 1.00 25.00 C ATOM 1180 O SER A 76 8.348 -23.724 4.646 1.00 25.00 O ATOM 1181 CB SER A 76 9.558 -24.020 2.191 1.00 25.00 C ATOM 1182 OG SER A 76 10.403 -24.460 1.144 1.00 25.00 O ATOM 0 H SER A 76 8.451 -26.834 1.549 1.00 25.00 H new ATOM 0 HA SER A 76 9.537 -25.943 3.221 1.00 25.00 H new ATOM 0 HB2 SER A 76 8.831 -23.306 1.805 1.00 25.00 H new ATOM 0 HB3 SER A 76 10.145 -23.499 2.947 1.00 25.00 H new ATOM 0 HG SER A 76 10.023 -24.190 0.282 1.00 25.00 H new ATOM 1188 N GLY A 77 6.962 -25.468 4.386 1.00 25.00 N ATOM 1189 CA GLY A 77 6.122 -25.077 5.515 1.00 25.00 C ATOM 1190 C GLY A 77 6.861 -25.134 6.836 1.00 25.00 C ATOM 1191 O GLY A 77 6.648 -24.310 7.714 1.00 25.00 O ATOM 0 H GLY A 77 6.676 -26.327 3.916 1.00 25.00 H new ATOM 0 HA2 GLY A 77 5.750 -24.065 5.354 1.00 25.00 H new ATOM 0 HA3 GLY A 77 5.252 -25.732 5.561 1.00 25.00 H new ATOM 1195 N GLY A 78 7.778 -26.087 6.959 1.00 25.00 N ATOM 1196 CA GLY A 78 8.602 -26.195 8.153 1.00 25.00 C ATOM 1197 C GLY A 78 9.399 -27.476 8.115 1.00 25.00 C ATOM 1198 O GLY A 78 8.981 -28.430 7.472 1.00 25.00 O ATOM 0 H GLY A 78 7.968 -26.793 6.248 1.00 25.00 H new ATOM 0 HA2 GLY A 78 9.275 -25.340 8.219 1.00 25.00 H new ATOM 0 HA3 GLY A 78 7.972 -26.175 9.043 1.00 25.00 H new ATOM 1202 N SER A 79 10.549 -27.485 8.779 1.00 25.00 N ATOM 1203 CA SER A 79 11.412 -28.665 8.859 1.00 25.00 C ATOM 1204 C SER A 79 12.428 -28.372 9.950 1.00 25.00 C ATOM 1205 O SER A 79 12.730 -27.205 10.202 1.00 25.00 O ATOM 1206 CB SER A 79 12.139 -28.910 7.532 1.00 25.00 C ATOM 1207 OG SER A 79 12.943 -30.075 7.605 1.00 25.00 O ATOM 0 H SER A 79 10.913 -26.674 9.279 1.00 25.00 H new ATOM 0 HA SER A 79 10.824 -29.557 9.074 1.00 25.00 H new ATOM 0 HB2 SER A 79 11.411 -29.015 6.728 1.00 25.00 H new ATOM 0 HB3 SER A 79 12.761 -28.048 7.289 1.00 25.00 H new ATOM 0 HG SER A 79 13.397 -30.214 6.747 1.00 25.00 H new ATOM 1213 N GLY A 80 12.960 -29.408 10.585 1.00 25.00 N ATOM 1214 CA GLY A 80 13.974 -29.234 11.608 1.00 25.00 C ATOM 1215 C GLY A 80 14.304 -30.577 12.215 1.00 25.00 C ATOM 1216 O GLY A 80 13.473 -31.480 12.162 1.00 25.00 O ATOM 0 H GLY A 80 12.703 -30.379 10.407 1.00 25.00 H new ATOM 0 HA2 GLY A 80 14.870 -28.787 11.177 1.00 25.00 H new ATOM 0 HA3 GLY A 80 13.616 -28.551 12.379 1.00 25.00 H new ATOM 1220 N SER A 81 15.499 -30.720 12.764 1.00 25.00 N ATOM 1221 CA SER A 81 15.946 -31.995 13.342 1.00 25.00 C ATOM 1222 C SER A 81 16.527 -31.761 14.732 1.00 25.00 C ATOM 1223 O SER A 81 17.292 -32.563 15.243 1.00 25.00 O ATOM 1224 CB SER A 81 17.007 -32.629 12.438 1.00 25.00 C