USER MOD reduce.3.24.130724 H: found=0, std=0, add=747, rem=0, adj=32 USER MOD reduce.3.24.130724 removed 752 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 12 SER OG : rot -160:sc= -0.935 USER MOD Set 1.2: A 139 THR OG1 : rot 180:sc= 0 USER MOD Set 2.1: A 27 LYS NZ :NH3+ -177:sc= -0.166 (180deg=0.866) USER MOD Set 2.2: A 80 TYR OH : rot 59:sc= 0.381 USER MOD Set 2.3: A 126 SER OG : rot -167:sc= 0.528 USER MOD Set 3.1: A 34 ASN : amide:sc= -1.15 K(o=-1.1,f=-6.6!) USER MOD Set 3.2: A 35 SER OG : rot 64:sc= 0.00603 USER MOD Single : A 3 SER OG : rot -40:sc= 0.0123 USER MOD Single : A 4 THR OG1 : rot 180:sc= -0.816 USER MOD Single : A 6 THR OG1 : rot 180:sc= 0 USER MOD Single : A 9 TYR OH : rot 180:sc= 0 USER MOD Single : A 11 GLN : amide:sc= -0.996 K(o=-1,f=-2.1) USER MOD Single : A 20 LYS NZ :NH3+ 169:sc= 0 (180deg=-0.08) USER MOD Single : A 21 MET CE :methyl -170:sc= -0.916 (180deg=-1.45!) USER MOD Single : A 25 ASN : amide:sc= -1.11 K(o=-1.1,f=-10!) USER MOD Single : A 28 TYR OH : rot 180:sc= 0 USER MOD Single : A 30 TYR OH : rot 180:sc= 0 USER MOD Single : A 42 SER OG : rot 158:sc= -1.31 USER MOD Single : A 44 THR OG1 : rot 180:sc= 0 USER MOD Single : A 45 TYR OH : rot 180:sc= 0 USER MOD Single : A 46 THR OG1 : rot -166:sc= 1.42 USER MOD Single : A 62 TYR OH : rot 180:sc= 0 USER MOD Single : A 63 TYR OH : rot 180:sc= 0 USER MOD Single : A 66 THR OG1 : rot 180:sc= -0.657 USER MOD Single : A 71 TYR OH : rot 180:sc= 0 USER MOD Single : A 78 SER OG : rot 111:sc= 0.503 USER MOD Single : A 87 TYR OH : rot 180:sc= -0.119 USER MOD Single : A 105 TYR OH : rot 180:sc= 0 USER MOD Single : A 108 SER OG : rot 180:sc= 0 USER MOD Single : A 109 TYR OH : rot 180:sc= 0 USER MOD Single : A 114 GLN : amide:sc= -0.184 K(o=-0.18,f=-0.94) USER MOD Single : A 116 ASN : amide:sc= -0.73 X(o=-0.73,f=-0.6) USER MOD Single : A 118 MET CE :methyl -147:sc= -0.194 (180deg=-1.34!) USER MOD Single : A 120 ASN : amide:sc= -0.192 X(o=-0.19,f=-0.0092) USER MOD Single : A 127 TYR OH : rot 180:sc= 0 USER MOD Single : A 129 GLN : amide:sc= -0.588 X(o=-0.59,f=-0.14) USER MOD Single : A 130 SER OG : rot 180:sc= -0.594 USER MOD Single : A 134 SER OG : rot 180:sc= 0 USER MOD Single : A 146 TYR OH : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 27 N SER A 3 115.566 -16.716 12.458 1.00 0.00 N ATOM 28 CA SER A 3 115.193 -15.370 12.039 1.00 0.00 C ATOM 29 C SER A 3 115.311 -15.242 10.525 1.00 0.00 C ATOM 30 O SER A 3 115.970 -16.055 9.877 1.00 0.00 O ATOM 31 CB SER A 3 116.104 -14.344 12.713 1.00 0.00 C ATOM 32 OG SER A 3 117.413 -14.452 12.171 1.00 0.00 O ATOM 0 HA SER A 3 114.160 -15.183 12.334 1.00 0.00 H new ATOM 0 HB2 SER A 3 115.715 -13.338 12.558 1.00 0.00 H new ATOM 0 HB3 SER A 3 116.128 -14.514 13.789 1.00 0.00 H new ATOM 0 HG SER A 3 117.635 -15.397 12.038 1.00 0.00 H new ATOM 38 N THR A 4 114.681 -14.215 9.959 1.00 0.00 N ATOM 39 CA THR A 4 114.750 -13.984 8.515 1.00 0.00 C ATOM 40 C THR A 4 115.290 -12.590 8.226 1.00 0.00 C ATOM 41 O THR A 4 115.196 -11.688 9.059 1.00 0.00 O ATOM 42 CB THR A 4 113.363 -14.125 7.879 1.00 0.00 C ATOM 43 OG1 THR A 4 112.521 -13.080 8.344 1.00 0.00 O ATOM 44 CG2 THR A 4 112.747 -15.481 8.237 1.00 0.00 C ATOM 0 H THR A 4 114.121 -13.534 10.472 1.00 0.00 H new ATOM 0 HA THR A 4 115.420 -14.730 8.087 1.00 0.00 H new ATOM 0 HB THR A 4 113.463 -14.061 6.795 1.00 0.00 H new ATOM 0 HG1 THR A 4 111.634 -13.169 7.936 1.00 0.00 H new ATOM 0 HG21 THR A 4 111.762 -15.566 7.778 1.00 0.00 H new ATOM 0 HG22 THR A 4 113.389 -16.281 7.869 1.00 0.00 H new ATOM 0 HG23 THR A 4 112.651 -15.562 9.320 1.00 0.00 H new ATOM 52 N VAL A 5 115.857 -12.422 7.036 1.00 0.00 N ATOM 53 CA VAL A 5 116.366 -11.121 6.610 1.00 0.00 C ATOM 54 C VAL A 5 115.872 -10.798 5.201 1.00 0.00 C ATOM 55 O VAL A 5 115.970 -11.628 4.296 1.00 0.00 O ATOM 56 CB VAL A 5 117.899 -11.122 6.663 1.00 0.00 C ATOM 57 CG1 VAL A 5 118.463 -12.170 5.698 1.00 0.00 C ATOM 58 CG2 VAL A 5 118.434 -9.739 6.281 1.00 0.00 C ATOM 0 H VAL A 5 115.976 -13.168 6.350 1.00 0.00 H new ATOM 0 HA VAL A 5 115.995 -10.350 7.286 1.00 0.00 H new ATOM 0 HB VAL A 5 118.212 -11.366 7.678 1.00 0.00 H new ATOM 0 HG11 VAL A 5 119.552 -12.160 5.746 1.00 0.00 H new ATOM 0 HG12 VAL A 5 118.097 -13.157 5.979 1.00 0.00 H new ATOM 0 HG13 VAL A 5 118.142 -11.939 4.682 1.00 0.00 H new ATOM 0 HG21 VAL A 5 119.523 -9.747 6.321 1.00 0.00 H new ATOM 0 HG22 VAL A 5 118.109 -9.490 5.271 1.00 0.00 H new ATOM 0 HG23 VAL A 5 118.051 -8.995 6.979 1.00 0.00 H new ATOM 68 N THR A 6 115.344 -9.590 5.022 1.00 0.00 N ATOM 69 CA THR A 6 114.823 -9.171 3.723 1.00 0.00 C ATOM 70 C THR A 6 115.421 -7.832 3.305 1.00 0.00 C ATOM 71 O THR A 6 115.639 -6.952 4.136 1.00 0.00 O ATOM 72 CB THR A 6 113.300 -9.053 3.789 1.00 0.00 C ATOM 73 OG1 THR A 6 112.753 -10.269 4.282 1.00 0.00 O ATOM 74 CG2 THR A 6 112.745 -8.773 2.390 1.00 0.00 C ATOM 0 H THR A 6 115.266 -8.886 