USER MOD reduce.3.24.130724 H: found=0, std=0, add=672, rem=0, adj=23 USER MOD reduce.3.24.130724 removed 669 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 38 TYR OH : rot -159:sc= 1.3 USER MOD Set 1.2: A 84 GLN : amide:sc= 0.941 K(o=2.2,f=-1) USER MOD Set 2.1: A 57 MET CE :methyl 152:sc= -0.17 (180deg=-2.03!) USER MOD Set 2.2: A 65 CYS SG : rot -58:sc= -0.0867 USER MOD Set 3.1: A 25 GLN : amide:sc= -0.109 K(o=0.22,f=-0.79) USER MOD Set 3.2: A 63 CYS SG : rot -15:sc= 0.687 USER MOD Set 3.3: A 64 ASN : amide:sc= -0.354 K(o=0.22,f=-1.1) USER MOD Set 4.1: A 39 GLN : amide:sc= -3.38! C(o=-3.1!,f=-8.3!) USER MOD Set 4.2: A 43 ASN : amide:sc= 0.316 X(o=-3.1,f=-3.4) USER MOD Single : A 1 GLY N :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 2 SER OG : rot 180:sc= 0 USER MOD Single : A 3 SER OG : rot 180:sc= 0 USER MOD Single : A 5 SER OG : rot 180:sc= 0 USER MOD Single : A 6 SER OG : rot 180:sc= 0 USER MOD Single : A 8 GLN : amide:sc= -0.233 X(o=-0.23,f=-0.23) USER MOD Single : A 9 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 10 SER OG : rot 180:sc= 0 USER MOD Single : A 14 THR OG1 : rot 180:sc= 0 USER MOD Single : A 16 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 18 SER OG : rot 180:sc= 0 USER MOD Single : A 23 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 28 SER OG : rot 180:sc= 0 USER MOD Single : A 29 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 30 THR OG1 : rot 180:sc= 0 USER MOD Single : A 31 GLN : amide:sc= -2.18 K(o=-2.2,f=-3.3!) USER MOD Single : A 37 SER OG : rot 180:sc= 0 USER MOD Single : A 42 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 44 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 45 TYR OH : rot -15:sc= -0.89 USER MOD Single : A 48 SER OG : rot 70:sc= 0.219 USER MOD Single : A 53 SER OG : rot 180:sc= 0 USER MOD Single : A 55 CYS SG : rot 19:sc= 0.305 USER MOD Single : A 61 THR OG1 : rot 180:sc= 0 USER MOD Single : A 80 GLN : amide:sc= -1.03 X(o=-1,f=-1.4) USER MOD Single : A 82 HIS : no HD1:sc= -1.2 X(o=-1.2,f=-1.3) USER MOD Single : A 89 THR OG1 : rot 180:sc= 0.0281 USER MOD Single : A 90 SER OG : rot -64:sc= 0.106 USER MOD Single : A 91 SER OG : rot 180:sc= 0 USER MOD Single : A 92 SER OG : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 1 6.617 -16.277 22.623 1.00 0.00 N ATOM 2 CA GLY A 1 5.525 -16.718 23.470 1.00 0.00 C ATOM 3 C GLY A 1 4.169 -16.501 22.828 1.00 0.00 C ATOM 4 O GLY A 1 3.366 -17.429 22.727 1.00 0.00 O ATOM 0 H1 GLY A 1 7.522 -16.447 23.107 1.00 0.00 H new ATOM 0 H2 GLY A 1 6.598 -16.807 21.728 1.00 0.00 H new ATOM 0 H3 GLY A 1 6.515 -15.261 22.426 1.00 0.00 H new ATOM 0 HA2 GLY A 1 5.651 -17.777 23.698 1.00 0.00 H new ATOM 0 HA3 GLY A 1 5.565 -16.181 24.418 1.00 0.00 H new ATOM 8 N SER A 2 3.912 -15.271 22.393 1.00 0.00 N ATOM 9 CA SER A 2 2.642 -14.934 21.761 1.00 0.00 C ATOM 10 C SER A 2 2.804 -13.751 20.811 1.00 0.00 C ATOM 11 O SER A 2 3.776 -13.001 20.897 1.00 0.00 O ATOM 12 CB SER A 2 1.591 -14.608 22.824 1.00 0.00 C ATOM 13 OG SER A 2 1.952 -13.453 23.562 1.00 0.00 O ATOM 0 H SER A 2 4.566 -14.492 22.467 1.00 0.00 H new ATOM 0 HA SER A 2 2.311 -15.798 21.184 1.00 0.00 H new ATOM 0 HB2 SER A 2 0.624 -14.451 22.347 1.00 0.00 H new ATOM 0 HB3 SER A 2 1.479 -15.455 23.501 1.00 0.00 H new ATOM 0 HG SER A 2 1.263 -13.265 24.233 1.00 0.00 H new ATOM 19 N SER A 3 1.845 -13.592 19.905 1.00 0.00 N ATOM 20 CA SER A 3 1.883 -12.504 18.935 1.00 0.00 C ATOM 21 C SER A 3 1.220 -11.251 19.499 1.00 0.00 C ATOM 22 O SER A 3 0.245 -11.333 20.245 1.00 0.00 O ATOM 23 CB SER A 3 1.187 -12.923 17.639 1.00 0.00 C ATOM 24 OG SER A 3 1.323 -14.316 17.414 1.00 0.00 O ATOM 0 H SER A 3 1.032 -14.203 19.822 1.00 0.00 H new ATOM 0 HA SER A 3 2.927 -12.277 18.721 1.00 0.00 H new ATOM 0 HB2 SER A 3 0.130 -12.661 17.689 1.00 0.00 H new ATOM 0 HB3 SER A 3 1.612 -12.373 16.800 1.00 0.00 H new ATOM 0 HG SER A 3 0.868 -14.559 16.581 1.00 0.00 H new ATOM 30 N GLY A 4 1.758 -10.090 19.136 1.00 0.00 N ATOM 31 CA GLY A 4 1.207 -8.835 19.614 1.00 0.00 C ATOM 32 C GLY A 4 2.279 -7.876 20.092 1.00 0.00 C ATOM 33 O GLY A 4 2.830 -7.109 19.304 1.00 0.00 O ATOM 0 H GLY A 4 2.565 -9.996 18.520 1.00 0.00 H new ATOM 0 HA2 GLY A 4 0.634 -8.365 18.814 1.00 0.00 H new ATOM 0 HA3 GLY A 4 0.512 -9.034 20.430 1.00 0.00 H new ATOM 37 N SER A 5 2.573 -7.918 21.387 1.00 0.00 N ATOM 38 CA SER A 5 3.582 -7.042 21.970 1.00 0.00 C ATOM 39 C SER A 5 4.912 -7.179 21.234 1.00 0.00 C ATOM 40 O SER A 5 5.569 -8.217 21.305 1.00 0.00 O ATOM 41 CB SER A 5 3.773 -7.364 23.454 1.00 0.00 C ATOM 42 OG SER A 5 4.203 -6.221 24.173 1.00 0.00 O ATOM 0 H SER A 5 2.127 -8.549 22.053 1.00 0.00 H new ATOM 0 HA SER A 5 3.235 -6.014 21.870 1.00 0.00 H new ATOM 0 HB2 SER A 5 2.836 -7.730 23.873 1.00 0.00 H new ATOM 0 HB3 SER A 5 4.505 -8.164 23.564 1.00 0.00 H new ATOM 0 HG SER A 5 4.316 -6.453 25.118 1.00 0.00 H new ATOM 48 N SER A 6 5.301 -6.123 20.527 1.00 0.00 N ATOM 49 CA SER A 6 6.550 -6.125 19.774 1.00 0.00 C ATOM 50 C SER A 6 7.723 -5.735 20.667 1.00 0.00 C ATOM 51 O SER A 6 8.609 -6.545 20.936 1.00 0.00 O ATOM 52 CB SER A 6 6.456 -5.164 18.587 1.00 0.00 C ATOM 53 OG SER A 6 5.799 -5.773 17.489 1.00 0.00 O ATOM 0 H SER A 6 4.769 -5.255 20.460 1.00 0.00 H new ATOM 0 HA SER A 6 6.720 -7.135 19.402 1.00 0.00 H new ATOM 0 HB2 SER A 6 5.916 -4.265 18.885 1.00 0.00 H new ATOM 0 HB3 SER A 6 7.456 -4.851 18.288 1.00 0.00 H new ATOM 0 HG SER A 6 5.750 -5.138 16.744 1.00 0.00 H new ATOM 59 N GLY A 7 7.722 -4.486 21.124 1.00 0.00 N ATOM 60 CA GLY A 7 8.791 -4.009 21.982 1.00 0.00 C ATOM 61 C GLY A 7 9.663 -2.973 21.300 1.00 0.00 C ATOM 62 O GLY A 7 9.243 -2.340 20.332 1.00 0.00 O ATOM 0 H GLY A 7 7.000 -3.796 20.915 1.00 0.00 H new ATOM 0 HA2 GLY A 7 8.362 -3.579 22.887 1.00 0.00 H new ATOM 0 HA3 GLY A 7 9.408 -4.852 22.291 1.00 0.00 H new ATOM 66 N GLN A 8 10.880 -2.800 21.806 1.00 0.00 N ATOM 67 CA GLN A 8 11.811 -1.832 21.240 1.00 0.00 C ATOM 68 C GLN A 8 11.214 -0.429 21.253 1.00 0.00 C ATOM 69 O GLN A 8 11.560 0.411 20.423 1.00 0.00 O ATOM 70 CB GLN A 8 12.184 -2.227 19.810 1.00 0.00 C ATOM 71 CG GLN A 8 13.496 -1.624 19.334 1.00 0.00 C ATOM 72 CD GLN A 8 14.683 -2.086 20.155 1.00 0.00 C ATOM 73 OE1 GLN A 8 15.389 -1.277 20.758 1.00 0.00 O ATOM 74 NE2 GLN A 8 14.910 -3.394 20.183 1.00 0.00 N ATOM 0 H GLN A 8 11.244 -3.317 22.606 1.00 0.00 H new ATOM 0 HA GLN A 8 12.711 -1.829 21.855 1.00 0.00 H new ATOM 0 HB2 GLN A 8 12.249 -3.313 19.747 1.00 0.00 H new ATOM 0 HB3 GLN A 8 11.385 -1.916 19.136 1.00 0.00 H new ATOM 0 HG2 GLN A 8 13.656 -1.891 18.289 1.00 0.00 H new ATOM 0 HG3 GLN A 8 13.429 -0.537 19.379 1.00 0.00 H new ATOM 0 HE21 GLN A 8 14.299 -4.029 19.668 1.00 0.00 H new ATOM 0 HE22 GLN A 8 15.695 -3.764 20.719 1.00 0.00 H new ATOM 83 N MET A 9 10.315 -0.183 22.200 1.00 0.00 N ATOM 84 CA MET A 9 9.670 1.119 22.322 1.00 0.00 C ATOM 85 C MET A 9 8.864 1.445 21.068 1.00 0.00 C ATOM 86 O MET A 9 9.413 1.909 20.069 1.00 0.00 O ATOM 87 CB MET A 9 10.715 2.209 22.568 1.00 0.00 C ATOM 88 CG MET A 9 10.119 3.529 23.031 1.00 0.00 C ATOM 89 SD MET A 9 10.972 4.210 24.466 1.00 0.00 S ATOM 90 CE MET A 9 10.143 3.342 25.795 1.00 0.00 C ATOM 0 H MET A 9 10.017 -0.868 22.894 1.00 0.00 H new ATOM 0 HA MET A 9 8.988 1.081 23.172 1.00 0.00 H new ATOM 0 HB2 MET A 9 11.425 1.858 23.317 1.00 0.00 H new ATOM 0 HB3 MET A 9 11.277 2.376 21.649 1.00 0.00 H new ATOM 0 HG2 MET A 9 10.160 4.249 22.213 1.00 0.00 H new ATOM 0 HG3 MET A 9 9.067 3.383 23.274 1.00 0.00 H new ATOM 0 HE1 MET A 9 10.561 3.656 26.751 1.00 0.00 H new ATOM 0 HE2 MET A 9 9.078 3.572 25.771 1.00 0.00 H new ATOM 0 HE3 MET A 9 10.285 2.268 25.673 1.00 0.00 H new ATOM 100 N SER A 10 7.559 1.200 21.129 1.00 0.00 N ATOM 101 CA SER A 10 6.678 1.465 19.997 1.00 0.00 C ATOM 102 C SER A 10 5.978 2.811 20.156 1.00 0.00 C ATOM 103 O SER A 10 5.669 3.236 21.270 1.00 0.00 O ATOM 104 CB SER A 10 5.639 0.350 19.861 1.00 0.00 C ATOM 105 OG SER A 10 4.742 0.353 20.957 1.00 0.00 O ATOM 0 H SER A 10 7.088 0.819 21.950 1.00 0.00 H new ATOM 0 HA SER A 10 7.287 1.497 19.094 1.00 0.00 H new ATOM 0 HB2 SER A 10 5.083 0.478 18.932 1.00 0.00 H new ATOM 0 HB3 SER A 10 6.142 -0.615 19.801 1.00 0.00 H new ATOM 0 HG SER A 10 4.087 -0.367 20.846 1.00 0.00 H new ATOM 111 N LEU A 11 5.732 3.479 19.034 1.00 0.00 N ATOM 112 CA LEU A 11 5.068 4.778 19.047 1.00 0.00 C ATOM 113 C LEU A 11 3.756 4.726 18.271 1.00 0.00 C ATOM 114 O LEU A 11 3.435 5.642 17.515 1.00 0.00 O ATOM 115 CB LEU A 11 5.985 5.847 18.449 1.00 0.00 C ATOM 116 CG LEU A 11 7.116 6.342 19.351 1.00 0.00 C ATOM 117 CD1 LEU A 11 8.469 5.987 18.755 1.00 0.00 C ATOM 118 CD2 LEU A 11 7.004 7.844 19.570 1.00 0.00 C ATOM 0 H LEU A 11 5.982 3.143 18.104 1.00 0.00 H new ATOM 0 HA LEU A 11 4.847 5.035 20.083 1.00 0.00 H new ATOM 0 HB2 LEU A 11 6.424 5.450 17.534 1.00 0.00 H new ATOM 0 HB3 LEU A 11 5.374 6.703 18.163 1.00 0.00 H new ATOM 0 HG LEU A 11 7.028 5.846 20.318 1.00 0.00 H new ATOM 0 HD11 LEU A 11 9.261 6.347 19.411 1.00 0.00 H new ATOM 0 HD12 LEU A 11 8.548 4.905 18.651 1.00 0.00 H new ATOM 0 HD13 LEU A 11 8.569 6.454 17.775 1.00 0.00 H new ATOM 0 HD21 LEU A 11 7.817 8.179 20.214 1.00 0.00 H new ATOM 0 HD22 LEU A 11 7.066 8.357 18.610 1.00 0.00 H new ATOM 0 HD23 LEU A 11 6.049 8.073 20.042 1.00 0.00 H new ATOM 130 N GLU A 12 3.001 3.650 18.467 1.00 0.00 N ATOM 131 CA GLU A 12 1.722 3.480 17.787 1.00 0.00 C ATOM 132 C GLU A 12 0.570 3.476 18.788 1.00 0.00 C ATOM 133 O GLU A 12 -0.432 4.165 18.600 1.00 0.00 O ATOM 134 CB GLU A 12 1.716 2.180 16.980 1.00 0.00 C ATOM 135 CG GLU A 12 2.199 2.350 15.549 1.00 0.00 C ATOM 136 CD GLU A 12 3.282 1.356 15.178 1.00 0.00 C ATOM 137 OE1 GLU A 12 4.115 1.032 16.049 1.00 0.00 O ATOM 138 OE2 GLU A 12 3.296 0.903 14.014 1.00 0.00 O ATOM 0 H GLU A 12 3.252 2.883 19.091 1.00 0.00 H new ATOM 0 HA GLU A 12 1.587 4.321 17.107 1.00 0.00 H new ATOM 0 HB2 GLU A 12 2.347 1.447 17.483 1.00 0.00 H new ATOM 0 HB3 GLU A 12 0.704 