ATOM 1225 OG SER A 81 16.537 -32.714 11.104 1.00 25.00 O ATOM 0 H SER A 81 16.187 -29.969 12.826 1.00 25.00 H new ATOM 0 HA SER A 81 15.092 -32.668 13.422 1.00 25.00 H new ATOM 0 HB2 SER A 81 17.922 -32.037 12.470 1.00 25.00 H new ATOM 0 HB3 SER A 81 17.258 -33.624 12.805 1.00 25.00 H new ATOM 0 HG SER A 81 17.227 -33.120 10.539 1.00 25.00 H new ATOM 1231 N GLY A 82 16.176 -30.624 15.311 1.00 25.00 N ATOM 1232 CA GLY A 82 16.731 -30.200 16.585 1.00 25.00 C ATOM 1233 C GLY A 82 17.396 -28.863 16.364 1.00 25.00 C ATOM 1234 O GLY A 82 17.261 -28.293 15.280 1.00 25.00 O ATOM 0 H GLY A 82 15.501 -29.972 14.912 1.00 25.00 H new ATOM 0 HA2 GLY A 82 15.947 -30.119 17.338 1.00 25.00 H new ATOM 0 HA3 GLY A 82 17.451 -30.931 16.952 1.00 25.00 H new ATOM 1238 N LEU A 83 18.080 -28.343 17.375 1.00 25.00 N ATOM 1239 CA LEU A 83 18.747 -27.045 17.243 1.00 25.00 C ATOM 1240 C LEU A 83 20.023 -27.191 16.428 1.00 25.00 C ATOM 1241 O LEU A 83 20.292 -26.370 15.558 1.00 25.00 O ATOM 1242 CB LEU A 83 19.094 -26.468 18.621 1.00 25.00 C ATOM 1243 CG LEU A 83 17.911 -26.159 19.557 1.00 25.00 C ATOM 1244 CD1 LEU A 83 18.437 -25.733 20.923 1.00 25.00 C ATOM 1245 CD2 LEU A 83 17.014 -25.054 18.979 1.00 25.00 C ATOM 0 H LEU A 83 18.190 -28.789 18.286 1.00 25.00 H new ATOM 0 HA LEU A 83 18.063 -26.366 16.735 1.00 25.00 H new ATOM 0 HB2 LEU A 83 19.755 -27.171 19.128 1.00 25.00 H new ATOM 0 HB3 LEU A 83 19.660 -25.548 18.473 1.00 25.00 H new ATOM 0 HG LEU A 83 17.311 -27.064 19.657 1.00 25.00 H new ATOM 0 HD11 LEU A 83 17.598 -25.515 21.584 1.00 25.00 H new ATOM 0 HD12 LEU A 83 19.035 -26.538 21.350 1.00 25.00 H new ATOM 0 HD13 LEU A 83 19.054 -24.841 20.813 1.00 25.00 H new ATOM 0 HD21 LEU A 83 16.189 -24.860 19.664 1.00 25.00 H new ATOM 0 HD22 LEU A 83 17.598 -24.143 18.847 1.00 25.00 H new ATOM 0 HD23 LEU A 83 16.618 -25.374 18.015 1.00 25.00 H new ATOM 1257 N THR A 84 20.748 -28.273 16.713 1.00 25.00 N ATOM 1258 CA THR A 84 22.044 -28.617 16.095 1.00 25.00 C ATOM 1259 C THR A 84 23.171 -27.675 16.539 1.00 25.00 C ATOM 1260 O THR A 84 22.994 -26.467 16.640 1.00 25.00 O ATOM 1261 CB THR A 84 21.978 -28.629 14.539 1.00 25.00 C ATOM 1262 OG1 THR A 84 20.673 -29.047 14.123 1.00 25.00 O ATOM 1263 CG2 THR A 84 22.996 -29.589 13.950 1.00 25.00 C ATOM 0 H THR A 84 20.446 -28.962 17.402 1.00 25.00 H new ATOM 0 HA THR A 84 22.267 -29.625 16.445 1.00 25.00 H new ATOM 0 HB THR A 84 22.196 -27.621 14.186 1.00 25.00 H new ATOM 0 HG1 THR A 84 20.628 -29.054 13.144 1.00 25.00 H new ATOM 0 HG21 THR A 84 22.924 -29.574 12.862 1.00 25.00 