5.756 1.00 0.00 H new ATOM 0 HA THR A 6 115.101 -9.922 2.984 1.00 0.00 H new ATOM 0 HB THR A 6 113.028 -8.234 4.455 1.00 0.00 H new ATOM 0 HG1 THR A 6 111.777 -10.194 4.327 1.00 0.00 H new ATOM 0 HG21 THR A 6 111.659 -8.689 2.439 1.00 0.00 H new ATOM 0 HG22 THR A 6 113.164 -7.840 2.012 1.00 0.00 H new ATOM 0 HG23 THR A 6 113.016 -9.590 1.721 1.00 0.00 H new ATOM 82 N GLY A 7 115.685 -7.684 2.013 1.00 0.00 N ATOM 83 CA GLY A 7 116.133 -6.404 1.474 1.00 0.00 C ATOM 84 C GLY A 7 115.333 -6.090 0.220 1.00 0.00 C ATOM 85 O GLY A 7 115.049 -6.996 -0.566 1.00 0.00 O ATOM 0 H GLY A 7 115.598 -8.429 1.322 1.00 0.00 H new ATOM 0 HA2 GLY A 7 115.998 -5.615 2.214 1.00 0.00 H new ATOM 0 HA3 GLY A 7 117.197 -6.445 1.242 1.00 0.00 H new ATOM 89 N GLY A 8 114.966 -4.824 0.034 1.00 0.00 N ATOM 90 CA GLY A 8 114.116 -4.469 -1.097 1.00 0.00 C ATOM 91 C GLY A 8 114.183 -2.987 -1.423 1.00 0.00 C ATOM 92 O GLY A 8 114.948 -2.236 -0.818 1.00 0.00 O ATOM 0 H GLY A 8 115.236 -4.046 0.635 1.00 0.00 H new ATOM 0 HA2 GLY A 8 114.418 -5.045 -1.971 1.00 0.00 H new ATOM 0 HA3 GLY A 8 113.085 -4.744 -0.875 1.00 0.00 H new ATOM 96 N TYR A 9 113.327 -2.571 -2.353 1.00 0.00 N ATOM 97 CA TYR A 9 113.315 -1.190 -2.826 1.00 0.00 C ATOM 98 C TYR A 9 111.927 -0.587 -2.649 1.00 0.00 C ATOM 99 O TYR A 9 110.933 -1.311 -2.590 1.00 0.00 O ATOM 100 CB TYR A 9 113.739 -1.141 -4.298 1.00 0.00 C ATOM 101 CG TYR A 9 112.745 -1.760 -5.254 1.00 0.00 C ATOM 102 CD1 TYR A 9 111.734 -0.972 -5.819 1.00 0.00 C ATOM 103 CD2 TYR A 9 112.833 -3.121 -5.575 1.00 0.00 C ATOM 104 CE1 TYR A 9 110.814 -1.544 -6.704 1.00 0.00 C ATOM 105 CE2 TYR A 9 111.912 -3.692 -6.461 1.00 0.00 C ATOM 106 CZ TYR A 9 110.902 -2.904 -7.025 1.00 0.00 C ATOM 107 OH TYR A 9 109.994 -3.467 -7.899 1.00 0.00 O ATOM 0 H TYR A 9 112.631 -3.172 -2.795 1.00 0.00 H new ATOM 0 HA TYR A 9 114.022 -0.605 -2.238 1.00 0.00 H new ATOM 0 HB2 TYR A 9 113.900 -0.101 -4.583 1.00 0.00 H new ATOM 0 HB3 TYR A 9 114.695 -1.653 -4.405 1.00 0.00 H new ATOM 0 HD1 TYR A 9 111.665 0.077 -5.571 1.00 0.00 H new ATOM 0 HD2 TYR A 9 113.611 -3.729 -5.139 1.00 0.00 H new ATOM 0 HE1 TYR A 9 110.035 -0.936 -7.140 1.00 0.00 H new ATOM 0 HE2 TYR A 9 111.981 -4.741 -6.709 1.00 0.00 H new ATOM 0 HH TYR A 9 110.197 -4.419 -8.014 1.00 0.00 H new ATOM 117 N ALA A 10 111.877 0.737 -2.565 1.00 0.00 N ATOM 118 CA ALA A 10 110.626 1.439 -2.316 1.00 0.00 C ATOM 119 C ALA A 10 110.507 2.654 -3.225 1.00 0.00 C ATOM 120 O ALA A 10 111.508 3.300 -3.535 1.00 0.00 O ATOM 121 CB ALA A 10 110.590 1.903 -0.859 1.00 0.00 C ATOM 0 H ALA A 10 112.689 1.346 -2.666 1.00 0.00 H new ATOM 0 HA ALA A 10 109.797 0.761 -2.518 1.00 0.00 H new ATOM 0 HB1 ALA A 10 109.655 2.429 -0.668 1.00 0.00 H new ATOM 0 HB2 ALA A 10 110.661 1.038 -0.200 1.00 0.00 H new ATOM 0 HB3 ALA A 10 111.429 2.573 -0.670 1.00 0.00 H new ATOM 127 N GLN A 11 109.283 2.963 -3.638 1.00 0.00 N ATOM 128 CA GLN A 11 109.028 4.173 -4.416 1.00 0.00 C ATOM 129 C GLN A 11 107.900 4.962 -3.765 1.00 0.00 C ATOM 130 O GLN A 11 106.868 4.387 -3.420 1.00 0.00 O ATOM 131 CB GLN A 11 108.646 3.805 -5.852 1.00 0.00 C ATOM 132 CG GLN A 11 108.502 5.079 -6.687 1.00 0.00 C ATOM 133 CD GLN A 11 108.172 4.746 -8.142 1.00 0.00 C ATOM 134 OE1 GLN A 11 108.196 3.583 -8.549 1.00 0.00 O ATOM 135 NE2 GLN A 11 107.860 5.712 -8.962 1.00 0.00 N ATOM 0 H GLN A 11 108.455 2.397 -3.449 1.00 0.00 H new ATOM 0 HA GLN A 11 109.931 4.783 -4.440 1.00 0.00 H new ATOM 0 HB2 GLN A 11 109.407 3.157 -6.287 1.00 0.00 H new ATOM 0 HB3 GLN A 11 107.710 3.246 -5.858 1.00 0.00 H new ATOM 0 HG2 GLN A 11 107.716 5.707 -6.267 1.00 0.00 H new ATOM 0 HG3 GLN A 11 109.427 5.654 -6.643 1.00 0.00 H new ATOM 0 HE21 GLN A 11 107.839 6.676 -8.630 1.00 0.00 H new ATOM 0 HE22 GLN A 11 107.637 5.503 -9.935 1.00 0.00 H new ATOM 144 N SER A 12 108.107 6.266 -3.587 1.00 0.00 N ATOM 145 CA SER A 12 107.106 7.111 -2.942 1.00 0.00 C ATOM 146 C SER A 12 106.561 8.136 -3.928 1.00 0.00 C ATOM 147 O SER A 12 107.333 8.826 -4.598 1.00 0.00 O ATOM 148 CB SER A 12 107.735 7.836 -1.753 1.00 0.00 C ATOM 149 OG SER A 12 106.743 8.630 -1.114 1.00 0.00 O ATOM 0 H SER A 12 108.953 6.756 -3.878 1.00 0.00 H new ATOM 0 HA SER A 12 106.286 6.481 -2.597 1.00 0.00 H new ATOM 0 HB2 SER A 12 108.150 7.114 -1.049 1.00 0.00 H new ATOM 0 HB3 SER A 12 108.560 8.464 -2.089 1.00 0.00 H new ATOM 0 HG SER A 12 107.177 9.323 -0.573 1.00 0.00 H new ATOM 155 N ASP A 13 105.236 8.246 -3.979 1.00 0.00 N ATOM 156 CA ASP A 13 104.573 9.133 -4.926 1.00 0.00 C ATOM 157 C ASP A 13 104.353 10.513 -4.317 1.00 0.00 C ATOM 158 O ASP A 13 103.781 10.642 -3.236 1.00 0.00 O ATOM 159 CB ASP A 13 103.225 8.540 -5.343 1.00 0.00 C ATOM 160 CG ASP A 13 102.591 9.397 -6.431 1.00 0.00 C ATOM 161 OD1 ASP A 13 102.932 9.200 -7.587 1.00 0.00 O ATOM 162 OD2 ASP A 13 101.773 10.238 -6.097 1.00 0.00 O ATOM 0 H ASP A 13 104.600 7.729 -3.372 1.00 0.00 H new ATOM 