1.775 16.967 1.00 0.00 H new ATOM 0 HG2 GLU A 12 1.356 2.234 14.868 1.00 0.00 H new ATOM 0 HG3 GLU A 12 2.579 3.363 15.415 1.00 0.00 H new ATOM 145 N GLY A 13 0.721 2.693 19.852 1.00 0.00 N ATOM 146 CA GLY A 13 -0.314 2.612 20.866 1.00 0.00 C ATOM 147 C GLY A 13 -0.329 3.824 21.777 1.00 0.00 C ATOM 148 O GLY A 13 0.606 4.626 21.771 1.00 0.00 O ATOM 0 H GLY A 13 1.541 2.114 20.030 1.00 0.00 H new ATOM 0 HA2 GLY A 13 -1.286 2.513 20.382 1.00 0.00 H new ATOM 0 HA3 GLY A 13 -0.163 1.713 21.464 1.00 0.00 H new ATOM 152 N THR A 14 -1.393 3.959 22.563 1.00 0.00 N ATOM 153 CA THR A 14 -1.527 5.083 23.481 1.00 0.00 C ATOM 154 C THR A 14 -2.791 4.956 24.324 1.00 0.00 C ATOM 155 O THR A 14 -3.826 4.498 23.841 1.00 0.00 O ATOM 156 CB THR A 14 -1.558 6.425 22.726 1.00 0.00 C ATOM 157 OG1 THR A 14 -1.904 7.485 23.625 1.00 0.00 O ATOM 158 CG2 THR A 14 -2.559 6.378 21.581 1.00 0.00 C ATOM 0 H THR A 14 -2.174 3.304 22.582 1.00 0.00 H new ATOM 0 HA THR A 14 -0.655 5.064 24.134 1.00 0.00 H new ATOM 0 HB THR A 14 -0.566 6.608 22.314 1.00 0.00 H new ATOM 0 HG1 THR A 14 -1.920 8.335 23.138 1.00 0.00 H new ATOM 0 HG21 THR A 14 -2.564 7.337 21.062 1.00 0.00 H new ATOM 0 HG22 THR A 14 -2.277 5.589 20.883 1.00 0.00 H new ATOM 0 HG23 THR A 14 -3.554 6.174 21.976 1.00 0.00 H new ATOM 166 N GLU A 15 -2.700 5.367 25.585 1.00 0.00 N ATOM 167 CA GLU A 15 -3.838 5.298 26.494 1.00 0.00 C ATOM 168 C GLU A 15 -3.933 6.563 27.342 1.00 0.00 C ATOM 169 O GLU A 15 -4.363 6.520 28.495 1.00 0.00 O ATOM 170 CB GLU A 15 -3.723 4.071 27.400 1.00 0.00 C ATOM 171 CG GLU A 15 -4.007 2.759 26.686 1.00 0.00 C ATOM 172 CD GLU A 15 -4.510 1.681 27.626 1.00 0.00 C ATOM 173 OE1 GLU A 15 -3.907 1.509 28.707 1.00 0.00 O ATOM 174 OE2 GLU A 15 -5.505 1.010 27.282 1.00 0.00 O ATOM 0 H GLU A 15 -1.851 5.751 26.000 1.00 0.00 H new ATOM 0 HA GLU A 15 -4.744 5.213 25.895 1.00 0.00 H new ATOM 0 HB2 GLU A 15 -2.719 4.035 27.823 1.00 0.00 H new ATOM 0 HB3 GLU A 15 -4.417 4.179 28.234 1.00 0.00 H new ATOM 0 HG2 GLU A 15 -4.747 2.928 25.904 1.00 0.00 H new ATOM 0 HG3 GLU A 15 -3.098 2.412 26.195 1.00 0.00 H new ATOM 181 N LYS A 16 -3.527 7.688 26.764 1.00 0.00 N ATOM 182 CA LYS A 16 -3.566 8.967 27.465 1.00 0.00 C ATOM 183 C LYS A 16 -3.856 10.109 26.497 1.00 0.00 C ATOM 184 O LYS A 16 -3.572 10.011 25.303 1.00 0.00 O ATOM 185 CB LYS A 16 -2.239 9.218 28.184 1.00 0.00 C ATOM 186 CG LYS A 16 -2.377 10.062 29.439 1.00 0.00 C ATOM 187 CD LYS A 16 -3.111 9.311 30.537 1.00 0.00 C ATOM 188 CE LYS A 16 -4.037 10.231 31.319 1.00 0.00 C ATOM 189 NZ LYS A 16 -4.481 9.613 32.599 1.00 0.00 N ATOM 0 H LYS A 16 -3.167 7.741 25.811 1.00 0.00 H new ATOM 0 HA LYS A 16 -4.369 8.926 28.201 1.00 0.00 H new ATOM 0 HB2 LYS A 16 -1.792 8.260 28.448 1.00 0.00 H new ATOM 0 HB3 LYS A 16 -1.551 9.712 27.498 1.00 0.00 H new ATOM 0 HG2 LYS A 16 -1.388 10.353 29.794 1.00 0.00 H new ATOM 0 HG3 LYS A 16 -2.914 10.981 29.204 1.00 0.00 H new ATOM 0 HD2 LYS A 16 -3.689 8.498 30.099 1.00 0.00 H new ATOM 0 HD3 LYS A 16 -2.388 8.858 31.216 1.00 0.00 H new ATOM 0 HE2 LYS A 16 -3.525 11.170 31.528 1.00 0.00 H new ATOM 0 HE3 LYS A 16 -4.909 10.472 30.710 1.00 0.00 H new ATOM 0 HZ1 LYS A 16 -5.110 10.271 33.102 1.00 0.00 H new ATOM 0 HZ2 LYS A 16 -4.992 8.730 32.399 1.00 0.00 H new ATOM 0 HZ3 LYS A 16 -3.651 9.406 33.191 1.00 0.00 H new ATOM 203 N ALA A 17 -4.423 11.192 27.019 1.00 0.00 N ATOM 204 CA ALA A 17 -4.748 12.354 26.201 1.00 0.00 C ATOM 205 C ALA A 17 -5.202 13.524 27.067 1.00 0.00 C ATOM 206 O ALA A 17 -5.968 13.348 28.015 1.00 0.00 O ATOM 207 CB ALA A 17 -5.822 12.000 25.184 1.00 0.00 C ATOM 0 H ALA A 17 -4.667 11.289 28.005 1.00 0.00 H new ATOM 0 HA ALA A 17 -3.846 12.657 25.669 1.00 0.00 H new ATOM 0 HB1 ALA A 17 -6.055 12.877 24.580 1.00 0.00 H new ATOM 0 HB2 ALA A 17 -5.461 11.200 24.538 1.00 0.00 H new ATOM 0 HB3 ALA A 17 -6.721 11.669 25.704 1.00 0.00 H new ATOM 213 N SER A 18 -4.725 14.720 26.736 1.00 0.00 N ATOM 214 CA SER A 18 -5.078 15.919 27.486 1.00 0.00 C ATOM 215 C SER A 18 -6.580 16.179 27.418 1.00 0.00 C ATOM 216 O SER A 18 -7.130 16.919 28.234 1.00 0.00 O ATOM 217 CB SER A 18 -4.315 17.129 26.944 1.00 0.00 C ATOM 218 OG SER A 18 -4.527 17.283 25.551 1.00 0.00 O ATOM 0 H SER A 18 -4.093 14.884 25.953 1.00 0.00 H new ATOM 0 HA SER A 18 -4.800 15.761 28.528 1.00 0.00 H new ATOM 0 HB2 SER A 18 -4.637 18.030 27.466 1.00 0.00 H new ATOM 0 HB3 SER A 18 -3.250 17.010 27.142 1.00 0.00 H new ATOM 0 HG SER A 18 -4.030 18.064 25.229 1.00 0.00 H new ATOM 224 N TRP A 19 -7.237 15.565 26.441 1.00 0.00 N ATOM 225 CA TRP A 19 -8.675 15.729 26.266 1.00 0.00 C ATOM 226 C TRP A 19 -9.416 14.442 26.611 1.00 0.00 C ATOM 227 O TRP A 19 -10.574 14.260 26.231 1.00 0.00 O ATOM 228 CB TRP A 19 -8.991 16.145 24.828 1.00 0.00 C ATOM 229 CG TRP A 19 -8.235 15.355 23.802 1.00 0.00 C ATOM 230 CD1 TRP A 19 -7.034 15.680 23.240 1.00 0.00 C ATOM 231 CD2 TRP A 19 -8.632 14.111 23.216 1.00 0.00 C ATOM 232 NE1 TRP A 19 -6.659 14.712 22.339 1.00 0.00 N ATOM 233 CE2 TRP A 19 -7.622 13.738 22.307 1.00 0.00 C ATOM 234 CE3 TRP A 19 -9.740 13.274 23.372 1.00 0.00 C ATOM 235 CZ2 TRP A 19 -7.691 12.566 21.558 1.00 0.00 C ATOM 236 CZ3 TRP A 19 -9.806 12.111 22.627 1.00 0.00 C ATOM 237 CH2 TRP A 19 -8.787 11.766 21.730 1.00 0.00 C ATOM 0 H TRP A 19 -6.797 14.949 25.758 1.00 0.00 H new ATOM 0 HA TRP A 19 -9.011 16.512 26.945 1.00 0.00 H new ATOM 0 HB2 TRP A 19 -10.060 16.029 24.650 1.00 0.00 H new ATOM 0 HB3 TRP A 19 -8.760 17.203 24.704 1.00 0.00 H new ATOM 0 HD1 TRP A 19 -6.463 16.567 23.470 1.00 0.00 H new ATOM 0 HE1 TRP A 19 -5.803 14.718 21.784 1.00 0.00 H new ATOM 0 HE3 TRP A 19 -10.530 13.531 24.062 1.00 0.00 H new ATOM 0 HZ2 TRP A 19 -6.907 12.298 20.866 1.00 0.00 H new ATOM 0 HZ3 TRP A 19 -10.658 11.457 22.739 1.00 0.00 H new ATOM 0 HH2 TRP A 19 -8.868 10.850 21.163 1.00 0.00 H new ATOM 248 N LEU A 20 -8.743 13.553 27.332 1.00 0.00 N ATOM 249 CA LEU A 20 -9.339 12.281 27.728 1.00 0.00 C ATOM 250 C LEU A 20 -9.651 12.268 29.221 1.00 0.00 C ATOM 251 O LEU A 20 -8.758 12.416 30.054 1.00 0.00 O ATOM 252 CB LEU A 20 -8.398 11.125 27.382 1.00 0.00 C ATOM 253 CG LEU A 20 -8.646 10.438 26.039 1.00 0.00 C ATOM 254 CD1 LEU A 20 -7.612 9.349 25.799 1.00 0.00 C ATOM 255 CD2 LEU A 20 -10.053 9.861 25.987 1.00 0.00 C ATOM 0 H LEU A 20 -7.785 13.689 27.655 1.00 0.00 H new ATOM 0 HA LEU A 20 -10.273 12.158 27.179 1.00 0.00 H new ATOM 0 HB2 LEU A 20 -7.375 11.500 27.392 1.00 0.00 H new ATOM 0 HB3 LEU A 20 -8.470 10.375 28.170 1.00 0.00 H new ATOM 0 HG LEU A 20 -8.551 11.182 25.248 1.00 0.00 H new ATOM 0 HD11 LEU A 20 -7.804 8.871 24.839 1.00 0.00 H new ATOM 0 HD12 LEU A 20 -6.615 9.789 25.793 1.00 0.00 H new ATOM 0 HD13 LEU A 20 -7.675 8.606 26.594 1.00 0.00 H new ATOM 0 HD21 LEU A 20 -10.212 9.376 25.024 1.00 0.00 H new ATOM 0 HD22 LEU A 20 -10.176 9.130 26.786 1.00 0.00 H new ATOM 0 HD23 LEU A 20 -10.780 10.663 26.114 1.00 0.00 H new ATOM 267 N GLY A 21 -10.926 12.088 29.552 1.00 0.00 N ATOM 268 CA GLY A 21 -11.334 12.057 30.945 1.00 0.00 C ATOM 269 C GLY A 21 -12.209 13.237 31.320 1.00 0.00 C ATOM 270 O GLY A 21 -12.914 13.199 32.327 1.00 0.00 O ATOM 0 H GLY A 21 -11.684 11.963 28.881 1.00 0.00 H new ATOM 0 HA2 GLY A 21 -11.875 11.131 31.141 1.00 0.00 H new ATOM 0 HA3 GLY A 21 -10.448 12.050 31.580 1.00 0.00 H new ATOM 274 N GLU A 22 -12.162 14.288 30.507 1.00 0.00 N ATOM 275 CA GLU A 22 -12.956 15.485 30.761 1.00 0.00 C ATOM 276 C GLU A 22 -13.885 15.781 29.587 1.00 0.00 C ATOM 277 O GLU A 22 -13.523 15.574 28.429 1.00 0.00 O ATOM 278 CB GLU A 22 -12.041 16.685 31.018 1.00 0.00 C ATOM 279 CG GLU A 22 -12.760 17.878 31.625 1.00 0.00 C ATOM 280 CD GLU A 22 -13.260 17.604 33.030 1.00 0.00 C ATOM 281 OE1 GLU A 22 -14.399 17.110 33.169 1.00 0.00 O ATOM 282 OE2 GLU A 22 -12.512 17.883 33.991 1.00 0.00 O ATOM 0 H GLU A 22 -11.584 14.335 29.668 1.00 0.00 H new ATOM 0 HA GLU A 22 -13.565 15.305 31.647 1.00 0.00 H new ATOM 0 HB2 GLU A 22 -11.234 16.380 31.684 1.00 0.00 H new ATOM 0 HB3 GLU A 22 -11.581 16.988 30.078 1.00 0.00 H new ATOM 0 HG2 GLU A 22 -12.085 18.733 31.644 1.00 0.00 H new ATOM 0 HG3 GLU A 22 -13.603 18.151 30.990 1.00 0.00 H new ATOM 289 N GLN A 23 -15.083 16.266 29.896 1.00 0.00 N ATOM 290 CA GLN A 23 -16.064 16.589 28.867 1.00 0.00 C ATOM 291 C GLN A 23 -15.520 17.642 27.908 1.00 0.00 C ATOM 292 O GLN A 23 -14.574 18.368 28.215 1.00 0.00 O ATOM 293 CB GLN A 23 -17.361 17.087 29.508 1.00 0.00 C ATOM 294 CG GLN A 23 -18.337 15.973 29.851 1.00 0.00 C ATOM 295 CD GLN A 23 -19.535 16.469 30.636 1.00 0.00 C ATOM 296 OE1 GLN A 23 -19.394 17.004 31.736 1.00 0.00 O ATOM 297 NE2 GLN A 23 -20.725 16.294 30.073 1.00 0.00 N ATOM 0 H GLN A 23 -15.398 16.444 30.850 1.00 0.00 H new ATOM 0 HA GLN A 23 -16.272 15.681 28.301 1.00 0.00 H new ATOM 0 HB2 GLN A 23 -17.119 17.639 30.416 1.00 0.00 H new ATOM 0 HB3 GLN A 23 -17.846 17.788 28.829 1.00 0.00 H new ATOM 0 HG2 GLN A 23 -18.681 15.500 28.931 1.00 0.00 H new ATOM 0 HG3 GLN A 23 -17.820 15.207 30.429 1.00 0.00 H new ATOM 0 HE21 GLN A 23 -20.796 15.846 29.160 1.00 0.00 H new ATOM 0 HE22 GLN A 23 -21.568 16.608 30.554 1.00 0.00 H new ATOM 306 N PRO A 24 -16.130 17.729 26.716 1.00 0.00 N ATOM 307 CA PRO A 24 -15.723 18.691 25.687 1.00 0.00 C ATOM 308 C PRO A 24 -16.056 20.128 26.073 1.00 0.00 C ATOM 309 O PRO A 24 -15.644 21.072 25.399 1.00 0.00 O ATOM 310 CB PRO A 24 -16.536 18.264 24.462 1.00 0.00 C ATOM 311 CG PRO A 24 -17.730 17.571 25.022 1.00 0.00 C ATOM 312 CD PRO A 24 -17.264 16.896 26.282 1.00 0.00 C ATOM 0 HA PRO A 24 -14.645 18.683 25.525 1.00 0.00 H new ATOM 0 HB2 PRO A 24 -16.825 19.125 23.859 1.00 0.00 H new ATOM 0 HB3 PRO A 24 -15.960 17.601 23.816 1.00 0.00 H new ATOM 0 HG2 PRO A 24 -18.530 18.281 25.232 1.00 0.00 H new ATOM 0 HG3 PRO A 24 -18.127 16.844 24.314 1.00 0.00 H new ATOM 0 HD2 PRO A 24 -18.051 16.864 27.036 1.00 0.00 H new ATOM 0 HD3 PRO A 24 -16.958 15.866 26.097 1.00 0.00 H new ATOM 320 N GLN A 25 -16.804 