H new ATOM 0 HG22 THR A 84 23.999 -29.286 14.252 1.00 25.00 H new ATOM 0 HG23 THR A 84 22.797 -30.598 14.313 1.00 25.00 H new ATOM 1271 N ASP A 85 24.339 -28.247 16.790 1.00 25.00 N ATOM 1272 CA ASP A 85 25.522 -27.455 17.119 1.00 25.00 C ATOM 1273 C ASP A 85 26.070 -26.957 15.788 1.00 25.00 C ATOM 1274 O ASP A 85 26.335 -27.747 14.883 1.00 25.00 O ATOM 1275 CB ASP A 85 26.569 -28.313 17.842 1.00 25.00 C ATOM 1276 CG ASP A 85 26.144 -28.673 19.250 1.00 25.00 C ATOM 1277 OD1 ASP A 85 26.115 -29.878 19.571 1.00 25.00 O ATOM 1278 OD2 ASP A 85 25.811 -27.754 20.029 1.00 25.00 O ATOM 0 H ASP A 85 24.496 -29.255 16.773 1.00 25.00 H new ATOM 0 HA ASP A 85 25.274 -26.631 17.788 1.00 25.00 H new ATOM 0 HB2 ASP A 85 26.743 -29.226 17.273 1.00 25.00 H new ATOM 0 HB3 ASP A 85 27.516 -27.774 17.877 1.00 25.00 H new ATOM 1283 N GLU A 86 26.174 -25.648 15.639 1.00 25.00 N ATOM 1284 CA GLU A 86 26.552 -25.049 14.370 1.00 25.00 C ATOM 1285 C GLU A 86 27.338 -23.768 14.631 1.00 25.00 C ATOM 1286 O GLU A 86 26.826 -22.825 15.234 1.00 25.00 O ATOM 1287 CB GLU A 86 25.277 -24.742 13.578 1.00 25.00 C ATOM 1288 CG GLU A 86 25.500 -24.276 12.151 1.00 25.00 C ATOM 1289 CD GLU A 86 24.177 -23.957 11.486 1.00 25.00 C ATOM 1290 OE1 GLU A 86 23.757 -24.688 10.566 1.00 25.00 O ATOM 1291 OE2 GLU A 86 23.494 -23.025 11.961 1.00 25.00 O ATOM 0 H GLU A 86 26.001 -24.975 16.386 1.00 25.00 H new ATOM 0 HA GLU A 86 27.179 -25.732 13.797 1.00 25.00 H new ATOM 0 HB2 GLU A 86 24.656 -25.638 13.558 1.00 25.00 H new ATOM 0 HB3 GLU A 86 24.714 -23.975 14.110 1.00 25.00 H new ATOM 0 HG2 GLU A 86 26.139 -23.393 12.146 1.00 25.00 H new ATOM 0 HG3 GLU A 86 26.021 -25.049 11.586 1.00 25.00 H new ATOM 1298 N LEU A 87 28.591 -23.738 14.205 1.00 25.00 N ATOM 1299 CA LEU A 87 29.415 -22.544 14.380 1.00 25.00 C ATOM 1300 C LEU A 87 29.152 -21.576 13.234 1.00 25.00 C ATOM 1301 O LEU A 87 29.483 -21.838 12.078 1.00 25.00 O ATOM 1302 CB LEU A 87 30.905 -22.893 14.441 1.00 25.00 C ATOM 1303 CG LEU A 87 31.344 -23.754 15.640 1.00 25.00 C ATOM 1304 CD1 LEU A 87 32.821 -24.126 15.483 1.00 25.00 C ATOM 1305 CD2 LEU A 87 31.141 -23.028 16.975 1.00 25.00 C ATOM 0 H LEU A 87 29.059 -24.516 13.740 1.00 25.00 H new ATOM 0 HA LEU A 87 29.146 -22.078 15.328 1.00 25.00 H new ATOM 0 HB2 LEU A 87 31.174 -23.417 13.524 1.00 25.00 H new ATOM 0 HB3 LEU A 87 31.476 -21.965 14.456 1.00 25.00 H new ATOM 0 HG LEU A 87 30.723 -24.650 15.652 1.00 25.00 H new ATOM 0 HD11 LEU A 87 33.135 -24.736 16.330 1.00 25.00 H new ATOM 0 HD12 LEU A 87 32.958 -24.689 14.560 1.00 25.00 H