0 HA ASP A 13 105.215 9.235 -5.801 1.00 0.00 H new ATOM 0 HB2 ASP A 13 103.363 7.522 -5.706 1.00 0.00 H new ATOM 0 HB3 ASP A 13 102.561 8.484 -4.480 1.00 0.00 H new ATOM 167 N ALA A 14 104.815 11.539 -5.021 1.00 0.00 N ATOM 168 CA ALA A 14 104.676 12.911 -4.550 1.00 0.00 C ATOM 169 C ALA A 14 103.560 13.630 -5.299 1.00 0.00 C ATOM 170 O ALA A 14 103.366 13.421 -6.497 1.00 0.00 O ATOM 171 CB ALA A 14 105.993 13.665 -4.749 1.00 0.00 C ATOM 0 H ALA A 14 105.289 11.447 -5.920 1.00 0.00 H new ATOM 0 HA ALA A 14 104.425 12.885 -3.490 1.00 0.00 H new ATOM 0 HB1 ALA A 14 105.883 14.690 -4.395 1.00 0.00 H new ATOM 0 HB2 ALA A 14 106.784 13.170 -4.186 1.00 0.00 H new ATOM 0 HB3 ALA A 14 106.251 13.673 -5.808 1.00 0.00 H new ATOM 249 N LYS A 20 109.007 12.583 -6.702 1.00 0.00 N ATOM 250 CA LYS A 20 109.016 11.269 -6.064 1.00 0.00 C ATOM 251 C LYS A 20 110.365 11.000 -5.402 1.00 0.00 C ATOM 252 O LYS A 20 111.332 11.718 -5.644 1.00 0.00 O ATOM 253 CB LYS A 20 108.734 10.181 -7.102 1.00 0.00 C ATOM 254 CG LYS A 20 107.325 10.365 -7.668 1.00 0.00 C ATOM 255 CD LYS A 20 107.004 9.216 -8.625 1.00 0.00 C ATOM 256 CE LYS A 20 105.646 9.462 -9.284 1.00 0.00 C ATOM 257 NZ LYS A 20 105.790 10.492 -10.350 1.00 0.00 N ATOM 0 HA LYS A 20 108.239 11.255 -5.300 1.00 0.00 H new ATOM 0 HB2 LYS A 20 109.469 10.231 -7.905 1.00 0.00 H new ATOM 0 HB3 LYS A 20 108.828 9.196 -6.646 1.00 0.00 H new ATOM 0 HG2 LYS A 20 106.597 10.391 -6.857 1.00 0.00 H new ATOM 0 HG3 LYS A 20 107.254 11.319 -8.191 1.00 0.00 H new ATOM 0 HD2 LYS A 20 107.780 9.136 -9.386 1.00 0.00 H new ATOM 0 HD3 LYS A 20 106.991 8.271 -8.083 1.00 0.00 H new ATOM 0 HE2 LYS A 20 105.263 8.534 -9.709 1.00 0.00 H new ATOM 0 HE3 LYS A 20 104.923 9.793 -8.539 1.00 0.00 H new ATOM 0 HZ1 LYS A 20 104.920 10.526 -10.919 1.00 0.00 H new ATOM 0 HZ2 LYS A 20 105.955 11.422 -9.914 1.00 0.00 H new ATOM 0 HZ3 LYS A 20 106.595 10.248 -10.962 1.00 0.00 H new ATOM 271 N MET A 21 110.422 9.965 -4.567 1.00 0.00 N ATOM 272 CA MET A 21 111.652 9.654 -3.836 1.00 0.00 C ATOM 273 C MET A 21 111.960 8.161 -3.904 1.00 0.00 C ATOM 274 O MET A 21 111.057 7.356 -4.125 1.00 0.00 O ATOM 275 CB MET A 21 111.498 10.072 -2.373 1.00 0.00 C ATOM 276 CG MET A 21 111.318 11.589 -2.288 1.00 0.00 C ATOM 277 SD MET A 21 111.339 12.112 -0.555 1.00 0.00 S ATOM 278 CE MET A 21 109.903 11.161 0.002 1.00 0.00 C ATOM 0 H MET A 21 109.643 9.334 -4.380 1.00 0.00 H new ATOM 0 HA MET A 21 112.474 10.202 -4.295 1.00 0.00 H new ATOM 0 HB2 MET A 21 110.639 9.568 -1.929 1.00 0.00 H new ATOM 0 HB3 MET A 21 112.376 9.767 -1.803 1.00 0.00 H new ATOM 0 HG2 MET A 21 112.114 12.090 -2.839 1.00 0.00 H new ATOM 0 HG3 MET A 21 110.376 11.880 -2.754 1.00 0.00 H new ATOM 0 HE1 MET A 21 109.628 11.474 1.009 1.00 0.00 H new ATOM 0 HE2 MET A 21 109.066 11.336 -0.674 1.00 0.00 H new ATOM 0 HE3 MET A 21 110.149 10.099 0.007 1.00 0.00 H new ATOM 288 N GLY A 22 113.226 7.791 -3.690 1.00 0.00 N ATOM 289 CA GLY A 22 113.600 6.377 -3.703 1.00 0.00 C ATOM 290 C GLY A 22 113.883 5.909 -2.281 1.00 0.00 C ATOM 291 O GLY A 22 114.284 6.713 -1.448 1.00 0.00 O ATOM 0 H GLY A 22 113.994 8.437 -3.509 1.00 0.00 H new ATOM 0 HA2 GLY A 22 112.797 5.782 -4.139 1.00 0.00 H new ATOM 0 HA3 GLY A 22 114.481 6.229 -4.327 1.00 0.00 H new ATOM 295 N GLY A 23 113.671 4.625 -2.000 1.00 0.00 N ATOM 296 CA GLY A 23 113.896 4.110 -0.651 1.00 0.00 C ATOM 297 C GLY A 23 114.487 2.704 -0.665 1.00 0.00 C ATOM 298 O GLY A 23 114.157 1.891 -1.524 1.00 0.00 O ATOM 0 H GLY A 23 113.349 3.932 -2.676 1.00 0.00 H new ATOM 0 HA2 GLY A 23 114.568 4.780 -0.115 1.00 0.00 H new ATOM 0 HA3 GLY A 23 112.953 4.101 -0.105 1.00 0.00 H new ATOM 302 N PHE A 24 115.380 2.438 0.284 1.00 0.00 N ATOM 303 CA PHE A 24 115.921 1.095 0.476 1.00 0.00 C ATOM 304 C PHE A 24 115.484 0.577 1.842 1.00 0.00 C ATOM 305 O PHE A 24 115.480 1.335 2.811 1.00 0.00 O ATOM 306 CB PHE A 24 117.450 1.127 0.399 1.00 0.00 C ATOM 307 CG PHE A 24 117.974 1.598 -0.937 1.00 0.00 C ATOM 308 CD1 PHE A 24 118.126 0.689 -1.991 1.00 0.00 C ATOM 309 CD2 PHE A 24 118.306 2.945 -1.122 1.00 0.00 C ATOM 310 CE1 PHE A 24 118.609 1.126 -3.229 1.00 0.00 C ATOM 311 CE2 PHE A 24 118.790 3.382 -2.360 1.00 0.00 C ATOM 312 CZ PHE A 24 118.943 2.474 -3.415 1.00 0.00 C ATOM 0 H PHE A 24 115.745 3.135 0.933 1.00 0.00 H new ATOM 0 HA PHE A 24 115.546 0.436 -0.307 1.00 0.00 H new ATOM 0 HB2 PHE A 24 117.832 1.782 1.182 1.00 0.00 H new ATOM 0 HB3 PHE A 24 117.837 0.128 0.601 1.00 0.00 H new ATOM 0 HD1 PHE A 24 117.870 -0.350 -1.848 1.00 0.00 H new ATOM 0 HD2 PHE A 24 118.189 3.647 -0.310 1.00 0.00 H new ATOM 0 HE1 PHE A 24 118.724 0.424 -4.042 1.00 0.00 H new ATOM 0 HE2 PHE A 24 119.046 4.422 -2.502 1.00 0.00 H new ATOM 0 HZ PHE A 24 119.318 2.812 -4.370 1.00 0.00 H new ATOM 322 N ASN A 25 115.108 -0.700 1.920 1.00 0.00 N ATOM 323 CA ASN A 25 114.555 -1.243 3.162 1.00 0.00 C ATOM 324 C ASN A 25 115.280 -2.512 3.591 1.00 0.00 C ATOM 325 O ASN A 25 115.522 -3.402 2.777 1.00 0.00 O ATOM 326 CB ASN A 25 113.067 -1.555 2.968 1.00 0.00 C ATOM 327 CG ASN A 25 112.390 -1.820 4.310 1.00 0.00 C ATOM 328 OD1 ASN A 25 113.055 -2.027 5.325 1.00 0.00 O ATOM 329 ND2 ASN A 25 111.087 -1.826 4.376 1.00 0.00 N ATOM 0 H ASN A 25 115.174 -1.368 1.152 1.00 0.00 H new ATOM 0 HA ASN A 25 114.687 -0.494 3.942 1.00 0.00 H new ATOM 0 HB2 ASN A 25 112.578 -0.719 2.467 1.00 0.00 H new ATOM 0 HB3 ASN A 25 112.954 -2.425 2.321 1.00 0.00 H new ATOM 0 HD21 ASN A 25 110.622 -2.002 5.267 1.00 0.00 H new ATOM 0 HD22 ASN A 25 110.533 -1.655 3.537 1.00 0.00 H new ATOM 336 N LEU A 26 115.628 -2.571 4.877 1.00 0.00 N ATOM 337 CA LEU A 26 116.207 -3.776 5.466 1.00 0.00 C ATOM 338 C LEU A 26 115.316 -4.242 6.611 1.00 0.00 C ATOM 339 O LEU A 26 114.845 -3.418 7.392 1.00 0.00 O ATOM 340 CB LEU A 26 117.618 -3.486 5.989 1.00 0.00 C ATOM 341 CG LEU A 26 118.495 -2.935 4.861 1.00 0.00 C ATOM 342 CD1 LEU A 26 119.868 -2.562 5.421 1.00 0.00 C ATOM 343 CD2 LEU A 26 118.670 -4.001 3.776 1.00 0.00 C ATOM 0 H LEU A 26 115.518 -1.796 5.531 1.00 0.00 H new ATOM 0 HA LEU A 26 116.273 -4.556 4.707 1.00 0.00 H new ATOM 0 HB2 LEU A 26 117.570 -2.767 6.807 1.00 0.00 H new ATOM 0 HB3 LEU A 26 118.060 -4.398 6.391 1.00 0.00 H new ATOM 0 HG LEU A 26 118.018 -2.053 4.433 1.00 0.00 H new ATOM 0 HD11 LEU A 26 120.494 -2.170 4.619 1.00 0.00 H new ATOM 0 HD12 LEU A 26 119.751 -1.803 6.195 1.00 0.00 H new ATOM 0 HD13 LEU A 26 120.339 -3.447 5.849 1.00 0.00 H new ATOM 0 HD21 LEU A 26 119.295 -3.606 2.975 1.00 0.00 H new ATOM 0 HD22 LEU A 26 119.146 -4.883 4.206 1.00 0.00 H new ATOM 0 HD23 LEU A 26 117.694 -4.275 3.374 1.00 0.00 H new ATOM 355 N LYS A 27 115.082 -5.547 6.716 1.00 0.00 N ATOM 356 CA LYS A 27 114.134 -6.060 7.704 1.00 0.00 C ATOM 357 C LYS A 27 114.685 -7.286 8.425 1.00 0.00 C ATOM 358 O LYS A 27 115.428 -8.081 7.850 1.00 0.00 O ATOM 359 CB LYS A 27 112.825 -6.433 7.008 1.00 0.00 C ATOM 360 CG LYS A 27 112.237 -5.193 6.331 1.00 0.00 C ATOM 361 CD LYS A 27 110.998 -5.590 5.528 1.00 0.00 C ATOM 362 CE LYS A 27 109.879 -6.002 6.487 1.00 0.00 C ATOM 363 NZ LYS A 27 108.624 -6.233 5.716 1.00 0.00 N ATOM 0 H LYS A 27 115.528 -6.261 6.139 1.00 0.00 H new ATOM 0 HA LYS A 27 113.962 -5.278 8.443 1.00 0.00 H new ATOM 0 HB2 LYS A 27 113.003 -7.214 6.269 1.00 0.00 H new ATOM 0 HB3 LYS A 27 112.117 -6.835 7.733 1.00 0.00 H new ATOM 0 HG2 LYS A 27 111.974 -4.447 7.081 1.00 0.00 H new ATOM 0 HG3 LYS A 27 112.979 -4.738 5.674 1.00 0.00 H new ATOM 0 HD2 LYS A 27 110.671 -4.756 4.908 1.00 0.00 H new ATOM 0 HD3 LYS A 27 111.236 -6.414 4.855 1.00 0.00 H new ATOM 0 HE2 LYS A 27 110.161 -6.908 7.024 1.00 0.00 H new ATOM 0 HE3 LYS A 27 109.721 -5.224 7.234 1.00 0.00 H new ATOM 0 HZ1 LYS A 27 107.851 -6.463 6.372 1.00 0.00 H new ATOM 0 HZ2 LYS A 27 108.381 -5.374 5.183 1.00 0.00 H new ATOM 0 HZ3 LYS A 27 108.763 -7.023 5.054 1.00 0.00 H new ATOM 377 N TYR A 28 114.313 -7.426 9.695 1.00 0.00 N ATOM 378 CA TYR A 28 114.662 -8.613 10.467 1.00 0.00 C ATOM 379 C TYR A 28 113.427 -9.131 11.198 1.00 0.00 C ATOM 380 O TYR A 28 112.601 -8.344 11.655 1.00 0.00 O ATOM 381 CB TYR A 28 115.777 -8.280 11.465 1.00 0.00 C ATOM 382 CG TYR A 28 115.359 -7.335 12.569 1.00 0.00 C ATOM 383 CD1 TYR A 28 115.387 -5.952 12.354 1.00 0.00 C ATOM 384 CD2 TYR A 28 114.942 -7.842 13.804 1.00 0.00 C ATOM 385 CE1 TYR A 28 115.001 -5.076 13.376 1.00 0.00 C ATOM 386 CE2 TYR A 28 114.556 -6.967 14.828 1.00 0.00 C ATOM 387 CZ TYR A 28 114.585 -5.584 14.612 1.00 0.00 C ATOM 388 OH TYR A 28 114.204 -4.721 15.620 1.00 0.00 O ATOM 0 H TYR A 28 113.771 -6.732 10.210 1.00 0.00 H new ATOM 0 HA TYR A 28 115.023 -9.390 9.793 1.00 0.00 H new ATOM 0 HB2 TYR A 28 116.138 -9.206 11.912 1.00 0.00 H new ATOM 0 HB3 TYR A 28 116.615 -7.840 10.923 1.00 0.00 H new ATOM 0 HD1 TYR A 28 115.706 -5.560 11.399 1.00 0.00 H new ATOM 0 HD2 TYR A 28 114.918 -8.909 13.969 1.00 0.00 H new ATOM 0 HE1 TYR A 28 115.024 -4.009 13.211 1.00 0.00 H new ATOM 0 HE2 TYR A 28 114.237 -7.359 15.782 1.00 0.00 H new ATOM 0 HH TYR A 28 113.943 -5.237 16.411 1.00 0.00 H new ATOM 398 N ARG A 29 113.308 -10.452 11.304 1.00 0.00 N ATOM 399 CA ARG A 29 112.138 -11.055 11.934 1.00 0.00 C ATOM 400 C ARG A 29 112.536 -12.244 12.802 1.00 0.00 C ATOM 401 O ARG A 29 113.453 -12.991 12.462 1.00 0.00 O ATOM 402 CB ARG A 29 111.146 -11.512 10.861 1.00 0.00 C ATOM 403 CG ARG A 29 109.858 -12.013 11.524 1.00 0.00 C ATOM 404 CD ARG A 29 108.842 -12.385 10.444 1.00 0.00 C ATOM 405 NE ARG A 29 109.288 -13.577 9.717 1.00 0.00 N ATOM 406 CZ ARG A 29 108.451 -14.428 9.104 1.00 0.00 C ATOM 407 NH1 ARG A 29 107.150 -14.255 9.110 1.00 0.00 N ATOM 408 NH2 ARG A 29 108.948 -15.460 8.480 1.00 0.00 N ATOM 0 H ARG A 29 114.001 -11.120 10.965 1.00 0.00 H new ATOM 0 HA ARG A 29 111.669 -10.304 12.570 1.00 0.00 H new ATOM 0 HB2 ARG A 29 110.921 -10.687 10.186 1.00 0.00 H new ATOM 0 HB3 ARG A 29 111.588 -12.305 10.258 1.00 0.00 H new ATOM 0 HG2 ARG A 29 110.072 -12.878 12.151 1.00 0.00 H new ATOM 0 HG3 ARG A 29 109.447 -11.241 12.175 1.00 0.00 H new ATOM 0 HD2 ARG A 29 107.869 -12.571 10.899 1.00 0.00 H new ATOM 0 HD3 ARG A 29 108.717 -11.553 9.751 1.00 0.00 H new ATOM 0 HE ARG A 29 110.289 -13.770 9.675 1.00 0.00 H new ATOM 0 HH11 ARG A 29 106.744 -13.453 9.592 1.00 0.00 H new ATOM 0 HH12 ARG A 29 106.544 -14.923 8.633 1.00 0.00 H new ATOM 0 HH21 ARG A 29 109.957 -15.609 8.464 1.00 0.00 H new ATOM 0 HH22 ARG A 29 108.328 -16.118 8.008 1.00 0.00 H new ATOM 422 N TYR A 30 111.840 -12.416 13.924 1.00 0.00 N ATOM 423 CA TYR A 30 112.082 -13.558 14.796 1.00 0.00 C ATOM 424 C TYR A 30 110.939 -14.554 14.641 1.00 0.00 C ATOM 425 O TYR A 30 109.785 -14.149 14.478 1.00 0.00 O ATOM 426 CB TYR A 30 112.180 -13.104 16.253 1.00 0.00 C ATOM 427 CG TYR A 30 112.715 -14.173 17.176 1.00 0.00 C ATOM 428 CD1 TYR A 30 114.094 -14.271 17.401 1.00 0.00 C ATOM 429 CD2 TYR A 30 111.839 -15.066 17.799 1.00 0.00 C ATOM 430 CE1 TYR A 30 114.594 -15.263 18.252 1.00 0.00 C ATOM 431 CE2 TYR A 30 112.338 -16.058 18.651 1.00 0.00 C ATOM 432 CZ TYR A 30 113.716 -16.157 18.878 1.00 0.00 C ATOM 433 OH TYR A 30 114.212 -17.135 19.718 1.00 0.00 O ATOM 0 H TYR A 30 111.109 -11.782 14.247 1.00 0.00 H new ATOM 0 HA TYR A 30 113.024 -14.030 14.517 1.00 0.00 H new ATOM 0 HB2 TYR A 30 112.825 -12.227 16.311 1.00 0.00 H new ATOM 0 HB3 TYR A 30 111.193 -12.796 16.598 1.00 0.00 H new ATOM 0 HD1 TYR A 30 114.771 -13.582 16.918 1.00 0.00 H new ATOM 0 HD2 TYR A 30 110.776 -14.991 17.623 1.00 0.00 H new ATOM 0 HE1 TYR A 30 115.657 -15.339 18.426 1.00 0.00 H new ATOM 0 HE2 TYR A 30 111.660 -16.747 19.133 1.00 0.00 H new ATOM 0 HH TYR A 30 113.471 -17.670 20.071 1.00 0.00 H new ATOM 443 N GLU A 31 111.251 -15.848 14.690 1.00 0.00 N ATOM 444 CA GLU A 31 110.224 -16.861 14.465 1.00 0.00 C ATOM 445 C GLU A 31 109.597 -17.300 15.783 1.00 0.00 C ATOM 446 O GLU A 31 110.285 -17.707 16.718 1.00 0.00 O ATOM 447 CB GLU A 31 110.830 -18.077 13.758 1.00 0.00 C ATOM 448 CG GLU A 31 109.706 -19.038 13.353 1.00 0.00 C ATOM 449 CD GLU A 31 110.248 -20.323 12.716 1.00 0.00 C ATOM 450 OE1 GLU A 31 111.457 -20.477 12.615 1.00 0.00 O ATOM 451 OE2 GLU A 31 109.435 -21.146 12.333 1.00 0.00 O ATOM 0 H GLU A 31 112.184 -16.213 14.879 1.00 0.00 H new ATOM 0 HA GLU A 31 109.448 -16.423 13.837 1.00 0.00 H new ATOM 0 HB2 GLU A 31 111.388 -17.760 12.877 1.00 0.00 H new ATOM 0 HB3 GLU A 31 111.536 -18.582 14.418 1.00 0.00 H new ATOM 0 HG2 GLU A 31 109.112 -19.292 14.231 1.00 0.00 H new ATOM 0 HG3 GLU A 31 109.039 -18.539 12.650 1.00 0.00 H new ATOM 458 N GLU A 32 108.272 -17.204 15.830 1.00 0.00 N ATOM 459 CA GLU A 32 107.505 -17.526 17.029 1.00 0.00 C ATOM 460 C GLU A 32 106.426 -18.557 16.723 1.00 0.00 C ATOM 461 O GLU A 32 105.949 -18.658 15.593 1.00 0.00 O ATOM 462 CB GLU A 32 106.854 -16.261 17.593 1.00 0.00 C ATOM 463 CG GLU A 32 107.934 -15.327 18.150 1.00 0.00 C ATOM 464 CD GLU A 32 108.681 -15.973 19.321 1.00 0.00 C ATOM 465 OE1 GLU A 32 108.184 -16.939 19.883 1.00 0.00 O ATOM 466 OE2 GLU A 32 109.746 -15.480 19.650 1.00 0.00 O ATOM 0 H GLU A 32 107.701 -16.902 15.041 1.00 0.00 H new ATOM 0 HA GLU A 32 108.191 -17.944 17.766 1.00 0.00 H new ATOM 0 HB2 GLU A 32 106.288 -15.753 16.812 1.00 0.00 H new ATOM 0 HB3 GLU A 32 106.147 -16.524 18.379 1.00 0.00 H new ATOM 0 HG2 GLU A 32 108.641 -15.074 17.360 1.00 0.00 H new ATOM 0 HG3 GLU A 32 107.476 -14.394 18.479 1.00 0.00 H new ATOM 473 N ASP A 33 106.051 -19.319 17.743 1.00 0.00 N ATOM 474 CA ASP A 33 105.023 -20.342 17.596 1.00 0.00 C ATOM 475 C ASP A 33 103.640 -19.696 17.511 1.00 0.00 C ATOM 476 O ASP A 33 103.517 -18.475 17.406 1.00 0.00 O ATOM 477 CB ASP A 33 105.090 -21.351 18.747 1.00 0.00 C ATOM 478 CG ASP A 33 104.728 -20.695 20.074 1.00 0.00 C ATOM 479 OD1 ASP A 33 105.627 -20.198 20.734 1.00 0.00 O ATOM 480 OD2 ASP A 33 103.555 -20.700 20.413 1.00 0.00 O ATOM 0 H ASP A 33 106.444 -19.248 18.682 1.00 0.00 H new ATOM 0 HA ASP A 33 105.204 -20.885 16.668 1.00 0.00 H new ATOM 0 HB2 ASP A 33 104.409 -22.179 18.549 1.00 0.00 H new ATOM 0 HB3 ASP A 33 106.094 -21.772 18.808 1.00 0.00 H new ATOM 485 N ASN A 34 102.614 -20.528 17.410 1.00 0.00 N ATOM 486 CA ASN A 34 101.254 -20.042 17.199 1.00 0.00 C ATOM 487 C ASN A 34 100.810 -18.990 18.219 1.00 0.00 C ATOM 488 O ASN A 34 100.080 -18.067 17.853 1.00 0.00 O ATOM 489 CB ASN A 34 100.282 -21.224 17.230 1.00 0.00 C ATOM 490 CG ASN A 34 100.275 -21.873 18.612 1.00 0.00 C ATOM 491 OD1 ASN A 34 101.241 -21.749 19.364 1.00 0.00 O ATOM 492 ND2 ASN A 34 99.233 -22.562 18.993 1.00 0.00 N ATOM 0 H ASN A 34 102.695 -21.543 17.470 1.00 0.00 H new ATOM 0 HA ASN A 34 101.246 -19.552 16.225 1.00 0.00 H new ATOM 0 HB2 ASN A 34 99.278 -20.884 16.976 1.00 0.00 H new ATOM 0 HB3 ASN A 34 