20.286 27.160 1.00 0.00 N ATOM 321 CA GLN A 25 -17.192 21.609 27.634 1.00 0.00 C ATOM 322 C GLN A 25 -16.098 22.218 28.505 1.00 0.00 C ATOM 323 O GLN A 25 -16.001 23.438 28.636 1.00 0.00 O ATOM 324 CB GLN A 25 -18.501 21.529 28.422 1.00 0.00 C ATOM 325 CG GLN A 25 -19.565 20.677 27.748 1.00 0.00 C ATOM 326 CD GLN A 25 -20.921 21.355 27.715 1.00 0.00 C ATOM 327 OE1 GLN A 25 -21.017 22.568 27.529 1.00 0.00 O ATOM 328 NE2 GLN A 25 -21.978 20.572 27.897 1.00 0.00 N ATOM 0 H GLN A 25 -17.153 19.515 27.729 1.00 0.00 H new ATOM 0 HA GLN A 25 -17.338 22.250 26.764 1.00 0.00 H new ATOM 0 HB2 GLN A 25 -18.295 21.123 29.412 1.00 0.00 H new ATOM 0 HB3 GLN A 25 -18.891 22.537 28.566 1.00 0.00 H new ATOM 0 HG2 GLN A 25 -19.252 20.450 26.729 1.00 0.00 H new ATOM 0 HG3 GLN A 25 -19.651 19.726 28.274 1.00 0.00 H new ATOM 0 HE21 GLN A 25 -21.851 19.571 28.048 1.00 0.00 H new ATOM 0 HE22 GLN A 25 -22.916 20.971 27.886 1.00 0.00 H new ATOM 337 N PHE A 26 -15.275 21.360 29.099 1.00 0.00 N ATOM 338 CA PHE A 26 -14.188 21.813 29.959 1.00 0.00 C ATOM 339 C PHE A 26 -12.833 21.545 29.309 1.00 0.00 C ATOM 340 O PHE A 26 -11.917 21.031 29.951 1.00 0.00 O ATOM 341 CB PHE A 26 -14.261 21.117 31.319 1.00 0.00 C ATOM 342 CG PHE A 26 -15.577 21.305 32.019 1.00 0.00 C ATOM 343 CD1 PHE A 26 -16.646 20.465 31.750 1.00 0.00 C ATOM 344 CD2 PHE A 26 -15.744 22.321 32.946 1.00 0.00 C ATOM 345 CE1 PHE A 26 -17.858 20.637 32.392 1.00 0.00 C ATOM 346 CE2 PHE A 26 -16.954 22.497 33.591 1.00 0.00 C ATOM 347 CZ PHE A 26 -18.012 21.653 33.315 1.00 0.00 C ATOM 0 H PHE A 26 -15.340 20.347 29.000 1.00 0.00 H new ATOM 0 HA PHE A 26 -14.296 22.888 30.103 1.00 0.00 H new ATOM 0 HB2 PHE A 26 -14.080 20.051 31.183 1.00 0.00 H new ATOM 0 HB3 PHE A 26 -13.462 21.497 31.956 1.00 0.00 H new ATOM 0 HD1 PHE A 26 -16.531 19.667 31.031 1.00 0.00 H new ATOM 0 HD2 PHE A 26 -14.920 22.983 33.167 1.00 0.00 H new ATOM 0 HE1 PHE A 26 -18.684 19.977 32.172 1.00 0.00 H new ATOM 0 HE2 PHE A 26 -17.072 23.294 34.310 1.00 0.00 H new ATOM 0 HZ PHE A 26 -18.957 21.787 33.820 1.00 0.00 H new ATOM 357 N TRP A 27 -12.716 21.896 28.034 1.00 0.00 N ATOM 358 CA TRP A 27 -11.473 21.693 27.297 1.00 0.00 C ATOM 359 C TRP A 27 -10.652 22.977 27.250 1.00 0.00 C ATOM 360 O TRP A 27 -11.168 24.064 27.508 1.00 0.00 O ATOM 361 CB TRP A 27 -11.772 21.212 25.876 1.00 0.00 C ATOM 362 CG TRP A 27 -11.990 19.732 25.784 1.00 0.00 C ATOM 363 CD1 TRP A 27 -12.077 18.850 26.823 1.00 0.00 C ATOM 364 CD2 TRP A 27 -12.147 18.962 24.587 1.00 0.00 C ATOM 365 NE1 TRP A 27 -12.279 17.578 26.344 1.00 0.00 N ATOM 366 CE2 TRP A 27 -12.326 17.619 24.976 1.00 0.00 C ATOM 367 CE3 TRP A 27 -12.155 19.275 23.226 1.00 0.00 C ATOM 368 CZ2 TRP A 27 -12.509 16.595 24.051 1.00 0.00 C ATOM 369 CZ3 TRP A 27 -12.337 18.257 22.309 1.00 0.00 C ATOM 370 CH2 TRP A 27 -12.513 16.931 22.725 1.00 0.00 C ATOM 0 H TRP A 27 -13.465 22.322 27.489 1.00 0.00 H new ATOM 0 HA TRP A 27 -10.892 20.931 27.816 1.00 0.00 H new ATOM 0 HB2 TRP A 27 -12.658 21.726 25.505 1.00 0.00 H new ATOM 0 HB3 TRP A 27 -10.945 21.492 25.224 1.00 0.00 H new ATOM 0 HD1 TRP A 27 -11.999 19.113 27.867 1.00 0.00 H new ATOM 0 HE1 TRP A 27 -12.378 16.739 26.915 1.00 0.00 H new ATOM 0 HE3 TRP A 27 -12.021 20.295 22.896 1.00 0.00 H new ATOM 0 HZ2 TRP A 27 -12.643 15.572 24.369 1.00 0.00 H new ATOM 0 HZ3 TRP A 27 -12.344 18.488 21.254 1.00 0.00 H new ATOM 0 HH2 TRP A 27 -12.655 16.158 21.984 1.00 0.00 H new ATOM 381 N SER A 28 -9.372 22.843 26.920 1.00 0.00 N ATOM 382 CA SER A 28 -8.478 23.993 26.842 1.00 0.00 C ATOM 383 C SER A 28 -8.124 24.309 25.393 1.00 0.00 C ATOM 384 O SER A 28 -8.331 23.490 24.497 1.00 0.00 O ATOM 385 CB SER A 28 -7.203 23.730 27.646 1.00 0.00 C ATOM 386 OG SER A 28 -7.257 24.366 28.911 1.00 0.00 O ATOM 0 H SER A 28 -8.930 21.950 26.702 1.00 0.00 H new ATOM 0 HA SER A 28 -8.995 24.854 27.266 1.00 0.00 H new ATOM 0 HB2 SER A 28 -7.069 22.657 27.781 1.00 0.00 H new ATOM 0 HB3 SER A 28 -6.338 24.092 27.090 1.00 0.00 H new ATOM 0 HG SER A 28 -6.431 24.181 29.406 1.00 0.00 H new ATOM 392 N LYS A 29 -7.587 25.504 25.168 1.00 0.00 N ATOM 393 CA LYS A 29 -7.201 25.931 23.829 1.00 0.00 C ATOM 394 C LYS A 29 -6.235 24.933 23.197 1.00 0.00 C ATOM 395 O LYS A 29 -6.153 24.822 21.973 1.00 0.00 O ATOM 396 CB LYS A 29 -6.558 27.318 23.878 1.00 0.00 C ATOM 397 CG LYS A 29 -7.526 28.424 24.264 1.00 0.00 C ATOM 398 CD LYS A 29 -6.819 29.557 24.987 1.00 0.00 C ATOM 399 CE LYS A 29 -7.678 30.812 25.032 1.00 0.00 C ATOM 400 NZ LYS A 29 -6.924 31.981 25.563 1.00 0.00 N ATOM 0 H LYS A 29 -7.409 26.194 25.897 1.00 0.00 H new ATOM 0 HA LYS A 29 -8.101 25.977 23.216 1.00 0.00 H new ATOM 0 HB2 LYS A 29 -5.734 27.302 24.591 1.00 0.00 H new ATOM 0 HB3 LYS A 29 -6.130 27.546 22.902 1.00 0.00 H new ATOM 0 HG2 LYS A 29 -8.014 28.811 23.369 1.00 0.00 H new ATOM 0 HG3 LYS A 29 -8.309 28.016 24.903 1.00 0.00 H new ATOM 0 HD2 LYS A 29 -6.575 29.245 26.003 1.00 0.00 H new ATOM 0 HD3 LYS A 29 -5.877 29.778 24.486 1.00 0.00 H new ATOM 0 HE2 LYS A 29 -8.042 31.039 24.030 1.00 0.00 H new ATOM 0 HE3 LYS A 29 -8.553 30.631 25.656 1.00 0.00 H new ATOM 0 HZ1 LYS A 29 -7.544 32.816 25.578 1.00 0.00 H new ATOM 0 HZ2 LYS A 29 -6.598 31.774 26.529 1.00 0.00 H new ATOM 0 HZ3 LYS A 29 -6.103 32.170 24.954 1.00 0.00 H new ATOM 414 N THR A 30 -5.506 24.208 24.039 1.00 0.00 N ATOM 415 CA THR A 30 -4.546 23.220 23.564 1.00 0.00 C ATOM 416 C THR A 30 -5.219 21.874 23.317 1.00 0.00 C ATOM 417 O THR A 30 -4.977 21.228 22.298 1.00 0.00 O ATOM 418 CB THR A 30 -3.393 23.029 24.567 1.00 0.00 C ATOM 419 OG1 THR A 30 -3.075 24.277 25.192 1.00 0.00 O ATOM 420 CG2 THR A 30 -2.158 22.475 23.872 1.00 0.00 C ATOM 0 H THR A 30 -5.562 24.287 25.054 1.00 0.00 H new ATOM 0 HA THR A 30 -4.141 23.598 22.625 1.00 0.00 H new ATOM 0 HB THR A 30 -3.715 22.315 25.325 1.00 0.00 H new ATOM 0 HG1 THR A 30 -2.342 24.146 25.829 1.00 0.00 H new ATOM 0 HG21 THR A 30 -1.357 22.348 24.600 1.00 0.00 H new ATOM 0 HG22 THR A 30 -2.395 21.511 23.422 1.00 0.00 H new ATOM 0 HG23 THR A 30 -1.836 23.168 23.095 1.00 0.00 H new ATOM 428 N GLN A 31 -6.063 21.460 24.256 1.00 0.00 N ATOM 429 CA GLN A 31 -6.771 20.190 24.139 1.00 0.00 C ATOM 430 C GLN A 31 -7.538 20.113 22.823 1.00 0.00 C ATOM 431 O GLN A 31 -7.521 19.089 22.141 1.00 0.00 O ATOM 432 CB GLN A 31 -7.731 20.007 25.315 1.00 0.00 C ATOM 433 CG GLN A 31 -7.054 20.097 26.673 1.00 0.00 C ATOM 434 CD GLN A 31 -8.036 19.992 27.823 1.00 0.00 C ATOM 435 OE1 GLN A 31 -7.972 20.762 28.782 1.00 0.00 O ATOM 436 NE2 GLN A 31 -8.954 19.036 27.733 1.00 0.00 N ATOM 0 H GLN A 31 -6.273 21.984 25.105 1.00 0.00 H new ATOM 0 HA GLN A 31 -6.032 19.388 24.155 1.00 0.00 H new ATOM 0 HB2 GLN A 31 -8.512 20.765 25.257 1.00 0.00 H new ATOM 0 HB3 GLN A 31 -8.221 19.037 25.226 1.00 0.00 H new ATOM 0 HG2 GLN A 31 -6.313 19.302 26.759 1.00 0.00 H new ATOM 0 HG3 GLN A 31 -6.516 21.042 26.745 1.00 0.00 H new ATOM 0 HE21 GLN A 31 -8.971 18.420 26.920 1.00 0.00 H new ATOM 0 HE22 GLN A 31 -9.642 18.918 28.477 1.00 0.00 H new ATOM 445 N VAL A 32 -8.212 21.204 22.473 1.00 0.00 N ATOM 446 CA VAL A 32 -8.986 21.261 21.238 1.00 0.00 C ATOM 447 C VAL A 32 -8.123 20.910 20.032 1.00 0.00 C ATOM 448 O VAL A 32 -8.311 19.867 19.403 1.00 0.00 O ATOM 449 CB VAL A 32 -9.602 22.657 21.026 1.00 0.00 C ATOM 450 CG1 VAL A 32 -10.387 22.702 19.724 1.00 0.00 C ATOM 451 CG2 VAL A 32 -10.486 23.034 22.205 1.00 0.00 C ATOM 0 H VAL A 32 -8.238 22.060 23.027 1.00 0.00 H new ATOM 0 HA VAL A 32 -9.788 20.529 21.333 1.00 0.00 H new ATOM 0 HB VAL A 32 -8.794 23.386 20.960 1.00 0.00 H new ATOM 0 HG11 VAL A 32 -10.815 23.696 19.591 1.00 0.00 H new ATOM 0 HG12 VAL A 32 -9.722 22.479 18.890 1.00 0.00 H new ATOM 0 HG13 VAL A 32 -11.188 21.964 19.756 1.00 0.00 H new ATOM 0 HG21 VAL A 32 -10.913 24.023 22.038 1.00 0.00 H new ATOM 0 HG22 VAL A 32 -11.289 22.304 22.305 1.00 0.00 H new ATOM 0 HG23 VAL A 32 -9.890 23.045 23.118 1.00 0.00 H new ATOM 461 N LEU A 33 -7.176 21.785 19.714 1.00 0.00 N ATOM 462 CA LEU A 33 -6.282 21.567 18.582 1.00 0.00 C ATOM 463 C LEU A 33 -5.552 20.234 18.713 1.00 0.00 C ATOM 464 O LEU A 33 -5.144 19.638 17.716 1.00 0.00 O ATOM 465 CB LEU A 33 -5.268 22.709 18.480 1.00 0.00 C ATOM 466 CG LEU A 33 -5.844 24.093 18.179 1.00 0.00 C ATOM 467 CD1 LEU A 33 -4.883 25.181 18.631 1.00 0.00 C ATOM 468 CD2 LEU A 33 -6.152 24.232 16.695 1.00 0.00 C ATOM 0 H LEU A 33 -7.007 22.652 20.224 1.00 0.00 H new ATOM 0 HA LEU A 33 -6.885 21.542 17.674 1.00 0.00 H new ATOM 0 HB2 LEU A 33 -4.716 22.763 19.419 1.00 0.00 H new ATOM 0 HB3 LEU A 33 -4.548 22.460 17.701 1.00 0.00 H new ATOM 0 HG LEU A 33 -6.775 24.206 18.734 1.00 0.00 H new ATOM 0 HD11 LEU A 33 -5.310 26.159 18.409 1.00 0.00 H new ATOM 0 HD12 LEU A 33 -4.714 25.094 19.704 1.00 0.00 H new ATOM 0 HD13 LEU A 33 -3.935 25.071 18.105 1.00 0.00 H new ATOM 0 HD21 LEU A 33 -6.561 25.223 16.500 1.00 0.00 H new ATOM 0 HD22 LEU A 33 -5.236 24.097 16.119 1.00 0.00 H new ATOM 0 HD23 LEU A 33 -6.879 23.475 16.402 1.00 0.00 H new ATOM 480 N ASP A 34 -5.392 19.772 19.948 1.00 0.00 N ATOM 481 CA ASP A 34 -4.715 18.508 20.210 1.00 0.00 C ATOM 482 C ASP A 34 -5.620 17.326 19.874 1.00 0.00 C ATOM 483 O ASP A 34 -5.142 16.234 19.565 1.00 0.00 O ATOM 484 CB ASP A 34 -4.278 18.432 21.673 1.00 0.00 C ATOM 485 CG ASP A 34 -2.934 19.091 21.911 1.00 0.00 C ATOM 486 OD1 ASP A 34 -2.657 20.124 21.266 1.00 0.00 O ATOM 487 OD2 ASP A 34 -2.158 18.574 22.742 1.00 0.00 O ATOM 0 H ASP A 34 -5.722 20.254 20.784 1.00 0.00 H new ATOM 0 HA ASP A 34 -3.832 18.459 19.573 1.00 0.00 H new ATOM 0 HB2 ASP A 34 -5.030 18.912 22.299 1.00 0.00 H new ATOM 0 HB3 ASP A 34 -4.227 17.387 21.980 1.00 0.00 H new ATOM 492 N TRP A 35 -6.927 17.552 19.938 1.00 0.00 N ATOM 493 CA TRP A 35 -7.899 16.506 19.642 1.00 0.00 C ATOM 494 C TRP A 35 -8.096 16.356 18.138 1.00 0.00 C ATOM 495 O TRP A 35 -8.303 15.250 17.637 1.00 0.00 O ATOM 496 CB TRP A 35 -9.236 16.818 20.316 1.00 0.00 C ATOM 497 