new ATOM 0 HD13 LEU A 87 33.423 -23.218 15.447 1.00 25.00 H new ATOM 0 HD21 LEU A 87 31.464 -23.673 17.792 1.00 25.00 H new ATOM 0 HD22 LEU A 87 31.729 -22.110 16.983 1.00 25.00 H new ATOM 0 HD23 LEU A 87 30.086 -22.785 17.100 1.00 25.00 H new ATOM 1317 N ALA A 88 28.529 -20.462 13.577 1.00 25.00 N ATOM 1318 CA ALA A 88 28.154 -19.452 12.601 1.00 25.00 C ATOM 1319 C ALA A 88 29.392 -18.770 11.999 1.00 25.00 C ATOM 1320 O ALA A 88 30.400 -18.578 12.690 1.00 25.00 O ATOM 1321 CB ALA A 88 27.262 -18.418 13.278 1.00 25.00 C ATOM 0 H ALA A 88 28.269 -20.232 14.536 1.00 25.00 H new ATOM 0 HA ALA A 88 27.615 -19.934 11.785 1.00 25.00 H new ATOM 0 HB1 ALA A 88 26.975 -17.655 12.554 1.00 25.00 H new ATOM 0 HB2 ALA A 88 26.368 -18.906 13.665 1.00 25.00 H new ATOM 0 HB3 ALA A 88 27.805 -17.952 14.100 1.00 25.00 H new ATOM 1327 N PRO A 89 29.316 -18.343 10.725 1.00 25.00 N ATOM 1328 CA PRO A 89 30.476 -17.642 10.167 1.00 25.00 C ATOM 1329 C PRO A 89 30.659 -16.263 10.793 1.00 25.00 C ATOM 1330 O PRO A 89 29.725 -15.707 11.395 1.00 25.00 O ATOM 1331 CB PRO A 89 30.133 -17.547 8.682 1.00 25.00 C ATOM 1332 CG PRO A 89 28.655 -17.483 8.659 1.00 25.00 C ATOM 1333 CD PRO A 89 28.225 -18.438 9.735 1.00 25.00 C ATOM 0 HA PRO A 89 31.418 -18.155 10.358 1.00 25.00 H new ATOM 0 HB2 PRO A 89 30.578 -16.663 8.225 1.00 25.00 H new ATOM 0 HB3 PRO A 89 30.504 -18.411 8.131 1.00 25.00 H new ATOM 0 HG2 PRO A 89 28.298 -16.473 8.858 1.00 25.00 H new ATOM 0 HG3 PRO A 89 28.259 -17.775 7.686 1.00 25.00 H new ATOM 0 HD2 PRO A 89 27.265 -18.154 10.165 1.00 25.00 H new ATOM 0 HD3 PRO A 89 28.115 -19.453 9.353 1.00 25.00 H new ATOM 1341 N PRO A 90 31.868 -15.692 10.681 1.00 25.00 N ATOM 1342 CA PRO A 90 32.083 -14.397 11.334 1.00 25.00 C ATOM 1343 C PRO A 90 31.341 -13.254 10.652 1.00 25.00 C ATOM 1344 O PRO A 90 31.052 -13.304 9.451 1.00 25.00 O ATOM 1345 CB PRO A 90 33.601 -14.207 11.235 1.00 25.00 C ATOM 1346 CG PRO A 90 33.982 -14.945 10.018 1.00 25.00 C ATOM 1347 CD PRO A 90 33.090 -16.161 9.997 1.00 25.00 C ATOM 0 HA PRO A 90 31.703 -14.387 12.355 1.00 25.00 H new ATOM 0 HB2 PRO A 90 33.866 -13.152 11.160 1.00 25.00 H new ATOM 0 HB3 PRO A 90 34.109 -14.601 12.115 1.00 25.00 H new ATOM 0 HG2 PRO A 90 33.837 -14.335 9.126 1.00 25.00 H new ATOM 0 HG3 PRO A 90 35.034 -15.229 10.043 1.00 25.00 H new ATOM 0 HD2 PRO A 90 32.881 -16.490 8.979 1.00 25.00 H new ATOM 0 HD3 PRO A 90 33.545 -17.004 10.517 1.00 25.00 H new ATOM 1355 N LYS A 91 31.035 -12.224 11.421 1.00 25.00 N ATOM 1356 CA LYS A 91 30.412 -11.021 10.891 1.00 25.00 C