100.569 -21.959 16.478 1.00 0.00 H new ATOM 0 HD21 ASN A 34 99.219 -22.998 19.915 1.00 0.00 H new ATOM 0 HD22 ASN A 34 98.433 -22.664 18.369 1.00 0.00 H new ATOM 499 N SER A 35 101.237 -19.104 19.482 1.00 0.00 N ATOM 500 CA SER A 35 100.641 -18.270 20.533 1.00 0.00 C ATOM 501 C SER A 35 101.373 -16.945 20.788 1.00 0.00 C ATOM 502 O SER A 35 100.744 -15.996 21.258 1.00 0.00 O ATOM 503 CB SER A 35 100.594 -19.064 21.839 1.00 0.00 C ATOM 504 OG SER A 35 99.632 -20.104 21.717 1.00 0.00 O ATOM 0 H SER A 35 101.968 -19.743 19.795 1.00 0.00 H new ATOM 0 HA SER A 35 99.645 -18.008 20.177 1.00 0.00 H new ATOM 0 HB2 SER A 35 101.576 -19.484 22.059 1.00 0.00 H new ATOM 0 HB3 SER A 35 100.334 -18.407 22.669 1.00 0.00 H new ATOM 0 HG SER A 35 99.916 -20.732 21.021 1.00 0.00 H new ATOM 510 N PRO A 36 102.649 -16.832 20.512 1.00 0.00 N ATOM 511 CA PRO A 36 103.307 -15.500 20.386 1.00 0.00 C ATOM 512 C PRO A 36 103.545 -15.104 18.930 1.00 0.00 C ATOM 513 O PRO A 36 103.944 -15.925 18.106 1.00 0.00 O ATOM 514 CB PRO A 36 104.629 -15.692 21.127 1.00 0.00 C ATOM 515 CG PRO A 36 104.950 -17.149 21.025 1.00 0.00 C ATOM 516 CD PRO A 36 103.672 -17.886 20.611 1.00 0.00 C ATOM 0 HA PRO A 36 102.693 -14.696 20.792 1.00 0.00 H new ATOM 0 HB2 PRO A 36 105.418 -15.086 20.681 1.00 0.00 H new ATOM 0 HB3 PRO A 36 104.541 -15.384 22.169 1.00 0.00 H new ATOM 0 HG2 PRO A 36 105.740 -17.315 20.293 1.00 0.00 H new ATOM 0 HG3 PRO A 36 105.316 -17.527 21.980 1.00 0.00 H new ATOM 0 HD2 PRO A 36 103.803 -18.402 19.660 1.00 0.00 H new ATOM 0 HD3 PRO A 36 103.394 -18.640 21.347 1.00 0.00 H new ATOM 524 N LEU A 37 103.296 -13.833 18.627 1.00 0.00 N ATOM 525 CA LEU A 37 103.447 -13.324 17.265 1.00 0.00 C ATOM 526 C LEU A 37 104.915 -13.075 16.932 1.00 0.00 C ATOM 527 O LEU A 37 105.761 -13.014 17.824 1.00 0.00 O ATOM 528 CB LEU A 37 102.662 -12.018 17.104 1.00 0.00 C ATOM 529 CG LEU A 37 101.190 -12.238 17.461 1.00 0.00 C ATOM 530 CD1 LEU A 37 100.442 -10.906 17.379 1.00 0.00 C ATOM 531 CD2 LEU A 37 100.560 -13.226 16.475 1.00 0.00 C ATOM 0 H LEU A 37 102.989 -13.136 19.305 1.00 0.00 H new ATOM 0 HA LEU A 37 103.056 -14.076 16.579 1.00 0.00 H new ATOM 0 HB2 LEU A 37 103.088 -11.248 17.747 1.00 0.00 H new ATOM 0 HB3 LEU A 37 102.745 -11.659 16.078 1.00 0.00 H new ATOM 0 HG LEU A 37 101.123 -12.639 18.472 1.00 0.00 H new ATOM 0 HD11 LEU A 37 99.393 -11.061 17.633 1.00 0.00 H new ATOM 0 HD12 LEU A 37 100.884 -10.197 18.079 1.00 0.00 H new ATOM 0 HD13 LEU A 37 100.515 -10.509 16.366 1.00 0.00 H new ATOM 0 HD21 LEU A 37 99.512 -13.379 16.733 1.00 0.00 H new ATOM 0 HD22 LEU A 37 100.630 -12.825 15.464 1.00 0.00 H new ATOM 0 HD23 LEU A 37 101.089 -14.178 16.525 1.00 0.00 H new ATOM 543 N GLY A 38 105.209 -12.926 15.643 1.00 0.00 N ATOM 544 CA GLY A 38 106.582 -12.702 15.201 1.00 0.00 C ATOM 545 C GLY A 38 106.889 -11.210 15.179 1.00 0.00 C ATOM 546 O GLY A 38 106.040 -10.419 14.771 1.00 0.00 O ATOM 0 H GLY A 38 104.520 -12.956 14.891 1.00 0.00 H new ATOM 0 HA2 GLY A 38 107.275 -13.214 15.869 1.00 0.00 H new ATOM 0 HA3 GLY A 38 106.726 -13.125 14.207 1.00 0.00 H new ATOM 550 N VAL A 39 108.091 -10.820 15.600 1.00 0.00 N ATOM 551 CA VAL A 39 108.415 -9.398 15.704 1.00 0.00 C ATOM 552 C VAL A 39 109.263 -8.976 14.511 1.00 0.00 C ATOM 553 O VAL A 39 110.319 -9.554 14.260 1.00 0.00 O ATOM 554 CB VAL A 39 109.177 -9.120 17.006 1.00 0.00 C ATOM 555 CG1 VAL A 39 109.426 -7.617 17.153 1.00 0.00 C ATOM 556 CG2 VAL A 39 108.355 -9.608 18.203 1.00 0.00 C ATOM 0 H VAL A 39 108.843 -11.454 15.870 1.00 0.00 H new ATOM 0 HA VAL A 39 107.488 -8.825 15.710 1.00 0.00 H new ATOM 0 HB VAL A 39 110.130 -9.648 16.975 1.00 0.00 H new ATOM 0 HG11 VAL A 39 109.967 -7.427 18.080 1.00 0.00 H new ATOM 0 HG12 VAL A 39 110.016 -7.262 16.308 1.00 0.00 H new ATOM 0 HG13 VAL A 39 108.472 -7.091 17.176 1.00 0.00 H new ATOM 0 HG21 VAL A 39 108.901 -9.408 19.125 1.00 0.00 H new ATOM 0 HG22 VAL A 39 107.400 -9.084 18.226 1.00 0.00 H new ATOM 0 HG23 VAL A 39 108.179 -10.680 18.111 1.00 0.00 H new ATOM 566 N ILE A 40 108.807 -7.952 13.793 1.00 0.00 N ATOM 567 CA ILE A 40 109.531 -7.463 12.622 1.00 0.00 C ATOM 568 C ILE A 40 109.939 -6.014 12.849 1.00 0.00 C ATOM 569 O ILE A 40 109.157 -5.227 13.379 1.00 0.00 O ATOM 570 CB ILE A 40 108.649 -7.556 11.371 1.00 0.00 C ATOM 571 CG1 ILE A 40 108.180 -9.000 11.175 1.00 0.00 C ATOM 572 CG2 ILE A 40 109.447 -7.123 10.138 1.00 0.00 C ATOM 573 CD1 ILE A 40 107.118 -9.053 10.074 1.00 0.00 C ATOM 0 H ILE A 40 107.945 -7.447 14.000 1.00 0.00 H new ATOM 0 HA ILE A 40 110.418 -8.078 12.473 1.00 0.00 H new ATOM 0 HB ILE A 40 107.787 -6.901 11.499 1.00 0.00 H new ATOM 0 HG12 ILE A 40 109.026 -9.634 10.909 1.00 0.00 H new ATOM 0 HG13 ILE A 40 107.771 -9.389 12.107 1.00 0.00 H new ATOM 0 HG21 ILE A 40 108.815 -7.191 9.253 1.00 0.00 H new ATOM 0 HG22 ILE A 40 109.783 -6.094 10.265 1.00 0.00 H new ATOM 0 HG23 ILE A 40 