CG TRP A 35 -10.338 15.887 19.909 1.00 0.00 C ATOM 498 CD1 TRP A 35 -10.470 14.573 20.255 1.00 0.00 C ATOM 499 CD2 TRP A 35 -11.460 16.200 19.076 1.00 0.00 C ATOM 500 NE1 TRP A 35 -11.607 14.050 19.689 1.00 0.00 N ATOM 501 CE2 TRP A 35 -12.233 15.028 18.961 1.00 0.00 C ATOM 502 CE3 TRP A 35 -11.888 17.356 18.419 1.00 0.00 C ATOM 503 CZ2 TRP A 35 -13.407 14.981 18.215 1.00 0.00 C ATOM 504 CZ3 TRP A 35 -13.054 17.308 17.678 1.00 0.00 C ATOM 505 CH2 TRP A 35 -13.803 16.128 17.582 1.00 0.00 C ATOM 0 H TRP A 35 -7.338 18.450 20.192 1.00 0.00 H new ATOM 0 HA TRP A 35 -7.514 15.565 20.034 1.00 0.00 H new ATOM 0 HB2 TRP A 35 -9.110 16.769 21.398 1.00 0.00 H new ATOM 0 HB3 TRP A 35 -9.526 17.841 20.075 1.00 0.00 H new ATOM 0 HD1 TRP A 35 -9.782 14.025 20.882 1.00 0.00 H new ATOM 0 HE1 TRP A 35 -11.933 13.089 19.794 1.00 0.00 H new ATOM 0 HE3 TRP A 35 -11.318 18.271 18.489 1.00 0.00 H new ATOM 0 HZ2 TRP A 35 -13.985 14.072 18.138 1.00 0.00 H new ATOM 0 HZ3 TRP A 35 -13.393 18.195 17.164 1.00 0.00 H new ATOM 0 HH2 TRP A 35 -14.711 16.123 16.997 1.00 0.00 H new ATOM 516 N ILE A 36 -8.030 17.474 17.423 1.00 0.00 N ATOM 517 CA ILE A 36 -8.201 17.465 15.975 1.00 0.00 C ATOM 518 C ILE A 36 -7.141 16.599 15.302 1.00 0.00 C ATOM 519 O ILE A 36 -7.461 15.708 14.515 1.00 0.00 O ATOM 520 CB ILE A 36 -8.131 18.889 15.391 1.00 0.00 C ATOM 521 CG1 ILE A 36 -9.206 19.775 16.022 1.00 0.00 C ATOM 522 CG2 ILE A 36 -8.289 18.849 13.879 1.00 0.00 C ATOM 523 CD1 ILE A 36 -9.192 21.199 15.511 1.00 0.00 C ATOM 0 H ILE A 36 -7.859 18.397 17.822 1.00 0.00 H new ATOM 0 HA ILE A 36 -9.188 17.048 15.776 1.00 0.00 H new ATOM 0 HB ILE A 36 -7.155 19.314 15.623 1.00 0.00 H new ATOM 0 HG12 ILE A 36 -10.185 19.338 15.828 1.00 0.00 H new ATOM 0 HG13 ILE A 36 -9.069 19.784 17.103 1.00 0.00 H new ATOM 0 HG21 ILE A 36 -8.237 19.862 13.481 1.00 0.00 H new ATOM 0 HG22 ILE A 36 -7.490 18.248 13.445 1.00 0.00 H new ATOM 0 HG23 ILE A 36 -9.253 18.408 13.625 1.00 0.00 H new ATOM 0 HD11 ILE A 36 -9.981 21.769 16.002 1.00 0.00 H new ATOM 0 HD12 ILE A 36 -8.226 21.654 15.729 1.00 0.00 H new ATOM 0 HD13 ILE A 36 -9.360 21.201 14.434 1.00 0.00 H new ATOM 535 N SER A 37 -5.878 16.866 15.618 1.00 0.00 N ATOM 536 CA SER A 37 -4.770 16.113 15.043 1.00 0.00 C ATOM 537 C SER A 37 -4.989 14.612 15.209 1.00 0.00 C ATOM 538 O SER A 37 -4.632 13.821 14.337 1.00 0.00 O ATOM 539 CB SER A 37 -3.451 16.523 15.700 1.00 0.00 C ATOM 540 OG SER A 37 -2.399 15.652 15.320 1.00 0.00 O ATOM 0 H SER A 37 -5.597 17.599 16.269 1.00 0.00 H new ATOM 0 HA SER A 37 -4.723 16.340 13.978 1.00 0.00 H new ATOM 0 HB2 SER A 37 -3.202 17.545 15.415 1.00 0.00 H new ATOM 0 HB3 SER A 37 -3.562 16.512 16.784 1.00 0.00 H new ATOM 0 HG SER A 37 -1.567 15.936 15.752 1.00 0.00 H new ATOM 546 N TYR A 38 -5.580 14.229 16.336 1.00 0.00 N ATOM 547 CA TYR A 38 -5.845 12.823 16.619 1.00 0.00 C ATOM 548 C TYR A 38 -6.798 12.230 15.586 1.00 0.00 C ATOM 549 O TYR A 38 -6.566 11.138 15.068 1.00 0.00 O ATOM 550 CB TYR A 38 -6.434 12.666 18.022 1.00 0.00 C ATOM 551 CG TYR A 38 -7.527 11.626 18.107 1.00 0.00 C ATOM 552 CD1 TYR A 38 -7.236 10.272 17.986 1.00 0.00 C ATOM 553 CD2 TYR A 38 -8.851 11.995 18.307 1.00 0.00 C ATOM 554 CE1 TYR A 38 -8.231 9.318 18.063 1.00 0.00 C ATOM 555 CE2 TYR A 38 -9.853 11.047 18.386 1.00 0.00 C ATOM 556 CZ TYR A 38 -9.538 9.710 18.263 1.00 0.00 C ATOM 557 OH TYR A 38 -10.534 8.763 18.340 1.00 0.00 O ATOM 0 H TYR A 38 -5.884 14.872 17.067 1.00 0.00 H new ATOM 0 HA TYR A 38 -4.899 12.283 16.567 1.00 0.00 H new ATOM 0 HB2 TYR A 38 -5.636 12.399 18.714 1.00 0.00 H new ATOM 0 HB3 TYR A 38 -6.832 13.627 18.349 1.00 0.00 H new ATOM 0 HD1 TYR A 38 -6.214 9.961 17.829 1.00 0.00 H new ATOM 0 HD2 TYR A 38 -9.102 13.041 18.402 1.00 0.00 H new ATOM 0 HE1 TYR A 38 -7.987 8.270 17.967 1.00 0.00 H new ATOM 0 HE2 TYR A 38 -10.877 11.351 18.543 1.00 0.00 H new ATOM 0 HH TYR A 38 -11.399 9.182 18.148 1.00 0.00 H new ATOM 567 N GLN A 39 -7.870 12.958 15.293 1.00 0.00 N ATOM 568 CA GLN A 39 -8.859 12.504 14.322 1.00 0.00 C ATOM 569 C GLN A 39 -8.353 12.701 12.897 1.00 0.00 C ATOM 570 O GLN A 39 -8.807 12.033 11.968 1.00 0.00 O ATOM 571 CB GLN A 39 -10.177 13.255 14.516 1.00 0.00 C ATOM 572 CG GLN A 39 -11.170 12.523 15.404 1.00 0.00 C ATOM 573 CD GLN A 39 -12.300 11.889 14.617 1.00 0.00 C ATOM 574 OE1 GLN A 39 -13.035 12.572 13.904 1.00 0.00 O ATOM 575 NE2 GLN A 39 -12.445 10.575 14.742 1.00 0.00 N ATOM 0 H GLN A 39 -8.076 13.864 15.713 1.00 0.00 H new ATOM 0 HA GLN A 39 -9.028 11.439 14.484 1.00 0.00 H new ATOM 0 HB2 GLN A 39 -9.968 14.233 14.949 1.00 0.00 H new ATOM 0 HB3 GLN A 39 -10.633 13.429 13.541 1.00 0.00 H new ATOM 0 HG2 GLN A 39 -10.647 11.750 15.968 1.00 0.00 H new ATOM 0 HG3 GLN A 39 -11.585 13.221 16.130 1.00 0.00 H new ATOM 0 HE21 GLN A 39 -11.813 10.047 15.344 1.00 0.00 H new ATOM 0 HE22 GLN A 39 -13.188 10.093 14.236 1.00 0.00 H new ATOM 584 N VAL A 40 -7.410 13.624 12.731 1.00 0.00 N ATOM 585 CA VAL A 40 -6.841 13.909 11.419 1.00 0.00 C ATOM 586 C VAL A 40 -5.799 12.865 11.033 1.00 0.00 C ATOM 587 O VAL A 40 -5.535 12.645 9.852 1.00 0.00 O ATOM 588 CB VAL A 40 -6.192 15.305 11.380 1.00 0.00 C ATOM 589 CG1 VAL A 40 -5.555 15.560 10.022 1.00 0.00 C ATOM 590 CG2 VAL A 40 -7.219 16.379 11.706 1.00 0.00 C ATOM 0 H VAL A 40 -7.024 14.187 13.489 1.00 0.00 H new ATOM 0 HA VAL A 40 -7.663 13.879 10.704 1.00 0.00 H new ATOM 0 HB VAL A 40 -5.407 15.343 12.136 1.00 0.00 H new ATOM 0 HG11 VAL A 40 -5.101 16.551 10.013 1.00 0.00 H new ATOM 0 HG12 VAL A 40 -4.788 14.809 9.833 1.00 0.00 H new ATOM 0 HG13 VAL A 40 -6.318 15.503 9.246 1.00 0.00 H new ATOM 0 HG21 VAL A 40 -6.743 17.359 11.674 1.00 0.00 H new ATOM 0 HG22 VAL A 40 -8.027 16.344 10.975 1.00 0.00 H new ATOM 0 HG23 VAL A 40 -7.624 16.205 12.703 1.00 0.00 H new ATOM 600 N GLU A 41 -5.212 12.223 12.039 1.00 0.00 N ATOM 601 CA GLU A 41 -4.198 11.202 11.804 1.00 0.00 C ATOM 602 C GLU A 41 -4.829 9.814 11.734 1.00 0.00 C ATOM 603 O GLU A 41 -4.276 8.897 11.127 1.00 0.00 O ATOM 604 CB GLU A 41 -3.140 11.238 12.909 1.00 0.00 C ATOM 605 CG GLU A 41 -2.016 10.235 12.708 1.00 0.00 C ATOM 606 CD GLU A 41 -1.449 10.267 11.302 1.00 0.00 C ATOM 607 OE1 GLU A 41 -1.190 11.378 10.793 1.00 0.00 O ATOM 608 OE2 GLU A 41 -1.265 9.183 10.712 1.00 0.00 O ATOM 0 H GLU A 41 -5.421 12.392 13.023 1.00 0.00 H new ATOM 0 HA GLU A 41 -3.721 11.414 10.847 1.00 0.00 H new ATOM 0 HB2 GLU A 41 -2.716 12.241 12.962 1.00 0.00 H new ATOM 0 HB3 GLU A 41 -3.621 11.045 13.868 1.00 0.00 H new ATOM 0 HG2 GLU A 41 -1.219 10.441 13.422 1.00 0.00 H new ATOM 0 HG3 GLU A 41 -2.386 9.233 12.924 1.00 0.00 H new ATOM 615 N LYS A 42 -5.992 9.668 12.362 1.00 0.00 N ATOM 616 CA LYS A 42 -6.701 8.394 12.372 1.00 0.00 C ATOM 617 C LYS A 42 -7.559 8.239 11.120 1.00 0.00 C ATOM 618 O LYS A 42 -7.685 7.143 10.575 1.00 0.00 O ATOM 619 CB LYS A 42 -7.578 8.285 13.621 1.00 0.00 C ATOM 620 CG LYS A 42 -7.552 6.909 14.264 1.00 0.00 C ATOM 621 CD LYS A 42 -7.403 7.002 15.774 1.00 0.00 C ATOM 622 CE LYS A 42 -7.140 5.638 16.393 1.00 0.00 C ATOM 623 NZ LYS A 42 -8.403 4.889 16.641 1.00 0.00 N ATOM 0 H LYS A 42 -6.463 10.417 12.870 1.00 0.00 H new ATOM 0 HA LYS A 42 -5.960 7.594 12.385 1.00 0.00 H new ATOM 0 HB2 LYS A 42 -7.249 9.024 14.351 1.00 0.00 H new ATOM 0 HB3 LYS A 42 -8.606 8.534 13.356 1.00 0.00 H new ATOM 0 HG2 LYS A 42 -8.470 6.375 14.020 1.00 0.00 H new ATOM 0 HG3 LYS A 42 -6.727 6.329 13.851 1.00 0.00 H new ATOM 0 HD2 LYS A 42 -6.584 7.678 16.019 1.00 0.00 H new ATOM 0 HD3 LYS A 42 -8.309 7.430 16.204 1.00 0.00 H new ATOM 0 HE2 LYS A 42 -6.497 5.057 15.732 1.00 0.00 H new ATOM 0 HE3 LYS A 42 -6.601 5.763 17.332 1.00 0.00 H new ATOM 0 HZ1 LYS A 42 -8.181 3.965 17.063 1.00 0.00 H new ATOM 0 HZ2 LYS A 42 -9.006 5.431 17.292 1.00 0.00 H new ATOM 0 HZ3 LYS A 42 -8.905 4.747 15.741 1.00 0.00 H new ATOM 637 N ASN A 43 -8.146 9.343 10.671 1.00 0.00 N ATOM 638 CA ASN A 43 -8.992 9.329 9.482 1.00 0.00 C ATOM 639 C ASN A 43 -8.147 9.357 8.213 1.00 0.00 C ATOM 640 O ASN A 43 -8.674 9.316 7.101 1.00 0.00 O ATOM 641 CB ASN A 43 -9.949 10.523 9.498 1.00 0.00 C ATOM 642 CG ASN A 43 -11.141 10.296 10.408 1.00 0.00 C ATOM 643 OD1 ASN A 43 -12.273 10.158 9.944 1.00 0.00 O ATOM 644 ND2 ASN A 43 -10.891 10.257 11.712 1.00 0.00 N ATOM 0 H ASN A 43 -8.052 10.258 11.111 1.00 0.00 H new ATOM 0 HA ASN A 43 -9.572 8.406 9.490 1.00 0.00 H new ATOM 0 HB2 ASN A 43 -9.410 11.413 9.824 1.00 0.00 H new ATOM 0 HB3 ASN A 43 -10.301 10.717 8.485 1.00 0.00 H new ATOM 0 HD21 ASN A 43 -11.653 10.108 12.373 1.00 0.00 H new ATOM 0 HD22 ASN A 43 -9.937 10.376 12.052 1.00 0.00 H new ATOM 651 N LYS A 44 -6.831 9.428 8.386 1.00 0.00 N ATOM 652 CA LYS A 44 -5.911 9.460 7.255 1.00 0.00 C ATOM 653 C LYS A 44 -6.129 10.712 6.412 1.00 0.00 C ATOM 654 O LYS A 44 -5.748 10.758 5.242 1.00 0.00 O ATOM 655 CB LYS A 44 -6.090 8.211 6.389 1.00 0.00 C ATOM 656 CG LYS A 44 -4.924 7.242 6.471 1.00 0.00 C ATOM 657 CD LYS A 44 -5.388 5.800 6.350 1.00 0.00 C ATOM 658 CE LYS A 44 -4.821 5.135 5.105 1.00 0.00 C ATOM 659 NZ LYS A 44 -5.419 5.689 3.859 1.00 0.00 N ATOM 0 H LYS A 44 -6.378 9.464 9.299 1.00 0.00 H new ATOM 0 HA LYS A 44 -4.894 9.480 7.647 1.00 0.00 H new ATOM 0 HB2 LYS A 44 -7.001 7.696 6.693 1.00 0.00 H new ATOM 0 HB3 LYS A 44 -6.226 8.515 5.351 1.00 0.00 H new ATOM 0 HG2 LYS A 44 -4.210 7.463 5.678 1.00 0.00 H new ATOM 0 HG3 LYS A 44 -4.402 7.379 7.418 1.00 0.00 H new ATOM 0 HD2 LYS A 44 -5.080 5.242 7.234 1.00 0.00 H new ATOM 0 HD3 LYS A 44 -6.477 5.769 6.317 1.00 0.00 H new ATOM 0 HE2 LYS A 44 -3.740 5.272 5.081 1.00 0.00 H new ATOM 0 HE3 LYS A 44 -5.006 4.062 5.150 1.00 0.00 H new ATOM 0 HZ1 LYS A 44 -5.007 5.210 3.033 1.00 0.00 H new ATOM 0 HZ2 LYS A 44 -6.448 5.536 3.870 1.00 0.00 H new ATOM 0 HZ3 LYS A 44 -5.221 6.708 3.802 1.00 0.00 H new ATOM 673 N TYR A 45 -6.742 11.726 7.013 1.00 0.00 N ATOM 674 CA TYR A 45 -7.011 12.978 6.316 1.00 0.00 C ATOM 675 C TYR A 45 -5.712 13.699 5.969 