ATOM 1357 C LYS A 91 31.545 -10.189 10.285 1.00 25.00 C ATOM 1358 O LYS A 91 32.684 -10.279 10.754 1.00 25.00 O ATOM 1359 CB LYS A 91 29.680 -10.251 12.015 1.00 25.00 C ATOM 1360 CG LYS A 91 30.501 -10.025 13.306 1.00 25.00 C ATOM 1361 CD LYS A 91 29.720 -9.247 14.386 1.00 25.00 C ATOM 1362 CE LYS A 91 28.535 -10.047 14.949 1.00 25.00 C ATOM 1363 NZ LYS A 91 27.877 -9.320 16.081 1.00 25.00 N ATOM 0 H LYS A 91 31.210 -12.196 12.426 1.00 25.00 H new ATOM 0 HA LYS A 91 29.659 -11.253 10.138 1.00 25.00 H new ATOM 0 HB2 LYS A 91 29.371 -9.281 11.626 1.00 25.00 H new ATOM 0 HB3 LYS A 91 28.771 -10.795 12.273 1.00 25.00 H new ATOM 0 HG2 LYS A 91 30.806 -10.990 13.710 1.00 25.00 H new ATOM 0 HG3 LYS A 91 31.412 -9.480 13.060 1.00 25.00 H new ATOM 0 HD2 LYS A 91 30.396 -8.985 15.200 1.00 25.00 H new ATOM 0 HD3 LYS A 91 29.354 -8.312 13.962 1.00 25.00 H new ATOM 0 HE2 LYS A 91 27.807 -10.228 14.158 1.00 25.00 H new ATOM 0 HE3 LYS A 91 28.882 -11.022 15.292 1.00 25.00 H new ATOM 0 HZ1 LYS A 91 26.908 -9.677 16.206 1.00 25.00 H new ATOM 0 HZ2 LYS A 91 28.419 -9.475 16.955 1.00 25.00 H new ATOM 0 HZ3 LYS A 91 27.846 -8.302 15.869 1.00 25.00 H new ATOM 1377 N PRO A 92 31.266 -9.406 9.222 1.00 25.00 N ATOM 1378 CA PRO A 92 32.342 -8.574 8.671 1.00 25.00 C ATOM 1379 C PRO A 92 32.711 -7.451 9.647 1.00 25.00 C ATOM 1380 O PRO A 92 31.965 -7.179 10.589 1.00 25.00 O ATOM 1381 CB PRO A 92 31.731 -8.031 7.370 1.00 25.00 C ATOM 1382 CG PRO A 92 30.288 -8.043 7.596 1.00 25.00 C ATOM 1383 CD PRO A 92 29.997 -9.205 8.491 1.00 25.00 C ATOM 0 HA PRO A 92 33.272 -9.116 8.498 1.00 25.00 H new ATOM 0 HB2 PRO A 92 32.089 -7.024 7.156 1.00 25.00 H new ATOM 0 HB3 PRO A 92 32.002 -8.653 6.517 1.00 25.00 H new ATOM 0 HG2 PRO A 92 29.962 -7.110 8.056 1.00 25.00 H new ATOM 0 HG3 PRO A 92 29.750 -8.138 6.653 1.00 25.00 H new ATOM 0 HD2 PRO A 92 29.172 -8.991 9.171 1.00 25.00 H new ATOM 0 HD3 PRO A 92 29.718 -10.091 7.920 1.00 25.00 H new ATOM 1391 N PRO A 93 33.885 -6.817 9.464 1.00 25.00 N ATOM 1392 CA PRO A 93 34.280 -5.765 10.406 1.00 25.00 C ATOM 1393 C PRO A 93 33.449 -4.495 10.259 1.00 25.00 C ATOM 1394 O PRO A 93 32.592 -4.386 9.374 1.00 25.00 O ATOM 1395 CB PRO A 93 35.742 -5.522 10.039 1.00 25.00 C ATOM 1396 CG PRO A 93 35.800 -5.798 8.594 1.00 25.00 C ATOM 1397 CD PRO A 93 34.912 -7.007 8.418 1.00 25.00 C ATOM 0 HA PRO A 93 34.128 -6.056 11.445 1.00 25.00 H new ATOM 0 HB2 PRO A 93 36.044 -4.499 10.262 1.00 25.00 H new ATOM 0 HB3 PRO A 93 36.408 -6.180 10.598 1.00 25.00 H new ATOM 0 HG2 PRO A 93 35.441 -4.950 8.011 1.00 