110.312 -7.775 10.017 1.00 0.00 H new ATOM 0 HD11 ILE A 40 106.787 -10.082 9.937 1.00 0.00 H new ATOM 0 HD12 ILE A 40 106.268 -8.433 10.358 1.00 0.00 H new ATOM 0 HD13 ILE A 40 107.542 -8.682 9.141 1.00 0.00 H new ATOM 585 N GLY A 41 111.166 -5.686 12.456 1.00 0.00 N ATOM 586 CA GLY A 41 111.648 -4.310 12.523 1.00 0.00 C ATOM 587 C GLY A 41 112.258 -3.927 11.181 1.00 0.00 C ATOM 588 O GLY A 41 112.999 -4.713 10.594 1.00 0.00 O ATOM 0 H GLY A 41 111.844 -6.353 12.088 1.00 0.00 H new ATOM 0 HA2 GLY A 41 110.827 -3.636 12.768 1.00 0.00 H new ATOM 0 HA3 GLY A 41 112.390 -4.210 13.315 1.00 0.00 H new ATOM 592 N SER A 42 111.936 -2.733 10.689 1.00 0.00 N ATOM 593 CA SER A 42 112.398 -2.319 9.368 1.00 0.00 C ATOM 594 C SER A 42 113.049 -0.943 9.422 1.00 0.00 C ATOM 595 O SER A 42 112.586 -0.058 10.143 1.00 0.00 O ATOM 596 CB SER A 42 111.218 -2.278 8.396 1.00 0.00 C ATOM 597 OG SER A 42 110.473 -3.482 8.514 1.00 0.00 O ATOM 0 H SER A 42 111.365 -2.044 11.178 1.00 0.00 H new ATOM 0 HA SER A 42 113.138 -3.043 9.026 1.00 0.00 H new ATOM 0 HB2 SER A 42 110.582 -1.420 8.614 1.00 0.00 H new ATOM 0 HB3 SER A 42 111.577 -2.157 7.374 1.00 0.00 H new ATOM 0 HG SER A 42 109.561 -3.336 8.186 1.00 0.00 H new ATOM 603 N PHE A 43 114.114 -0.779 8.644 1.00 0.00 N ATOM 604 CA PHE A 43 114.792 0.507 8.528 1.00 0.00 C ATOM 605 C PHE A 43 114.671 1.001 7.094 1.00 0.00 C ATOM 606 O PHE A 43 114.981 0.265 6.158 1.00 0.00 O ATOM 607 CB PHE A 43 116.269 0.350 8.889 1.00 0.00 C ATOM 608 CG PHE A 43 116.502 -0.145 10.297 1.00 0.00 C ATOM 609 CD1 PHE A 43 116.631 0.769 11.349 1.00 0.00 C ATOM 610 CD2 PHE A 43 116.586 -1.520 10.549 1.00 0.00 C ATOM 611 CE1 PHE A 43 116.846 0.309 12.654 1.00 0.00 C ATOM 612 CE2 PHE A 43 116.801 -1.979 11.854 1.00 0.00 C ATOM 613 CZ PHE A 43 116.930 -1.065 12.906 1.00 0.00 C ATOM 0 H PHE A 43 114.527 -1.524 8.083 1.00 0.00 H new ATOM 0 HA PHE A 43 114.334 1.224 9.209 1.00 0.00 H new ATOM 0 HB2 PHE A 43 116.733 -0.344 8.188 1.00 0.00 H new ATOM 0 HB3 PHE A 43 116.768 1.311 8.764 1.00 0.00 H new ATOM 0 HD1 PHE A 43 116.565 1.829 11.154 1.00 0.00 H new ATOM 0 HD2 PHE A 43 116.485 -2.225 9.738 1.00 0.00 H new ATOM 0 HE1 PHE A 43 116.947 1.014 13.466 1.00 0.00 H new ATOM 0 HE2 PHE A 43 116.867 -3.039 12.049 1.00 0.00 H new ATOM 0 HZ PHE A 43 117.094 -1.420 13.913 1.00 0.00 H new ATOM 623 N THR A 44 114.211 2.237 6.923 1.00 0.00 N ATOM 624 CA THR A 44 114.053 2.809 5.588 1.00 0.00 C ATOM 625 C THR A 44 114.891 4.072 5.442 1.00 0.00 C ATOM 626 O THR A 44 114.846 4.956 6.298 1.00 0.00 O ATOM 627 CB THR A 44 112.579 3.143 5.343 1.00 0.00 C ATOM 628 OG1 THR A 44 111.786 1.990 5.585 1.00 0.00 O ATOM 629 CG2 THR A 44 112.390 3.599 3.894 1.00 0.00 C ATOM 0 H THR A 44 113.943 2.859 7.686 1.00 0.00 H new ATOM 0 HA THR A 44 114.392 2.078 4.854 1.00 0.00 H new ATOM 0 HB THR A 44 112.272 3.943 6.016 1.00 0.00 H new ATOM 0 HG1 THR A 44 110.842 2.204 5.430 1.00 0.00 H new ATOM 0 HG21 THR A 44 111.340 3.836 3.721 1.00 0.00 H new ATOM 0 HG22 THR A 44 112.998 4.485 3.709 1.00 0.00 H new ATOM 0 HG23 THR A 44 112.697 2.801 3.218 1.00 0.00 H new ATOM 637 N TYR A 45 115.646 4.140 4.351 1.00 0.00 N ATOM 638 CA TYR A 45 116.466 5.309 4.048 1.00 0.00 C ATOM 639 C TYR A 45 116.077 5.852 2.681 1.00 0.00 C ATOM 640 O TYR A 45 115.887 5.071 1.749 1.00 0.00 O ATOM 641 CB TYR A 45 117.945 4.918 4.039 1.00 0.00 C ATOM 642 CG TYR A 45 118.417 4.301 5.333 1.00 0.00 C ATOM 643 CD1 TYR A 45 118.318 2.919 5.526 1.00 0.00 C ATOM 644 CD2 TYR A 45 118.957 5.111 6.339 1.00 0.00 C ATOM 645 CE1 TYR A 45 118.759 2.346 6.723 1.00 0.00 C ATOM 646 CE2 TYR A 45 119.398 4.538 7.538 1.00 0.00 C ATOM 647 CZ TYR A 45 119.298 3.155 7.731 1.00 0.00 C ATOM 648 OH TYR A 45 119.733 2.590 8.913 1.00 0.00 O ATOM 0 H TYR A 45 115.708 3.395 3.657 1.00 0.00 H new ATOM 0 HA TYR A 45 116.303 6.073 4.809 1.00 0.00 H new ATOM 0 HB2 TYR A 45 118.121 4.214 3.226 1.00 0.00 H new ATOM 0 HB3 TYR A 45 118.545 5.804 3.829 1.00 0.00 H new ATOM 0 HD1 TYR A 45 117.901 2.294 4.750 1.00 0.00 H new ATOM 0 HD2 TYR A 45 119.033 6.178 6.190 1.00 0.00 H new ATOM 0 HE1 TYR A 45 118.684 1.279 6.870 1.00 0.00 H new ATOM 0 HE2 TYR A 45 119.815 5.163 8.314 1.00 0.00 H new ATOM 0 HH TYR A 45 120.079 3.292 9.503 1.00 0.00 H new ATOM 658 N THR A 46 115.961 7.174 2.548 1.00 0.00 N ATOM 659 CA THR A 46 115.542 7.757 1.278 1.00 0.00 C ATOM 660 C THR A 46 116.744 8.227 0.468 1.00 0.00 C ATOM 661 O THR A 46 117.760 8.649 1.022 1.00 0.00 O ATOM 662 CB THR A 46 114.606 8.935 1.534 1.00 0.00 C ATOM 663 OG1 THR A 46 113.581 8.527 2.426 1.00 0.00 O ATOM 664 CG2 THR A 46 113.987 9.397 0.214 1.00 0.00 C ATOM 0 H THR A 46 116.148 7.848 3.290 1.00 0.00 H new ATOM 0 HA THR A 46 115.020 6.989 0.707 1.00 0.00 H new ATOM 0 HB THR A 46 115.166 9.761 1.972 1.00 0.00 H new ATOM 0 HG1 THR A 46 112.864 9.195 2.428 1.00 0.00 H new ATOM 0 HG21 THR A 46 113.319 10.238 0.400 1.00 