1.00 0.00 C ATOM 676 O TYR A 45 -4.828 13.848 6.813 1.00 0.00 O ATOM 677 CB TYR A 45 -7.896 13.884 7.174 1.00 0.00 C ATOM 678 CG TYR A 45 -8.594 14.970 6.388 1.00 0.00 C ATOM 679 CD1 TYR A 45 -9.465 14.654 5.352 1.00 0.00 C ATOM 680 CD2 TYR A 45 -8.382 16.312 6.679 1.00 0.00 C ATOM 681 CE1 TYR A 45 -10.105 15.643 4.630 1.00 0.00 C ATOM 682 CE2 TYR A 45 -9.018 17.307 5.963 1.00 0.00 C ATOM 683 CZ TYR A 45 -9.879 16.968 4.940 1.00 0.00 C ATOM 684 OH TYR A 45 -10.513 17.957 4.224 1.00 0.00 O ATOM 0 H TYR A 45 -7.062 11.705 7.981 1.00 0.00 H new ATOM 0 HA TYR A 45 -7.534 12.743 5.389 1.00 0.00 H new ATOM 0 HB2 TYR A 45 -8.645 13.274 7.678 1.00 0.00 H new ATOM 0 HB3 TYR A 45 -7.285 14.345 7.950 1.00 0.00 H new ATOM 0 HD1 TYR A 45 -9.645 13.618 5.107 1.00 0.00 H new ATOM 0 HD2 TYR A 45 -7.708 16.582 7.479 1.00 0.00 H new ATOM 0 HE1 TYR A 45 -10.778 15.380 3.828 1.00 0.00 H new ATOM 0 HE2 TYR A 45 -8.842 18.345 6.203 1.00 0.00 H new ATOM 0 HH TYR A 45 -10.885 17.577 3.401 1.00 0.00 H new ATOM 694 N ASP A 46 -5.605 14.143 4.722 1.00 0.00 N ATOM 695 CA ASP A 46 -4.415 14.850 4.262 1.00 0.00 C ATOM 696 C ASP A 46 -4.123 16.057 5.148 1.00 0.00 C ATOM 697 O ASP A 46 -2.978 16.494 5.261 1.00 0.00 O ATOM 698 CB ASP A 46 -4.592 15.299 2.810 1.00 0.00 C ATOM 699 CG ASP A 46 -3.399 14.943 1.945 1.00 0.00 C ATOM 700 OD1 ASP A 46 -2.263 14.962 2.464 1.00 0.00 O ATOM 701 OD2 ASP A 46 -3.600 14.647 0.748 1.00 0.00 O ATOM 0 H ASP A 46 -6.327 14.026 4.011 1.00 0.00 H new ATOM 0 HA ASP A 46 -3.570 14.165 4.322 1.00 0.00 H new ATOM 0 HB2 ASP A 46 -5.488 14.836 2.396 1.00 0.00 H new ATOM 0 HB3 ASP A 46 -4.748 16.377 2.783 1.00 0.00 H new ATOM 706 N ALA A 47 -5.167 16.591 5.774 1.00 0.00 N ATOM 707 CA ALA A 47 -5.022 17.746 6.651 1.00 0.00 C ATOM 708 C ALA A 47 -4.548 18.969 5.874 1.00 0.00 C ATOM 709 O ALA A 47 -3.945 19.881 6.440 1.00 0.00 O ATOM 710 CB ALA A 47 -4.056 17.431 7.784 1.00 0.00 C ATOM 0 H ALA A 47 -6.122 16.242 5.690 1.00 0.00 H new ATOM 0 HA ALA A 47 -6.000 17.974 7.075 1.00 0.00 H new ATOM 0 HB1 ALA A 47 -3.957 18.303 8.431 1.00 0.00 H new ATOM 0 HB2 ALA A 47 -4.437 16.590 8.364 1.00 0.00 H new ATOM 0 HB3 ALA A 47 -3.081 17.174 7.370 1.00 0.00 H new ATOM 716 N SER A 48 -4.822 18.982 4.574 1.00 0.00 N ATOM 717 CA SER A 48 -4.419 20.091 3.718 1.00 0.00 C ATOM 718 C SER A 48 -5.629 20.922 3.300 1.00 0.00 C ATOM 719 O SER A 48 -5.614 21.580 2.260 1.00 0.00 O ATOM 720 CB SER A 48 -3.692 19.568 2.477 1.00 0.00 C ATOM 721 OG SER A 48 -4.612 19.210 1.461 1.00 0.00 O ATOM 0 H SER A 48 -5.322 18.236 4.090 1.00 0.00 H new ATOM 0 HA SER A 48 -3.741 20.728 4.286 1.00 0.00 H new ATOM 0 HB2 SER A 48 -3.010 20.331 2.102 1.00 0.00 H new ATOM 0 HB3 SER A 48 -3.086 18.703 2.744 1.00 0.00 H new ATOM 0 HG SER A 48 -5.029 20.019 1.098 1.00 0.00 H new ATOM 727 N ALA A 49 -6.675 20.886 4.118 1.00 0.00 N ATOM 728 CA ALA A 49 -7.892 21.636 3.836 1.00 0.00 C ATOM 729 C ALA A 49 -8.358 22.410 5.065 1.00 0.00 C ATOM 730 O ALA A 49 -8.809 23.551 4.957 1.00 0.00 O ATOM 731 CB ALA A 49 -8.989 20.699 3.353 1.00 0.00 C ATOM 0 H ALA A 49 -6.704 20.345 4.982 1.00 0.00 H new ATOM 0 HA ALA A 49 -7.671 22.356 3.048 1.00 0.00 H new ATOM 0 HB1 ALA A 49 -9.892 21.273 3.146 1.00 0.00 H new ATOM 0 HB2 ALA A 49 -8.663 20.195 2.443 1.00 0.00 H new ATOM 0 HB3 ALA A 49 -9.199 19.957 4.123 1.00 0.00 H new ATOM 737 N ILE A 50 -8.247 21.782 6.231 1.00 0.00 N ATOM 738 CA ILE A 50 -8.657 22.412 7.479 1.00 0.00 C ATOM 739 C ILE A 50 -8.026 23.792 7.631 1.00 0.00 C ATOM 740 O ILE A 50 -6.881 24.010 7.233 1.00 0.00 O ATOM 741 CB ILE A 50 -8.276 21.550 8.697 1.00 0.00 C ATOM 742 CG1 ILE A 50 -8.928 20.169 8.595 1.00 0.00 C ATOM 743 CG2 ILE A 50 -8.689 22.243 9.987 1.00 0.00 C ATOM 744 CD1 ILE A 50 -8.459 19.199 9.657 1.00 0.00 C ATOM 0 H ILE A 50 -7.877 20.838 6.337 1.00 0.00 H new ATOM 0 HA ILE A 50 -9.742 22.512 7.440 1.00 0.00 H new ATOM 0 HB ILE A 50 -7.194 21.421 8.708 1.00 0.00 H new ATOM 0 HG12 ILE A 50 -10.010 20.281 8.669 1.00 0.00 H new ATOM 0 HG13 ILE A 50 -8.717 19.748 7.612 1.00 0.00 H new ATOM 0 HG21 ILE A 50 -8.413 21.621 10.839 1.00 0.00 H new ATOM 0 HG22 ILE A 50 -8.183 23.205 10.061 1.00 0.00 H new ATOM 0 HG23 ILE A 50 -9.768 22.400 9.987 1.00 0.00 H new ATOM 0 HD11 ILE A 50 -8.963 18.242 9.523 1.00 0.00 H new ATOM 0 HD12 ILE A 50 -7.382 19.058 9.570 1.00 0.00 H new ATOM 0 HD13 ILE A 50 -8.694 19.598 10.644 1.00 0.00 H new ATOM 756 N ASP A 51 -8.778 24.720 8.211 1.00 0.00 N ATOM 757 CA ASP A 51 -8.292 26.079 8.419 1.00 0.00 C ATOM 758 C ASP A 51 -8.151 26.385 9.907 1.00 0.00 C ATOM 759 O ASP A 51 -9.037 26.985 10.515 1.00 0.00 O ATOM 760 CB ASP A 51 -9.239 27.088 7.766 1.00 0.00 C ATOM 761 CG ASP A 51 -9.047 27.175 6.265 1.00 0.00 C ATOM 762 OD1 ASP A 51 -8.096 26.549 5.752 1.00 0.00 O ATOM 763 OD2 ASP A 51 -9.847 27.869 5.603 1.00 0.00 O ATOM 0 H ASP A 51 -9.727 24.556 8.546 1.00 0.00 H new ATOM 0 HA ASP A 51 -7.309 26.161 7.955 1.00 0.00 H new ATOM 0 HB2 ASP A 51 -10.270 26.807 7.982 1.00 0.00 H new ATOM 0 HB3 ASP A 51 -9.078 28.071 8.208 1.00 0.00 H new ATOM 768 N PHE A 52 -7.032 25.966 10.488 1.00 0.00 N ATOM 769 CA PHE A 52 -6.775 26.192 11.906 1.00 0.00 C ATOM 770 C PHE A 52 -6.816 27.682 12.235 1.00 0.00 C ATOM 771 O PHE A 52 -7.047 28.069 13.380 1.00 0.00 O ATOM 772 CB PHE A 52 -5.417 25.608 12.299 1.00 0.00 C ATOM 773 CG PHE A 52 -5.333 24.118 12.130 1.00 0.00 C ATOM 774 CD1 PHE A 52 -4.939 23.566 10.921 1.00 0.00 C ATOM 775 CD2 PHE A 52 -5.648 23.269 13.179 1.00 0.00 C ATOM 776 CE1 PHE A 52 -4.862 22.196 10.763 1.00 0.00 C ATOM 777 CE2 PHE A 52 -5.572 21.898 13.026 1.00 0.00 C ATOM 778 CZ PHE A 52 -5.178 21.360 11.816 1.00 0.00 C ATOM 0 H PHE A 52 -6.288 25.468 9.999 1.00 0.00 H new ATOM 0 HA PHE A 52 -7.557 25.690 12.476 1.00 0.00 H new ATOM 0 HB2 PHE A 52 -4.640 26.078 11.696 1.00 0.00 H new ATOM 0 HB3 PHE A 52 -5.210 25.860 13.339 1.00 0.00 H new ATOM 0 HD1 PHE A 52 -4.690 24.214 10.094 1.00 0.00 H new ATOM 0 HD2 PHE A 52 -5.957 23.684 14.127 1.00 0.00 H new ATOM 0 HE1 PHE A 52 -4.555 21.778 9.816 1.00 0.00 H new ATOM 0 HE2 PHE A 52 -5.820 21.247 13.852 1.00 0.00 H new ATOM 0 HZ PHE A 52 -5.117 20.289 11.694 1.00 0.00 H new ATOM 788 N SER A 53 -6.588 28.512 11.222 1.00 0.00 N ATOM 789 CA SER A 53 -6.594 29.959 11.403 1.00 0.00 C ATOM 790 C SER A 53 -7.903 30.421 12.035 1.00 0.00 C ATOM 791 O SER A 53 -7.934 31.403 12.778 1.00 0.00 O ATOM 792 CB SER A 53 -6.386 30.663 10.061 1.00 0.00 C ATOM 793 OG SER A 53 -5.028 31.027 9.881 1.00 0.00 O ATOM 0 H SER A 53 -6.397 28.207 10.268 1.00 0.00 H new ATOM 0 HA SER A 53 -5.775 30.220 12.073 1.00 0.00 H new ATOM 0 HB2 SER A 53 -6.700 30.006 9.250 1.00 0.00 H new ATOM 0 HB3 SER A 53 -7.014 31.553 10.012 1.00 0.00 H new ATOM 0 HG SER A 53 -4.921 31.474 9.015 1.00 0.00 H new ATOM 799 N ARG A 54 -8.983 29.708 11.734 1.00 0.00 N ATOM 800 CA ARG A 54 -10.296 30.045 12.271 1.00 0.00 C ATOM 801 C ARG A 54 -10.700 29.069 13.373 1.00 0.00 C ATOM 802 O ARG A 54 -11.884 28.912 13.672 1.00 0.00 O ATOM 803 CB ARG A 54 -11.344 30.036 11.157 1.00 0.00 C ATOM 804 CG ARG A 54 -10.939 30.840 9.933 1.00 0.00 C ATOM 805 CD ARG A 54 -12.087 31.698 9.425 1.00 0.00 C ATOM 806 NE ARG A 54 -11.613 32.845 8.655 1.00 0.00 N ATOM 807 CZ ARG A 54 -12.420 33.756 8.121 1.00 0.00 C ATOM 808 NH1 ARG A 54 -13.733 33.653 8.273 1.00 0.00 N ATOM 809 NH2 ARG A 54 -11.913 34.772 7.435 1.00 0.00 N ATOM 0 H ARG A 54 -8.975 28.893 11.121 1.00 0.00 H new ATOM 0 HA ARG A 54 -10.240 31.046 12.699 1.00 0.00 H new ATOM 0 HB2 ARG A 54 -11.535 29.005 10.857 1.00 0.00 H new ATOM 0 HB3 ARG A 54 -12.281 30.433 11.548 1.00 0.00 H new ATOM 0 HG2 ARG A 54 -10.089 31.476 10.179 1.00 0.00 H new ATOM 0 HG3 ARG A 54 -10.612 30.163 9.144 1.00 0.00 H new ATOM 0 HD2 ARG A 54 -12.746 31.091 8.804 1.00 0.00 H new ATOM 0 HD3 ARG A 54 -12.679 32.048 10.270 1.00 0.00 H new ATOM 0 HE ARG A 54 -10.608 32.953 8.520 1.00 0.00 H new ATOM 0 HH11 ARG A 54 -14.126 32.873 8.801 1.00 0.00 H new ATOM 0 HH12 ARG A 54 -14.350 34.353 7.862 1.00 0.00 H new ATOM 0 HH21 ARG A 54 -10.903 34.854 7.317 1.00 0.00 H new ATOM 0 HH22 ARG A 54 -12.533 35.471 7.025 1.00 0.00 H new ATOM 823 N CYS A 55 -9.709 28.417 13.970 1.00 0.00 N ATOM 824 CA CYS A 55 -9.961 27.455 15.038 1.00 0.00 C ATOM 825 C CYS A 55 -9.728 28.087 16.406 1.00 0.00 C ATOM 826 O CYS A 55 -8.798 27.716 17.122 1.00 0.00 O ATOM 827 CB CYS A 55 -9.064 26.228 14.870 1.00 0.00 C ATOM 828 SG CYS A 55 -9.422 24.887 16.028 1.00 0.00 S ATOM 0 H CYS A 55 -8.724 28.536 13.733 1.00 0.00 H new ATOM 0 HA CYS A 55 -11.004 27.145 14.975 1.00 0.00 H new ATOM 0 HB2 CYS A 55 -9.168 25.852 13.852 1.00 0.00 H new ATOM 0 HB3 CYS A 55 -8.024 26.532 14.993 1.00 0.00 H new ATOM 0 HG CYS A 55 -10.612 25.049 16.525 1.00 0.00 H new ATOM 834 N ASP A 56 -10.577 29.045 16.762 1.00 0.00 N ATOM 835 CA ASP A 56 -10.464 29.730 18.044 1.00 0.00 C ATOM 836 C ASP A 56 -11.471 29.177 19.047 1.00 0.00 C ATOM 837 O ASP A 56 -12.417 29.862 19.434 1.00 0.00 O ATOM 838 CB ASP A 56 -10.678 31.234 17.864 1.00 0.00 C ATOM 839 CG ASP A 56 -9.454 31.930 17.301 1.00 0.00 C ATOM 840 OD1 ASP A 56 -8.361 31.327 17.336 1.00 0.00 O ATOM 841 OD2 ASP A 56 -9.590 33.077 16.826 1.00 0.00 O ATOM 0 H ASP A 56 -11.351 29.365 16.180 1.00 0.00 H new ATOM 0 HA ASP A 56 -9.460 29.558 18.432 1.00 0.00 H new ATOM 0 HB2 ASP A 56 -11.525 31.400 17.199 1.00 0.00 H new ATOM 0 HB3 ASP A 56 -10.935 31.679 18.825 1.00 0.00 H new ATOM 846 N MET A 57 -11.261 27.932 19.463 1.00 0.00 N ATOM 847 CA MET A 57 -12.151 27.287 20.422 1.00 0.00 C ATOM 848 C MET A 57 -11.358 26.668 21.569 1.00 0.00 C ATOM 849 O MET A 57 -10.448 25.870 21.346 1.00 0.00 O ATOM 850 CB MET A 57 -12.990 26.212 19.728 1.00 0.00 C ATOM 851 CG MET A 57 -13.615 26.678 18.423 1.00 0.00 C ATOM 852 SD MET A 57 -12.803 25.974 16.974 1.00 0.00 S ATOM 853 CE MET A 57 -14.216 25.373 16.053 1.00 0.00 C ATOM 0 H MET A 57 -10.483 27.350 19.151 1.00 0.00 H new ATOM 0 HA MET A 57 -12.815 28.048 20.832 1.00 0.00 H new ATOM 0 HB2 MET A 57 -12.362 25.343 19.531 1.00 0.00 H new ATOM 0 HB3 MET A 57 -13.781 25.887 20.404 1.00 0.00 H new ATOM 0 HG2 MET A 57 -14.670 26.405 18.412 1.00 0.00 H new ATOM 0 HG3 MET A 57 -13.567 27.766 18.369 1.00 0.00 H new ATOM 0 HE1 MET A 57 -13.983 25.374 14.988 1.00 0.00 H new ATOM 0 HE2 MET A 57 -14.453 24.358 16.372 1.00 0.00 H new ATOM 0 HE3 MET A 57 -15.073 26.021 16.238 1.00 0.00 H new ATOM 863 N ASP A 58 -11.710 27.042 22.794 1.00 0.00 N ATOM 864 CA ASP A 58 -11.031 26.523 23.976 1.00 0.00 C ATOM 865 C ASP A 58 -11.673 25.220 24.442 1.00 0.00 C ATOM 866 O ASP A 58 -10.980 24.263 24.786 1.00 0.00 O ATOM 867 CB ASP A 58 -11.064 27.555 25.104 1.00 0.00 C ATOM 868 CG ASP A 58 -10.987 28.978 24.589 1.00 0.00 C ATOM 869 OD1 ASP A 58 -10.244 29.217 23.614 1.00 0.00 O ATOM 870 OD2 ASP A 58 -11.670 29.854 25.160 1.00 0.00 O ATOM 0 H ASP A 58 -12.461 27.702 22.995 1.00 0.00 H new ATOM 0 HA ASP A 58 -9.993 26.321 23.710 1.00 0.00 H new ATOM 0 HB2 ASP A 58 -11.980 27.430 25.681 1.00 0.00 H new ATOM 0 HB3 ASP A 58 -10.232 27.372 25.784 1.00 0.00 H new ATOM 875 N GLY A 59 -13.002 25.191 24.452 1.00 0.00 N ATOM 876 CA GLY A 59 -13.715 24.001 24.880 1.00 0.00 C ATOM 877 C GLY A 59 -15.219 24.164 24.793 1.00 0.00 C ATOM 878 O GLY A 59 -15.893 23.411 24.091 1.00 0.00 O ATOM 0 H GLY A 59 -13.598 25.970 24.171 1.00 0.00 H new ATOM 0 HA2 GLY A 59 -13.408 23.156 24.264 1.00 0.00 H new ATOM 0 HA3 GLY A 59 -13.437 23.764 25.907 1.00 0.00 H new ATOM 882 N ALA A 60 -15.748 25.150 25.510 1.00 0.00 N ATOM 883 CA ALA A 60 -17.182 25.410 25.511 1.00 0.00 C ATOM 884 C ALA A 60 -17.658 25.867 24.137 1.00 0.00 C ATOM 885 O ALA A 60 -18.826 25.697 23.783 1.00 0.00 O ATOM 886 CB ALA A 60 -17.530 26.451 26.566 1.00 0.00 C ATOM 0 H ALA A 60 -15.204 25.782 26.098 1.00 0.00 H new ATOM 0 HA ALA A 60 -17.694 24.479 25.753 1.00 0.00 H new ATOM 0 HB1 ALA A 60 -18.604 26.635 26.555 1.00 0.00 H new ATOM 0 HB2 ALA A 60 -17.234 26.085 27.549 1.00 0.00 H new ATOM 0 HB3 ALA A 60 -17.001 27.379 26.350 1.00 0.00 H new ATOM 892 N THR A 61 -16.747 26.450 23.364 1.00 0.00 N ATOM 893 CA THR A 61 -17.074 26.934 22.028 1.00 0.00 C ATOM 894 C THR A 61 -17.173 25.782 21.035 1.00 0.00 C ATOM 895 O THR A 61 -17.946 25.838 20.078 1.00 0.00 O ATOM 896 CB THR A 61 -16.026 27.943 21.524 1.00 0.00 C ATOM 897 OG1 THR A 61 -15.852 28.991 22.485 1.00 0.00 O ATOM 898 CG2 THR A 61 -16.446 28.538 20.189 1.00 0.00 C ATOM 0 H THR A 61 -15.776 26.599 23.640 1.00 0.00 H new ATOM 0 HA THR A 61 -18.041 27.432 22.100 1.00 0.00 H new ATOM 0 HB THR A 61 -15.082 27.415 21.388 1.00 0.00 H new ATOM 0 HG1 THR A 61 -15.183 29.627 22.157 1.00 0.00 H new ATOM 0 HG21 THR A 61 -15.690 29.248 19.853 1.00 0.00 H new ATOM 0 HG22 THR A 61 -16.549 27.742 19.452 1.00 0.00 H new ATOM 0 HG23 THR A 61 -17.401 29.052 20.304 1.00 0.00 H new ATOM 906 N LEU A 62 -16.386 24.737 21.268 1.00 0.00 N ATOM 907 CA LEU A 62 -16.386 23.570 20.393 1.00 0.00 C ATOM 908 C LEU A 62 -17.706 22.814 20.493 1.00 0.00 C ATOM 909 O LEU A 62 -18.304 22.451 19.479 1.00 0.00 O ATOM 910 CB LEU A 62 -15.224 22.641 20.750 1.00 0.00 C ATOM 911 CG LEU A 62 -15.052 21.409 19.861 1.00 0.00 C ATOM 912 CD1 LEU A 62 -14.874 21.820 18.408 1.00 0.00 C ATOM 913 CD2 LEU A 62 -13.870 20.574 20.330 1.00 0.00 C ATOM 0 H LEU A 62 -15.740 24.674 22.055 1.00 0.00 H new ATOM 0 HA LEU A 62 -16.265 23.916 19.367 1.00 0.00 H new ATOM 0 HB2 LEU A 62 -14.300 23.219 20.718 1.00 0.00 H new ATOM 0 HB3 LEU A 62 -15.356 22.306 21.779 1.00 0.00 H new ATOM 0 HG LEU A 62 -15.953 20.801 19.937 1.00 0.00 H new ATOM 0 HD11 LEU A 62 -14.753 20.930 17.790 1.00 0.00 H new ATOM 0 HD12 LEU A 62 -15.752 22.375 18.077 1.00 0.00 H new ATOM 0 HD13 LEU A 62 -13.989 22.450 18.314 1.00 0.00 H new ATOM 0 HD21 LEU A 62 -13.763 19.701 19.686 1.00 0.00 H new ATOM 0 HD22 LEU A 62 -12.960 21.173 20.284 1.00 0.00 H new ATOM 0 HD23 LEU A 62 -14.039 20.249 21.357 1.00 0.00 H new ATOM 925 N CYS A 63 -18.157 22.581 21.721 1.00 0.00 N ATOM 926 CA CYS A 63 -19.409 21.869 21.954 1.00 0.00 C ATOM 927 C CYS A 63 -20.606 22.744 21.598 1.00 0.00 C ATOM 928 O CYS A 63 -21.678 22.240 21.265 1.00 0.00 O ATOM 929 CB CYS A 63 -19.503 21.424 23.414 1.00 0.00 C ATOM 930 SG CYS A 63 -19.644 22.788 24.593 1.00 0.00 S ATOM 0 H CYS A 63 -17.675 22.875 22.570 1.00 0.00 H new ATOM 0 HA CYS A 63 -19.422 20.988 21.312 1.00 0.00 H new ATOM 0 HB2 CYS A 63 -20.366 20.768 23.528 1.00 0.00 H new ATOM 0 HB3 CYS A 63 -18.620 20.834 23.661 1.00 0.00 H new ATOM 0 HG CYS A 63 -19.327 23.904 24.006 1.00 0.00 H new ATOM 936 N ASN A 64 -20.416 24.057 21.672 1.00 0.00 N ATOM 937 CA ASN A 64 -21.481 25.003 21.359 1.00 0.00 C ATOM 938 C ASN A 64 -21.580 25.234 19.855 1.00 0.00 C ATOM 939 O ASN A 64 -22.661 25.497 19.326 1.00 0.00 O ATOM 940 CB ASN A 64 -21.238 26.332 22.076 1.00 0.00 C ATOM 941 CG ASN A 64 -21.677 26.295 23.527 1.00 0.00 C ATOM 942 OD1 ASN A 64 -22.057 25.246 24.046 1.00 0.00 O ATOM 943 ND2 ASN A 64 -21.626 27.445 24.190 1.00 0.00 N ATOM 0 H ASN A 64 -19.534 24.490 21.946 1.00 0.00 H new ATOM 0 HA ASN A 64 -22.423 24.578 21.705 1.00 0.00 H new ATOM 0 HB2 ASN A 64 -20.178 26.580 22.026 1.00 0.00 H new ATOM 0 HB3 ASN A 64 -21.776 27.125 21.557 1.00 0.00 H new ATOM 0 HD21 ASN A 64 -21.909 27.482 25.169 1.00 0.00 H new ATOM 0 HD22 ASN A 64 -21.304 28.291 23.720 1.00 0.00 H new ATOM 950 N CYS A 65 -20.445 25.134 19.171 1.00 0.00 N ATOM 951 CA CYS A 65 -20.403 25.333 17.727 1.00 0.00 C ATOM 952 C CYS A 65 -21.442 24.462 17.027 1.00 0.00 C ATOM 953 O CYS A 65 -21.911 23.470 17.584 1.00 0.00 O ATOM 954 CB CYS A 65 -19.007 25.014 17.188 1.00 0.00 C ATOM 955 SG CYS A 65 -17.931 26.458 17.026 1.00 0.00 S ATOM 0 H CYS A 65 -19.542 24.916 19.593 1.00 0.00 H new ATOM 0 HA CYS A 65 -20.634 26.378 17.522 1.00 0.00 H new ATOM 0 HB2 CYS A 65 -18.530 24.291 17.850 1.00 0.00 H new ATOM 0 HB3 CYS A 65 -19.106 24.537 16.213 1.00 0.00 H new ATOM 0 HG CYS A 65 -18.493 27.333 16.246 1.00 0.00 H new ATOM 961 N ALA A 66 -21.799 24.842 15.805 1.00 0.00 N ATOM 962 CA ALA A 66 -22.782 24.096 15.029 1.00 0.00 C ATOM 963 C ALA A 66 -22.105 23.085 14.111 1.00 0.00 C ATOM 964 O ALA A 66 -20.937 23.243 13.750 1.00 0.00 O ATOM 965 CB ALA A 66 -23.649 25.049 14.220 1.00 0.00 C ATOM 0 H ALA A 66 -21.422 25.663 15.331 1.00 0.00 H new ATOM 0 HA ALA A 66 -23.416 23.547 15.725 1.00 0.00 H new ATOM 0 HB1 ALA A 66 -24.379 24.478 13.645 1.00 0.00 H new ATOM 0 HB2 ALA A 66 -24.170 25.729 14.895 1.00 0.00 H new ATOM 0 HB3 ALA A 66 -23.021 25.624 13.540 1.00 0.00 H new ATOM 971 N LEU A 67 -22.843 22.046 13.736 1.00 0.00 N ATOM 972 CA LEU A 67 -22.313 21.007 12.860 1.00 0.00 C ATOM 973 C LEU A 67 -21.713 21.615 11.596 1.00 0.00 C ATOM 974 O LEU A 67 -20.519 21.473 11.333 1.00 0.00 O ATOM 975 CB LEU A 67 -23.415 20.014 12.489 1.00 0.00 C ATOM 976 CG LEU A 67 -23.127 19.107 11.291 1.00 0.00 C ATOM 977 CD1 LEU A 67 -21.798 18.389 11.474 1.00 0.00 C ATOM 978 CD2 LEU A 67 -24.255 18.105 11.098 1.00 0.00 C ATOM 0 H LEU A 67 -23.810 21.901 14.025 1.00 0.00 H new ATOM 0 HA LEU A 67 -21.524 20.480 13.397 1.00 0.00 H new ATOM 0 HB2 LEU A 67 -23.616 19.384 13.356 1.00 0.00 H new ATOM 0 HB3 LEU A 67 -24.327 20.574 12.284 1.00 0.00 H new ATOM 0 HG LEU A 67 -23.062 19.727 10.397 1.00 0.00 H new ATOM 0 HD11 LEU A 67 -21.609 17.748 10.613 1.00 0.00 H new ATOM 0 HD12 LEU A 67 -20.997 19.123 11.563 1.00 0.00 H new ATOM 0 HD13 LEU A 67 -21.835 17.781 12.378 1.00 0.00 H new ATOM 0 HD21 LEU A 67 -24.033 17.468 10.242 1.00 0.00 H new ATOM 0 HD22 LEU A 67 -24.352 17.490 11.992 1.00 0.00 H new ATOM 0 HD23 LEU A 67 -25.189 18.638 10.921 1.00 0.00 H new ATOM 990 N GLU A 68 -22.550 22.294 10.817 1.00 0.00 N ATOM 991 CA GLU A 68 -22.102 22.924 9.581 1.00 0.00 C ATOM 992 C GLU A 68 -20.881 23.805 9.831 1.00 0.00 C ATOM 993 O GLU A 68 -19.991 23.902 8.988 1.00 0.00 O ATOM 994 CB GLU A 68 -23.229 23.759 8.970 1.00 0.00 C ATOM 995 CG GLU A 68 -24.358 22.924 8.388 1.00 0.00 C ATOM 996 CD GLU A 68 -25.384 23.762 7.652 1.00 0.00 C ATOM 997 OE1 GLU A 68 -25.627 24.911 8.076 1.00 0.00 O ATOM 998 OE2 GLU A 68 -25.944 23.269 6.650 1.00 0.00 O ATOM 0 H GLU A 68 -23.541 22.422 11.020 1.00 0.00 H new ATOM 0 HA GLU A 68 -21.824 22.135 8.882 1.00 0.00 H new ATOM 0 HB2 GLU A 68 -23.635 24.421 9.735 1.00 0.00 H new ATOM 0 HB3 GLU A 68 -22.816 24.393 8.186 1.00 0.00 H new ATOM 0 HG2 GLU A 68 -23.942 22.183 7.705 1.00 0.00 H new ATOM 0 HG3 GLU A 68 -24.851 22.376 9.191 1.00 0.00 H new ATOM 1005 N GLU A 69 -20.848 24.444 10.997 1.00 0.00 N ATOM 1006 CA GLU A 69 -19.738 25.317 11.357 1.00 0.00 C ATOM 1007 C GLU A 69 -18.419 24.550 11.355 1.00 0.00 C ATOM 1008 O GLU A 69 -17.456 24.950 10.700 1.00 0.00 O ATOM 1009 CB GLU A 69 -19.976 25.940 12.735 1.00 0.00 C ATOM 1010 CG GLU A 69 -20.217 27.439 12.692 1.00 0.00 C ATOM 1011 CD GLU A 69 -20.948 27.948 13.919 1.00 0.00 C ATOM 1012 OE1 GLU A 69 -20.538 27.592 15.043 1.00 0.00 O ATOM 1013 OE2 GLU A 69 -21.930 28.702 13.755 1.00 0.00 O ATOM 0 H GLU A 69 -21.577 24.373 11.707 1.00 0.00 H new ATOM 0 HA GLU A 69 -19.678 26.111 10.612 1.00 0.00 H new ATOM 0 HB2 GLU A 69 -20.835 25.456 13.200 1.00 0.00 H new ATOM 0 HB3 GLU A 69 -19.113 25.737 13.370 1.00 0.00 H new ATOM 0 HG2 GLU A 69 -19.261 27.955 12.604 1.00 0.00 H new ATOM 0 HG3 GLU A 69 -20.795 27.685 11.801 1.00 0.00 H new ATOM 1020 N LEU A 70 -18.383 23.446 12.092 1.00 0.00 N ATOM 1021 CA LEU A 70 -17.182 22.621 12.177 1.00 0.00 C ATOM 1022 C LEU A 70 -16.763 22.127 10.796 1.00 0.00 C ATOM 1023 O LEU A 70 -15.591 21.831 10.561 1.00 0.00 O ATOM 1024 CB LEU A 70 -17.422 21.430 13.106 1.00 0.00 C ATOM 1025 CG LEU A 70 -18.000 21.759 14.483 1.00 0.00 C ATOM 1026 CD1 LEU A 70 -18.292 20.483 15.258 1.00 0.00 C ATOM 1027 CD2 LEU A 70 -17.046 22.652 15.262 1.00 0.00 C ATOM 0 H LEU A 70 -19.171 23.101 12.640 1.00 0.00 H new ATOM 0 HA LEU A 70 -16.378 23.234 12.583 1.00 0.00 H new ATOM 0 HB2 LEU A 70 -18.098 