25.00 H new ATOM 0 HG3 PRO A 93 36.820 -6.001 8.267 1.00 25.00 H new ATOM 0 HD2 PRO A 93 34.472 -7.043 7.421 1.00 25.00 H new ATOM 0 HD3 PRO A 93 35.463 -7.937 8.557 1.00 25.00 H new ATOM 1405 N LEU A 94 33.712 -3.537 11.132 1.00 25.00 N ATOM 1406 CA LEU A 94 33.008 -2.263 11.153 1.00 25.00 C ATOM 1407 C LEU A 94 34.035 -1.140 11.291 1.00 25.00 C ATOM 1408 O LEU A 94 35.167 -1.390 11.726 1.00 25.00 O ATOM 1409 CB LEU A 94 32.027 -2.236 12.340 1.00 25.00 C ATOM 1410 CG LEU A 94 30.657 -2.892 12.094 1.00 25.00 C ATOM 1411 CD1 LEU A 94 29.833 -2.775 13.344 1.00 25.00 C ATOM 1412 CD2 LEU A 94 29.886 -2.228 10.958 1.00 25.00 C ATOM 0 H LEU A 94 34.427 -3.621 11.854 1.00 25.00 H new ATOM 0 HA LEU A 94 32.443 -2.129 10.231 1.00 25.00 H new ATOM 0 HB2 LEU A 94 32.499 -2.732 13.188 1.00 25.00 H new ATOM 0 HB3 LEU A 94 31.864 -1.198 12.629 1.00 25.00 H new ATOM 0 HG LEU A 94 30.838 -3.931 11.820 1.00 25.00 H new ATOM 0 HD11 LEU A 94 28.859 -3.237 13.182 1.00 25.00 H new ATOM 0 HD12 LEU A 94 30.342 -3.281 14.164 1.00 25.00 H new ATOM 0 HD13 LEU A 94 29.699 -1.723 13.594 1.00 25.00 H new ATOM 0 HD21 LEU A 94 28.927 -2.730 10.827 1.00 25.00 H new ATOM 0 HD22 LEU A 94 29.716 -1.178 11.198 1.00 25.00 H new ATOM 0 HD23 LEU A 94 30.463 -2.301 10.036 1.00 25.00 H new ATOM 1424 N PRO A 95 33.659 0.100 10.916 1.00 25.00 N ATOM 1425 CA PRO A 95 34.559 1.249 11.050 1.00 25.00 C ATOM 1426 C PRO A 95 34.706 1.674 12.513 1.00 25.00 C ATOM 1427 O PRO A 95 34.181 1.014 13.410 1.00 25.00 O ATOM 1428 CB PRO A 95 33.851 2.325 10.218 1.00 25.00 C ATOM 1429 CG PRO A 95 32.428 2.015 10.395 1.00 25.00 C ATOM 1430 CD PRO A 95 32.358 0.512 10.357 1.00 25.00 C ATOM 0 HA PRO A 95 35.576 1.046 10.716 1.00 25.00 H new ATOM 0 HB2 PRO A 95 34.090 3.328 10.572 1.00 25.00 H new ATOM 0 HB3 PRO A 95 34.144 2.279 9.169 1.00 25.00 H new ATOM 0 HG2 PRO A 95 32.052 2.405 11.341 1.00 25.00 H new ATOM 0 HG3 PRO A 95 31.824 2.460 9.604 1.00 25.00 H new ATOM 0 HD2 PRO A 95 31.526 0.132 10.951 1.00 25.00 H new ATOM 0 HD3 PRO A 95 32.220 0.141 9.341 1.00 25.00 H new ATOM 1438 N GLU A 96 35.439 2.764 12.733 1.00 25.00 N ATOM 1439 CA GLU A 96 35.716 3.318 14.051 1.00 25.00 C ATOM 1440 C GLU A 96 36.397 2.362 15.036 1.00 25.00 C ATOM 1441 O GLU A 96 36.546 2.656 16.217 1.00 25.00 O ATOM 1442 CB GLU A 96 34.437 3.908 14.606 1.00 25.00 C ATOM 1443 CG GLU A 96 34.558 5.376 14.916 1.00 25.00 C ATOM 1444 CD GLU A 96 34.705 6.223 13.658 1.00 25.00 C ATOM 1445 OE1 GLU A 96 33.672 6.601 13.061 1.00 25.00 O ATOM 1446 OE2 GLU A 96 35.858 6.493 13.254 1.00 25.00 