20.736 12.607 1.00 0.00 H new ATOM 0 HB3 LEU A 70 -16.476 20.908 13.247 1.00 0.00 H new ATOM 0 HG LEU A 70 -18.937 22.297 14.343 1.00 0.00 H new ATOM 0 HD11 LEU A 70 -18.703 20.737 16.235 1.00 0.00 H new ATOM 0 HD12 LEU A 70 -19.013 19.880 14.707 1.00 0.00 H new ATOM 0 HD13 LEU A 70 -17.370 19.917 15.388 1.00 0.00 H new ATOM 0 HD21 LEU A 70 -17.474 22.876 16.239 1.00 0.00 H new ATOM 0 HD22 LEU A 70 -16.092 22.140 15.392 1.00 0.00 H new ATOM 0 HD23 LEU A 70 -16.888 23.581 14.714 1.00 0.00 H new ATOM 1039 N ARG A 71 -17.728 22.041 9.886 1.00 0.00 N ATOM 1040 CA ARG A 71 -17.458 21.584 8.528 1.00 0.00 C ATOM 1041 C ARG A 71 -16.857 22.705 7.686 1.00 0.00 C ATOM 1042 O ARG A 71 -16.217 22.454 6.663 1.00 0.00 O ATOM 1043 CB ARG A 71 -18.744 21.074 7.874 1.00 0.00 C ATOM 1044 CG ARG A 71 -19.377 19.903 8.608 1.00 0.00 C ATOM 1045 CD ARG A 71 -20.859 19.781 8.287 1.00 0.00 C ATOM 1046 NE ARG A 71 -21.173 18.516 7.628 1.00 0.00 N ATOM 1047 CZ ARG A 71 -22.410 18.123 7.345 1.00 0.00 C ATOM 1048 NH1 ARG A 71 -23.443 18.892 7.661 1.00 0.00 N ATOM 1049 NH2 ARG A 71 -22.616 16.958 6.744 1.00 0.00 N ATOM 0 H ARG A 71 -18.703 22.282 10.064 1.00 0.00 H new ATOM 0 HA ARG A 71 -16.737 20.768 8.583 1.00 0.00 H new ATOM 0 HB2 ARG A 71 -19.464 21.891 7.821 1.00 0.00 H new ATOM 0 HB3 ARG A 71 -18.526 20.775 6.849 1.00 0.00 H new ATOM 0 HG2 ARG A 71 -18.867 18.980 8.332 1.00 0.00 H new ATOM 0 HG3 ARG A 71 -19.245 20.031 9.682 1.00 0.00 H new ATOM 0 HD2 ARG A 71 -21.437 19.864 9.207 1.00 0.00 H new ATOM 0 HD3 ARG A 71 -21.160 20.609 7.645 1.00 0.00 H new ATOM 0 HE ARG A 71 -20.401 17.901 7.371 1.00 0.00 H new ATOM 0 HH11 ARG A 71 -23.289 19.788 8.123 1.00 0.00 H new ATOM 0 HH12 ARG A 71 -24.391 18.587 7.442 1.00 0.00 H new ATOM 0 HH21 ARG A 71 -21.824 16.363 6.499 1.00 0.00 H new ATOM 0 HH22 ARG A 71 -23.566 16.657 6.527 1.00 0.00 H new ATOM 1063 N LEU A 72 -17.067 23.943 8.121 1.00 0.00 N ATOM 1064 CA LEU A 72 -16.546 25.104 7.407 1.00 0.00 C ATOM 1065 C LEU A 72 -15.181 25.511 7.952 1.00 0.00 C ATOM 1066 O LEU A 72 -14.437 26.248 7.305 1.00 0.00 O ATOM 1067 CB LEU A 72 -17.522 26.276 7.519 1.00 0.00 C ATOM 1068 CG LEU A 72 -18.406 26.532 6.297 1.00 0.00 C ATOM 1069 CD1 LEU A 72 -19.867 26.631 6.707 1.00 0.00 C ATOM 1070 CD2 LEU A 72 -17.965 27.797 5.576 1.00 0.00 C ATOM 0 H LEU A 72 -17.594 24.169 8.964 1.00 0.00 H new ATOM 0 HA LEU A 72 -16.432 24.833 6.357 1.00 0.00 H new ATOM 0 HB2 LEU A 72 -18.168 26.104 8.380 1.00 0.00 H new ATOM 0 HB3 LEU A 72 -16.950 27.181 7.725 1.00 0.00 H new ATOM 0 HG LEU A 72 -18.299 25.691 5.612 1.00 0.00 H new ATOM 0 HD11 LEU A 72 -20.481 26.813 5.825 1.00 0.00 H new ATOM 0 HD12 LEU A 72 -20.177 25.698 7.178 1.00 0.00 H new ATOM 0 HD13 LEU A 72 -19.992 27.453 7.412 1.00 0.00 H new ATOM 0 HD21 LEU A 72 -18.605 27.964 4.709 1.00 0.00 H new ATOM 0 HD22 LEU A 72 -18.043 28.648 6.253 1.00 0.00 H new ATOM 0 HD23 LEU A 72 -16.931 27.687 5.248 1.00 0.00 H new ATOM 1082 N VAL A 73 -14.857 25.024 9.146 1.00 0.00 N ATOM 1083 CA VAL A 73 -13.579 25.334 9.777 1.00 0.00 C ATOM 1084 C VAL A 73 -12.596 24.179 9.624 1.00 0.00 C ATOM 1085 O VAL A 73 -11.383 24.386 9.567 1.00 0.00 O ATOM 1086 CB VAL A 73 -13.755 25.649 11.275 1.00 0.00 C ATOM 1087 CG1 VAL A 73 -12.409 25.935 11.922 1.00 0.00 C ATOM 1088 CG2 VAL A 73 -14.707 26.820 11.465 1.00 0.00 C ATOM 0 H VAL A 73 -15.462 24.413 9.696 1.00 0.00 H new ATOM 0 HA VAL A 73 -13.182 26.214 9.272 1.00 0.00 H new ATOM 0 HB VAL A 73 -14.188 24.776 11.764 1.00 0.00 H new ATOM 0 HG11 VAL A 73 -12.553 26.155 12.980 1.00 0.00 H new ATOM 0 HG12 VAL A 73 -11.763 25.064 11.818 1.00 0.00 H new ATOM 0 HG13 VAL A 73 -11.945 26.791 11.433 1.00 0.00 H new ATOM 0 HG21 VAL A 73 -14.820 27.029 12.529 1.00 0.00 H new ATOM 0 HG22 VAL A 73 -14.306 27.700 10.963 1.00 0.00 H new ATOM 0 HG23 VAL A 73 -15.679 26.571 11.039 1.00 0.00 H new ATOM 1098 N PHE A 74 -13.126 22.962 9.557 1.00 0.00 N ATOM 1099 CA PHE A 74 -12.295 21.773 9.410 1.00 0.00 C ATOM 1100 C PHE A 74 -12.622 21.037 8.114 1.00 0.00 C ATOM 1101 O PHE A 74 -12.383 19.837 7.992 1.00 0.00 O ATOM 1102 CB PHE A 74 -12.491 20.837 10.605 1.00 0.00 C ATOM 1103 CG PHE A 74 -12.550 21.553 11.924 1.00 0.00 C ATOM 1104 CD1 PHE A 74 -11.477 22.313 12.363 1.00 0.00 C ATOM 1105 CD2 PHE A 74 -13.677 21.467 12.725 1.00 0.00 C ATOM 1106 CE1 PHE A 74 -11.529 22.972 13.576 1.00 0.00 C ATOM 1107 CE2 PHE A 74 -13.734 22.124 13.939 1.00 0.00 C ATOM 1108 CZ PHE A 74 -12.659 22.879 14.365 1.00 0.00 C ATOM 0 H PHE A 74 -14.127 22.773 9.602 1.00 0.00 H new ATOM 0 HA PHE A 74 -11.253 22.091 9.373 1.00 0.00 H new ATOM 0 HB2 PHE A 74 -13.412 20.272 10.466 1.00 0.00 H new ATOM 0 HB3 PHE A 74 -11.675 20.115 10.629 1.00 0.00 H new ATOM 0 HD1 PHE A 74 -10.591 22.391 11.750 1.00 0.00 H new ATOM 0 HD2 PHE A 74 -14.521 20.879 12.396 1.00 0.00 H new ATOM 0 HE1 PHE A 74 -10.686 23.560 13.908 1.00 0.00 H new ATOM 0 HE2 PHE A 74 -14.618 22.047 14.554 1.00 0.00 H new ATOM 0 HZ PHE A 74 -12.702 23.395 15.313 1.00 0.00 H new ATOM 1118 N GLY A 75 -13.172 21.768 7.148 1.00 0.00 N ATOM 1119 CA GLY A 75 -13.524 21.169 5.874 1.00 0.00 C ATOM 1120 C GLY A 75 -14.521 20.037 6.022 1.00 0.00 C ATOM 1121 O GLY A 75 -15.353 20.028 6.930 1.00 0.00 O ATOM 0 H GLY A 75 -13.380 22.764 7.226 1.00 0.00 H new ATOM 0 HA2 GLY A 75 -13.942 21.934 5.219 1.00 0.00 H new ATOM 0 HA3 GLY A 75 -12.622 20.794 5.391 1.00 0.00 H new ATOM 1125 N PRO A 76 -14.446 19.054 5.112 1.00 0.00 N ATOM 1126 CA PRO A 76 -15.343 17.894 5.123 1.00 0.00 C ATOM 1127 C PRO A 76 -15.068 16.961 6.297 1.00 0.00 C ATOM 1128 O PRO A 76 -15.811 16.007 6.532 1.00 0.00 O ATOM 1129 CB PRO A 76 -15.032 17.193 3.799 1.00 0.00 C ATOM 1130 CG PRO A 76 -13.637 17.601 3.472 1.00 0.00 C ATOM 1131 CD PRO A 76 -13.480 18.999 4.002 1.00 0.00 C ATOM 0 HA PRO A 76 -16.387 18.187 5.231 1.00 0.00 H new ATOM 0 HB2 PRO A 76 -15.115 16.110 3.895 1.00 0.00 H new ATOM 0 HB3 PRO A 76 -15.727 17.498 3.017 1.00 0.00 H new ATOM 0 HG2 PRO A 76 -12.915 16.926 3.932 1.00 0.00 H new ATOM 0 HG3 PRO A 76 -13.463 17.569 2.396 1.00 0.00 H new ATOM 0 HD2 PRO A 76 -12.463 19.187 4.345 1.00 0.00 H new ATOM 0 HD3 PRO A 76 -13.702 19.745 3.239 1.00 0.00 H new ATOM 1139 N LEU A 77 -13.998 17.242 7.033 1.00 0.00 N ATOM 1140 CA LEU A 77 -13.626 16.427 8.184 1.00 0.00 C ATOM 1141 C LEU A 77 -14.534 16.719 9.374 1.00 0.00 C ATOM 1142 O LEU A 77 -14.690 15.888 10.268 1.00 0.00 O ATOM 1143 CB LEU A 77 -12.167 16.685 8.566 1.00 0.00 C ATOM 1144 CG LEU A 77 -11.610 15.829 9.703 1.00 0.00 C ATOM 1145 CD1 LEU A 77 -11.837 14.352 9.421 1.00 0.00 C ATOM 1146 CD2 LEU A 77 -10.129 16.112 9.908 1.00 0.00 C ATOM 0 H LEU A 77 -13.373 18.028 6.853 1.00 0.00 H new ATOM 0 HA LEU A 77 -13.744 15.379 7.909 1.00 0.00 H new ATOM 0 HB2 LEU A 77 -11.548 16.528 7.683 1.00 0.00 H new ATOM 0 HB3 LEU A 77 -12.065 17.734 8.844 1.00 0.00 H new ATOM 0 HG LEU A 77 -12.140 16.089 10.619 1.00 0.00 H new ATOM 0 HD11 LEU A 77 -11.434 13.759 10.242 1.00 0.00 H new ATOM 0 HD12 LEU A 77 -12.906 14.160 9.325 1.00 0.00 H new ATOM 0 HD13 LEU A 77 -11.335 14.077 8.494 1.00 0.00 H new ATOM 0 HD21 LEU A 77 -9.750 15.494 10.721 1.00 0.00 H new ATOM 0 HD22 LEU A 77 -9.584 15.881 8.992 1.00 0.00 H new ATOM 0 HD23 LEU A 77 -9.991 17.164 10.157 1.00 0.00 H new ATOM 1158 N GLY A 78 -15.134 17.906 9.378 1.00 0.00 N ATOM 1159 CA GLY A 78 -16.021 18.285 10.461 1.00 0.00 C ATOM 1160 C GLY A 78 -17.089 17.243 10.729 1.00 0.00 C ATOM 1161 O GLY A 78 -17.333 16.876 11.878 1.00 0.00 O ATOM 0 H GLY A 78 -15.021 18.611 8.650 1.00 0.00 H new ATOM 0 HA2 GLY A 78 -15.436 18.442 11.367 1.00 0.00 H new ATOM 0 HA3 GLY A 78 -16.498 19.235 10.220 1.00 0.00 H new ATOM 1165 N ASP A 79 -17.728 16.768 9.666 1.00 0.00 N ATOM 1166 CA ASP A 79 -18.776 15.762 9.791 1.00 0.00 C ATOM 1167 C ASP A 79 -18.253 14.516 10.498 1.00 0.00 C ATOM 1168 O ASP A 79 -19.017 13.772 11.112 1.00 0.00 O ATOM 1169 CB ASP A 79 -19.322 15.389 8.411 1.00 0.00 C ATOM 1170 CG ASP A 79 -20.687 14.735 8.486 1.00 0.00 C ATOM 1171 OD1 ASP A 79 -21.381 14.923 9.508 1.00 0.00 O ATOM 1172 OD2 ASP A 79 -21.063 14.035 7.523 1.00 0.00 O ATOM 0 H ASP A 79 -17.539 17.063 8.708 1.00 0.00 H new ATOM 0 HA ASP A 79 -19.582 16.186 10.390 1.00 0.00 H new ATOM 0 HB2 ASP A 79 -19.385 16.285 7.794 1.00 0.00 H new ATOM 0 HB3 ASP A 79 -18.624 14.712 7.918 1.00 0.00 H new ATOM 1177 N GLN A 80 -16.945 14.295 10.406 1.00 0.00 N ATOM 1178 CA GLN A 80 -16.321 13.138 11.036 1.00 0.00 C ATOM 1179 C GLN A 80 -15.965 13.434 12.489 1.00 0.00 C ATOM 1180 O GLN A 80 -15.942 12.535 13.330 1.00 0.00 O ATOM 1181 CB GLN A 80 -15.065 12.727 10.265 1.00 0.00 C ATOM 1182 CG GLN A 80 -15.357 11.894 9.027 1.00 0.00 C ATOM 1183 CD GLN A 80 -16.357 12.557 8.100 1.00 0.00 C ATOM 1184 OE1 GLN A 80 -17.567 12.380 8.246 1.00 0.00 O ATOM 1185 NE2 GLN A 80 -15.856 13.326 7.140 1.00 0.00 N ATOM 0 H GLN A 80 -16.298 14.901 9.902 1.00 0.00 H new ATOM 0 HA GLN A 80 -17.037 12.316 11.017 1.00 0.00 H new ATOM 0 HB2 GLN A 80 -14.520 13.624 9.969 1.00 0.00 H new ATOM 0 HB3 GLN A 80 -14.411 12.161 10.928 1.00 0.00 H new ATOM 0 HG2 GLN A 80 -14.428 11.717 8.486 1.00 0.00 H new ATOM 0 HG3 GLN A 80 -15.740 10.920 9.331 1.00 0.00 H new ATOM 0 HE21 GLN A 80 -14.846 13.444 7.056 1.00 0.00 H new ATOM 0 HE22 GLN A 80 -16.481 13.798 6.487 1.00 0.00 H new ATOM 1194 N LEU A 81 -15.688 14.701 12.778 1.00 0.00 N ATOM 1195 CA LEU A 81 -15.333 15.117 14.130 1.00 0.00 C ATOM 1196 C LEU A 81 -16.571 15.206 15.016 1.00 0.00 C ATOM 1197 O LEU A 81 -16.576 14.716 16.145 1.00 0.00 O ATOM 1198 CB LEU A 81 -14.617 16.469 14.098 1.00 0.00 C ATOM 1199 CG LEU A 81 -13.340 16.532 13.258 1.00 0.00 C ATOM 1200 CD1 LEU A 81 -12.806 17.955 13.206 1.00 0.00 C ATOM 1201 CD2 LEU A 81 -12.288 15.585 13.816 1.00 0.00 C ATOM 0 H LEU A 81 -15.702 15.458 12.094 1.00 0.00 H new ATOM 0 HA LEU A 81 -14.662 14.367 14.549 1.00 0.00 H new ATOM 0 HB2 LEU A 81 -15.314 17.218 13.721 1.00 0.00 H new ATOM 0 HB3 