O ATOM 0 H GLU A 96 35.867 3.298 11.977 1.00 25.00 H new ATOM 0 HA GLU A 96 36.466 4.098 13.919 1.00 25.00 H new ATOM 0 HB2 GLU A 96 33.631 3.758 13.887 1.00 25.00 H new ATOM 0 HB3 GLU A 96 34.159 3.372 15.513 1.00 25.00 H new ATOM 0 HG2 GLU A 96 33.677 5.702 15.470 1.00 25.00 H new ATOM 0 HG3 GLU A 96 35.420 5.538 15.563 1.00 25.00 H new ATOM 1453 N GLY A 97 36.927 1.273 14.498 1.00 25.00 N ATOM 1454 CA GLY A 97 37.743 0.348 15.270 1.00 25.00 C ATOM 1455 C GLY A 97 39.206 0.740 15.193 1.00 25.00 C ATOM 1456 O GLY A 97 40.094 -0.040 15.531 1.00 25.00 O ATOM 0 H GLY A 97 36.805 1.007 13.521 1.00 25.00 H new ATOM 0 HA2 GLY A 97 37.415 0.345 16.310 1.00 25.00 H new ATOM 0 HA3 GLY A 97 37.611 -0.666 14.891 1.00 25.00 H new ATOM 1460 N GLU A 98 39.449 1.942 14.693 1.00 25.00 N ATOM 1461 CA GLU A 98 40.802 2.450 14.504 1.00 25.00 C ATOM 1462 C GLU A 98 41.417 2.753 15.872 1.00 25.00 C ATOM 1463 O GLU A 98 40.907 3.552 16.653 1.00 25.00 O ATOM 1464 CB GLU A 98 40.773 3.710 13.630 1.00 25.00 C ATOM 1465 CG GLU A 98 42.096 4.015 12.921 1.00 25.00 C ATOM 1466 CD GLU A 98 42.249 3.232 11.615 1.00 25.00 C ATOM 1467 OE1 GLU A 98 42.596 3.856 10.591 1.00 25.00 O ATOM 1468 OE2 GLU A 98 42.056 1.997 11.620 1.00 25.00 O ATOM 0 H GLU A 98 38.717 2.592 14.407 1.00 25.00 H new ATOM 0 HA GLU A 98 41.411 1.701 13.997 1.00 25.00 H new ATOM 0 HB2 GLU A 98 39.989 3.600 12.880 1.00 25.00 H new ATOM 0 HB3 GLU A 98 40.502 4.563 14.252 1.00 25.00 H new ATOM 0 HG2 GLU A 98 42.155 5.083 12.711 1.00 25.00 H new ATOM 0 HG3 GLU A 98 42.926 3.774 13.586 1.00 25.00 H new ATOM 1475 N VAL A 99 42.514 2.064 16.192 1.00 25.00 N ATOM 1476 CA VAL A 99 43.174 2.208 17.499 1.00 25.00 C ATOM 1477 C VAL A 99 43.755 3.618 17.720 1.00 25.00 C ATOM 1478 O VAL A 99 43.741 4.207 18.776 1.00 25.00 O ATOM 1479 CB VAL A 99 44.243 1.088 17.685 1.00 25.00 C ATOM 1480 CG1 VAL A 99 44.832 1.111 19.117 1.00 25.00 C ATOM 1481 CG2 VAL A 99 43.616 -0.310 17.411 1.00 25.00 C ATOM 1482 OXT VAL A 99 44.294 4.157 16.675 1.00 25.00 O ATOM 0 H VAL A 99 42.968 1.399 15.566 1.00 25.00 H new ATOM 0 HA VAL A 99 42.415 2.086 18.272 1.00 25.00 H new ATOM 0 HB VAL A 99 45.046 1.275 16.972 1.00 25.00 H new ATOM 0 HG11 VAL A 99 45.574 0.319 19.218 1.00 25.00 H new ATOM 0 HG12 VAL A 99 45.304 2.076 19.301 1.00 25.00 H new ATOM 0 HG13 VAL A 99 44.033 0.953 19.842 1.00 25.00 H new ATOM 0 HG21 VAL A 99 44.374 -1.081 17.545 1.00 25.00 H new ATOM 0 HG22 VAL A 99 42.795 -0.483 18.107 1.00 25.00 H new ATOM 0 HG23 VAL A 99 43.239 -0.346 16.389 1.00 25.00 H new TER 1493 VAL A 99