LEU A 81 -14.369 16.751 15.121 1.00 0.00 H new ATOM 0 HG LEU A 81 -13.580 16.218 12.242 1.00 0.00 H new ATOM 0 HD11 LEU A 81 -11.897 17.981 12.604 1.00 0.00 H new ATOM 0 HD12 LEU A 81 -13.555 18.609 12.760 1.00 0.00 H new ATOM 0 HD13 LEU A 81 -12.582 18.297 14.217 1.00 0.00 H new ATOM 0 HD21 LEU A 81 -11.386 15.643 13.206 1.00 0.00 H new ATOM 0 HD22 LEU A 81 -12.051 15.868 14.842 1.00 0.00 H new ATOM 0 HD23 LEU A 81 -12.672 14.565 13.800 1.00 0.00 H new ATOM 1213 N HIS A 82 -17.621 15.833 14.494 1.00 0.00 N ATOM 1214 CA HIS A 82 -18.868 15.984 15.237 1.00 0.00 C ATOM 1215 C HIS A 82 -19.350 14.637 15.768 1.00 0.00 C ATOM 1216 O HIS A 82 -19.792 14.532 16.912 1.00 0.00 O ATOM 1217 CB HIS A 82 -19.943 16.609 14.348 1.00 0.00 C ATOM 1218 CG HIS A 82 -21.180 17.008 15.093 1.00 0.00 C ATOM 1219 ND1 HIS A 82 -22.285 16.192 15.207 1.00 0.00 N ATOM 1220 CD2 HIS A 82 -21.481 18.143 15.766 1.00 0.00 C ATOM 1221 CE1 HIS A 82 -23.214 16.808 15.916 1.00 0.00 C ATOM 1222 NE2 HIS A 82 -22.750 17.994 16.268 1.00 0.00 N ATOM 0 H HIS A 82 -17.633 16.244 13.561 1.00 0.00 H new ATOM 0 HA HIS A 82 -18.680 16.643 16.085 1.00 0.00 H new ATOM 0 HB2 HIS A 82 -19.528 17.487 13.853 1.00 0.00 H new ATOM 0 HB3 HIS A 82 -20.213 15.900 13.566 1.00 0.00 H new ATOM 0 HD2 HIS A 82 -20.842 19.005 15.886 1.00 0.00 H new ATOM 0 HE1 HIS A 82 -24.187 16.410 16.165 1.00 0.00 H new ATOM 0 HE2 HIS A 82 -23.253 18.687 16.823 1.00 0.00 H new ATOM 1230 N ALA A 83 -19.263 13.610 14.929 1.00 0.00 N ATOM 1231 CA ALA A 83 -19.689 12.271 15.314 1.00 0.00 C ATOM 1232 C ALA A 83 -19.041 11.845 16.628 1.00 0.00 C ATOM 1233 O ALA A 83 -19.686 11.230 17.476 1.00 0.00 O ATOM 1234 CB ALA A 83 -19.358 11.274 14.213 1.00 0.00 C ATOM 0 H ALA A 83 -18.901 13.680 13.978 1.00 0.00 H new ATOM 0 HA ALA A 83 -20.769 12.289 15.460 1.00 0.00 H new ATOM 0 HB1 ALA A 83 -19.682 10.278 14.515 1.00 0.00 H new ATOM 0 HB2 ALA A 83 -19.872 11.561 13.296 1.00 0.00 H new ATOM 0 HB3 ALA A 83 -18.282 11.268 14.039 1.00 0.00 H new ATOM 1240 N GLN A 84 -17.764 12.177 16.787 1.00 0.00 N ATOM 1241 CA GLN A 84 -17.030 11.827 17.997 1.00 0.00 C ATOM 1242 C GLN A 84 -17.479 12.686 19.174 1.00 0.00 C ATOM 1243 O GLN A 84 -17.700 12.182 20.276 1.00 0.00 O ATOM 1244 CB GLN A 84 -15.526 11.995 17.773 1.00 0.00 C ATOM 1245 CG GLN A 84 -14.865 10.779 17.143 1.00 0.00 C ATOM 1246 CD GLN A 84 -14.038 9.985 18.134 1.00 0.00 C ATOM 1247 OE1 GLN A 84 -12.828 10.179 18.247 1.00 0.00 O ATOM 1248 NE2 GLN A 84 -14.689 9.084 18.861 1.00 0.00 N ATOM 0 H GLN A 84 -17.217 12.687 16.094 1.00 0.00 H new ATOM 0 HA GLN A 84 -17.242 10.784 18.231 1.00 0.00 H new ATOM 0 HB2 GLN A 84 -15.357 12.862 17.134 1.00 0.00 H new ATOM 0 HB3 GLN A 84 -15.046 12.205 18.729 1.00 0.00 H new ATOM 0 HG2 GLN A 84 -15.633 10.133 16.717 1.00 0.00 H new ATOM 0 HG3 GLN A 84 -14.227 11.102 16.320 1.00 0.00 H new ATOM 0 HE21 GLN A 84 -15.693 8.956 18.735 1.00 0.00 H new ATOM 0 HE22 GLN A 84 -14.185 8.520 19.545 1.00 0.00 H new ATOM 1257 N LEU A 85 -17.613 13.986 18.934 1.00 0.00 N ATOM 1258 CA LEU A 85 -18.036 14.917 19.975 1.00 0.00 C ATOM 1259 C LEU A 85 -19.418 14.549 20.505 1.00 0.00 C ATOM 1260 O LEU A 85 -19.684 14.658 21.702 1.00 0.00 O ATOM 1261 CB LEU A 85 -18.049 16.347 19.433 1.00 0.00 C ATOM 1262 CG LEU A 85 -16.705 17.076 19.432 1.00 0.00 C ATOM 1263 CD1 LEU A 85 -16.771 18.317 18.555 1.00 0.00 C ATOM 1264 CD2 LEU A 85 -16.297 17.446 20.851 1.00 0.00 C ATOM 0 H LEU A 85 -17.435 14.419 18.028 1.00 0.00 H new ATOM 0 HA LEU A 85 -17.323 14.853 20.797 1.00 0.00 H new ATOM 0 HB2 LEU A 85 -18.428 16.324 18.411 1.00 0.00 H new ATOM 0 HB3 LEU A 85 -18.756 16.931 20.022 1.00 0.00 H new ATOM 0 HG LEU A 85 -15.951 16.405 19.021 1.00 0.00 H new ATOM 0 HD11 LEU A 85 -15.805 18.823 18.567 1.00 0.00 H new ATOM 0 HD12 LEU A 85 -17.017 18.028 17.533 1.00 0.00 H new ATOM 0 HD13 LEU A 85 -17.538 18.991 18.936 1.00 0.00 H new ATOM 0 HD21 LEU A 85 -15.338 17.964 20.831 1.00 0.00 H new ATOM 0 HD22 LEU A 85 -17.053 18.098 21.288 1.00 0.00 H new ATOM 0 HD23 LEU A 85 -16.208 16.541 21.452 1.00 0.00 H new ATOM 1276 N ARG A 86 -20.294 14.112 19.606 1.00 0.00 N ATOM 1277 CA ARG A 86 -21.648 13.727 19.983 1.00 0.00 C ATOM 1278 C ARG A 86 -21.627 12.633 21.046 1.00 0.00 C ATOM 1279 O ARG A 86 -22.549 12.519 21.853 1.00 0.00 O ATOM 1280 CB ARG A 86 -22.425 13.245 18.756 1.00 0.00 C ATOM 1281 CG ARG A 86 -23.158 14.357 18.024 1.00 0.00 C ATOM 1282 CD ARG A 86 -24.613 13.993 17.772 1.00 0.00 C ATOM 1283 NE ARG A 86 -25.477 14.398 18.878 1.00 0.00 N ATOM 1284 CZ ARG A 86 -26.718 13.953 19.042 1.00 0.00 C ATOM 1285 NH1 ARG A 86 -27.237 13.094 18.176 1.00 0.00 N ATOM 1286 NH2 ARG A 86 -27.442 14.367 20.074 1.00 0.00 N ATOM 0 H ARG A 86 -20.090 14.016 18.611 1.00 0.00 H new ATOM 0 HA ARG A 86 -22.145 14.604 20.398 1.00 0.00 H new ATOM 0 HB2 ARG A 86 -21.734 12.761 18.066 1.00 0.00 H new ATOM 0 HB3 ARG A 86 -23.146 12.489 19.067 1.00 0.00 H new ATOM 0 HG2 ARG A 86 -23.108 15.275 18.610 1.00 0.00 H new ATOM 0 HG3 ARG A 86 -22.662 14.558 17.074 1.00 0.00 H new ATOM 0 HD2 ARG A 86 -24.952 14.471 16.853 1.00 0.00 H new ATOM 0 HD3 ARG A 86 -24.697 12.917 17.622 1.00 0.00 H new ATOM 0 HE ARG A 86 -25.107 15.059 19.562 1.00 0.00 H new ATOM 0 HH11 ARG A 86 -26.683 12.773 17.382 1.00 0.00 H new ATOM 0 HH12 ARG A 86 -28.190 12.754 18.304 1.00 0.00 H new ATOM 0 HH21 ARG A 86 -27.046 15.028 20.743 1.00 0.00 H new ATOM 0 HH22 ARG A 86 -28.395 14.025 20.199 1.00 0.00 H new ATOM 1300 N ASP A 87 -20.568 11.830 21.040 1.00 0.00 N ATOM 1301 CA ASP A 87 -20.426 10.745 22.004 1.00 0.00 C ATOM 1302 C ASP A 87 -19.777 11.244 23.292 1.00 0.00 C ATOM 1303 O ASP A 87 -19.986 10.678 24.365 1.00 0.00 O ATOM 1304 CB ASP A 87 -19.594 9.609 21.406 1.00 0.00 C ATOM 1305 CG ASP A 87 -20.422 8.369 21.132 1.00 0.00 C ATOM 1306 OD1 ASP A 87 -20.989 8.267 20.025 1.00 0.00 O ATOM 1307 OD2 ASP A 87 -20.503 7.500 22.026 1.00 0.00 O ATOM 0 H ASP A 87 -19.796 11.910 20.378 1.00 0.00 H new ATOM 0 HA ASP A 87 -21.422 10.370 22.242 1.00 0.00 H new ATOM 0 HB2 ASP A 87 -19.135 9.948 20.478 1.00 0.00 H new ATOM 0 HB3 ASP A 87 -18.783 9.357 22.089 1.00 0.00 H new ATOM 1312 N LEU A 88 -18.987 12.306 23.177 1.00 0.00 N ATOM 1313 CA LEU A 88 -18.306 12.881 24.332 1.00 0.00 C ATOM 1314 C LEU A 88 -19.279 13.674 25.199 1.00 0.00 C ATOM 1315 O LEU A 88 -19.338 13.489 26.415 1.00 0.00 O ATOM 1316 CB LEU A 88 -17.159 13.785 23.875 1.00 0.00 C ATOM 1317 CG LEU A 88 -15.955 13.078 23.252 1.00 0.00 C ATOM 1318 CD1 LEU A 88 -15.206 14.019 22.321 1.00 0.00 C ATOM 1319 CD2 LEU A 88 -15.028 12.548 24.337 1.00 0.00 C ATOM 0 H LEU A 88 -18.802 12.786 22.296 1.00 0.00 H new ATOM 0 HA LEU A 88 -17.901 12.063 24.928 1.00 0.00 H new ATOM 0 HB2 LEU A 88 -17.552 14.498 23.150 1.00 0.00 H new ATOM 0 HB3 LEU A 88 -16.813 14.361 24.733 1.00 0.00 H new ATOM 0 HG LEU A 88 -16.317 12.233 22.666 1.00 0.00 H new ATOM 0 HD11 LEU A 88 -14.352 13.498 21.887 1.00 0.00 H new ATOM 0 HD12 LEU A 88 -15.873 14.350 21.525 1.00 0.00 H new ATOM 0 HD13 LEU A 88 -14.855 14.884 22.883 1.00 0.00 H new ATOM 0 HD21 LEU A 88 -14.177 12.048 23.876 1.00 0.00 H new ATOM 0 HD22 LEU A 88 -14.674 13.377 24.950 1.00 0.00 H new ATOM 0 HD23 LEU A 88 -15.569 11.839 24.964 1.00 0.00 H new ATOM 1331 N THR A 89 -20.044 14.558 24.564 1.00 0.00 N ATOM 1332 CA THR A 89 -21.015 15.379 25.277 1.00 0.00 C ATOM 1333 C THR A 89 -22.107 14.519 25.903 1.00 0.00 C ATOM 1334 O THR A 89 -22.397 14.637 27.094 1.00 0.00 O ATOM 1335 CB THR A 89 -21.667 16.416 24.343 1.00 0.00 C ATOM 1336 OG1 THR A 89 -21.781 15.880 23.019 1.00 0.00 O ATOM 1337 CG2 THR A 89 -20.852 17.699 24.307 1.00 0.00 C ATOM 0 H THR A 89 -20.009 14.723 23.558 1.00 0.00 H new ATOM 0 HA THR A 89 -20.471 15.901 26.064 1.00 0.00 H new ATOM 0 HB THR A 89 -22.660 16.646 24.728 1.00 0.00 H new ATOM 0 HG1 THR A 89 -22.198 16.545 22.432 1.00 0.00 H new ATOM 0 HG21 THR A 89 -21.332 18.416 23.641 1.00 0.00 H new ATOM 0 HG22 THR A 89 -20.791 18.120 25.311 1.00 0.00 H new ATOM 0 HG23 THR A 89 -19.848 17.482 23.943 1.00 0.00 H new ATOM 1345 N SER A 90 -22.709 13.653 25.094 1.00 0.00 N ATOM 1346 CA SER A 90 -23.772 12.775 25.570 1.00 0.00 C ATOM 1347 C SER A 90 -24.858 13.573 26.284 1.00 0.00 C ATOM 1348 O SER A 90 -25.138 13.346 27.461 1.00 0.00 O ATOM 1349 CB SER A 90 -23.201 11.712 26.511 1.00 0.00 C ATOM 1350 OG SER A 90 -24.180 10.740 26.835 1.00 0.00 O ATOM 0 H SER A 90 -22.479 13.540 24.107 1.00 0.00 H new ATOM 0 HA SER A 90 -24.217 12.283 24.705 1.00 0.00 H new ATOM 0 HB2 SER A 90 -22.345 11.228 26.041 1.00 0.00 H new ATOM 0 HB3 SER A 90 -22.839 12.186 27.423 1.00 0.00 H new ATOM 0 HG SER A 90 -24.909 11.164 27.335 1.00 0.00 H new ATOM 1356 N SER A 91 -25.465 14.511 25.563 1.00 0.00 N ATOM 1357 CA SER A 91 -26.518 15.347 26.128 1.00 0.00 C ATOM 1358 C SER A 91 -26.026 16.067 27.380 1.00 0.00 C ATOM 1359 O SER A 91 -24.857 15.963 27.751 1.00 0.00 O ATOM 1360 CB SER A 91 -27.747 14.500 26.463 1.00 0.00 C ATOM 1361 OG SER A 91 -28.937 15.134 26.030 1.00 0.00 O ATOM 0 H SER A 91 -25.246 14.711 24.587 1.00 0.00 H new ATOM 0 HA SER A 91 -26.793 16.094 25.384 1.00 0.00 H new ATOM 0 HB2 SER A 91 -27.659 13.522 25.989 1.00 0.00 H new ATOM 0 HB3 SER A 91 -27.793 14.330 27.539 1.00 0.00 H new ATOM 0 HG SER A 91 -29.708 14.572 26.254 1.00 0.00 H new ATOM 1367 N SER A 92 -26.928 16.799 28.027 1.00 0.00 N ATOM 1368 CA SER A 92 -26.587 17.540 29.235 1.00 0.00 C ATOM 1369 C SER A 92 -27.579 17.242 30.354 1.00 0.00 C ATOM 1370 O SER A 92 -27.807 16.084 30.703 1.00 0.00 O ATOM 1371 CB SER A 92 -26.563 19.043 28.947 1.00 0.00 C ATOM 1372 OG SER A 92 -26.791 19.792 30.128 1.00 0.00 O ATOM 0 H SER A 92 -27.900 16.894 27.734 1.00 0.00 H new ATOM 0 HA SER A 92 -25.596 17.223 29.558 1.00 0.00 H new ATOM 0 HB2 SER A 92 -25.600 19.319 28.518 1.00 0.00 H new ATOM 0 HB3 SER A 92 -27.324 19.287 28.205 1.00 0.00 H new ATOM 0 HG SER A 92 -26.769 20.749 29.918 1.00 0.00 H new TER 1378 SER A 92