0.00 H new ATOM 0 HG22 THR A 46 114.777 9.706 -0.470 1.00 0.00 H new ATOM 0 HG23 THR A 46 113.423 8.577 -0.230 1.00 0.00 H new ATOM 672 N GLU A 47 116.619 8.140 -0.854 1.00 0.00 N ATOM 673 CA GLU A 47 117.717 8.465 -1.755 1.00 0.00 C ATOM 674 C GLU A 47 117.348 9.659 -2.627 1.00 0.00 C ATOM 675 O GLU A 47 116.192 9.799 -3.042 1.00 0.00 O ATOM 676 CB GLU A 47 118.030 7.258 -2.644 1.00 0.00 C ATOM 677 CG GLU A 47 119.306 7.531 -3.453 1.00 0.00 C ATOM 678 CD GLU A 47 119.619 6.390 -4.429 1.00 0.00 C ATOM 679 OE1 GLU A 47 118.861 5.434 -4.497 1.00 0.00 O ATOM 680 OE2 GLU A 47 120.630 6.493 -5.102 1.00 0.00 O ATOM 0 H GLU A 47 115.763 7.846 -1.325 1.00 0.00 H new ATOM 0 HA GLU A 47 118.596 8.718 -1.162 1.00 0.00 H new ATOM 0 HB2 GLU A 47 118.160 6.366 -2.031 1.00 0.00 H new ATOM 0 HB3 GLU A 47 117.195 7.063 -3.317 1.00 0.00 H new ATOM 0 HG2 GLU A 47 119.192 8.462 -4.008 1.00 0.00 H new ATOM 0 HG3 GLU A 47 120.146 7.667 -2.772 1.00 0.00 H new ATOM 897 N TYR A 62 114.688 11.077 4.417 1.00 0.00 N ATOM 898 CA TYR A 62 114.115 10.779 5.724 1.00 0.00 C ATOM 899 C TYR A 62 114.460 9.369 6.186 1.00 0.00 C ATOM 900 O TYR A 62 114.778 8.491 5.385 1.00 0.00 O ATOM 901 CB TYR A 62 112.595 10.975 5.705 1.00 0.00 C ATOM 902 CG TYR A 62 111.836 9.948 4.901 1.00 0.00 C ATOM 903 CD1 TYR A 62 111.585 10.167 3.541 1.00 0.00 C ATOM 904 CD2 TYR A 62 111.379 8.777 5.516 1.00 0.00 C ATOM 905 CE1 TYR A 62 110.878 9.216 2.797 1.00 0.00 C ATOM 906 CE2 TYR A 62 110.672 7.824 4.772 1.00 0.00 C ATOM 907 CZ TYR A 62 110.421 8.043 3.412 1.00 0.00 C ATOM 908 OH TYR A 62 109.723 7.107 2.679 1.00 0.00 O ATOM 0 HA TYR A 62 114.553 11.477 6.437 1.00 0.00 H new ATOM 0 HB2 TYR A 62 112.227 10.957 6.731 1.00 0.00 H new ATOM 0 HB3 TYR A 62 112.375 11.965 5.305 1.00 0.00 H new ATOM 0 HD1 TYR A 62 111.937 11.071 3.066 1.00 0.00 H new ATOM 0 HD2 TYR A 62 111.572 8.608 6.565 1.00 0.00 H new ATOM 0 HE1 TYR A 62 110.684 9.386 1.748 1.00 0.00 H new ATOM 0 HE2 TYR A 62 110.320 6.920 5.247 1.00 0.00 H new ATOM 0 HH TYR A 62 109.481 6.354 3.257 1.00 0.00 H new ATOM 918 N TYR A 63 114.388 9.176 7.498 1.00 0.00 N ATOM 919 CA TYR A 63 114.657 7.879 8.104 1.00 0.00 C ATOM 920 C TYR A 63 113.399 7.384 8.803 1.00 0.00 C ATOM 921 O TYR A 63 112.734 8.148 9.500 1.00 0.00 O ATOM 922 CB TYR A 63 115.791 8.005 9.124 1.00 0.00 C ATOM 923 CG TYR A 63 117.052 8.609 8.552 1.00 0.00 C ATOM 924 CD1 TYR A 63 117.968 7.797 7.875 1.00 0.00 C ATOM 925 CD2 TYR A 63 117.302 9.978 8.701 1.00 0.00 C ATOM 926 CE1 TYR A 63 119.139 8.356 7.347 1.00 0.00 C ATOM 927 CE2 TYR A 63 118.471 10.536 8.170 1.00 0.00 C ATOM 928 CZ TYR A 63 119.390 9.726 7.494 1.00 0.00 C ATOM 929 OH TYR A 63 120.544 10.276 6.971 1.00 0.00 O ATOM 0 H TYR A 63 114.144 9.907 8.166 1.00 0.00 H new ATOM 0 HA TYR A 63 114.952 7.172 7.329 1.00 0.00 H new ATOM 0 HB2 TYR A 63 115.451 8.617 9.959 1.00 0.00 H new ATOM 0 HB3 TYR A 63 116.020 7.018 9.525 1.00 0.00 H new ATOM 0 HD1 TYR A 63 117.773 6.741 7.760 1.00 0.00 H new ATOM 0 HD2 TYR A 63 116.594 10.603 9.225 1.00 0.00 H new ATOM 0 HE1 TYR A 63 119.849 7.730 6.826 1.00 0.00 H new ATOM 0 HE2 TYR A 63 118.664 11.593 8.282 1.00 0.00 H new ATOM 0 HH TYR A 63 120.563 11.237 7.160 1.00 0.00 H new ATOM 939 N GLY A 64 113.064 6.115 8.602 1.00 0.00 N ATOM 940 CA GLY A 64 111.858 5.549 9.202 1.00 0.00 C ATOM 941 C GLY A 64 112.177 4.282 9.983 1.00 0.00 C ATOM 942 O GLY A 64 112.881 3.401 9.487 1.00 0.00 O ATOM 0 H GLY A 64 113.604 5.462 8.034 1.00 0.00 H new ATOM 0 HA2 GLY A 64 111.399 6.283 9.865 1.00 0.00 H new ATOM 0 HA3 GLY A 64 111.130 5.325 8.422 1.00 0.00 H new ATOM 946 N ILE A 65 111.662 4.206 11.206 1.00 0.00 N ATOM 947 CA ILE A 65 111.817 3.010 12.031 1.00 0.00 C ATOM 948 C ILE A 65 110.439 2.442 12.345 1.00 0.00 C ATOM 949 O ILE A 65 109.621 3.124 12.961 1.00 0.00 O ATOM 950 CB ILE A 65 112.533 3.353 13.341 1.00 0.00 C ATOM 951 CG1 ILE A 65 113.858 4.081 13.072 1.00 0.00 C ATOM 952 CG2 ILE A 65 112.803 2.069 14.129 1.00 0.00 C ATOM 953 CD1 ILE A 65 114.794 3.224 12.212 1.00 0.00 C ATOM 0 H ILE A 65 111.134 4.958 11.649 1.00 0.00 H new ATOM 0 HA ILE A 65 112.412 2.277 11.487 1.00 0.00 H new ATOM 0 HB ILE A 65 111.890 4.015 13.921 1.00 0.00 H new ATOM 0 HG12 ILE A 65 113.661 5.027 12.568 1.00 0.00 H new ATOM 0 HG13 ILE A 65 114.344 4.319 14.018 1.00 0.00 H new ATOM 0 HG21 ILE A 65 113.312 2.314 15.061 1.00 0.00 H new ATOM 0 HG22 ILE A 65 111.858 1.573 14.352 1.00 0.00 H new ATOM 0 HG23 ILE A 65 113.431 1.404 13.536 1.00 0.00 H new ATOM 0 HD11 ILE A 65 115.724 3.764 12.037 1.00 0.00 H new ATOM 0 HD12 ILE A 65 115.009 2.289 12.729 1.00 0.00 H new ATOM 0 HD13 ILE A 65 114.315 3.008 11.257 1.00 0.00 H new ATOM 965 N THR A 66 110.176 1.210 11.906 1.00 0.00 N ATOM 966 CA THR A 66 108.860 0.601 12.111 1.00 0.00 C ATOM 967 C THR A 66 108.983 -0.721 12.862 1.00 0.00 C ATOM 968 O THR A 66 109.990 -1.418 12.740 1.00 0.00 O ATOM 969 CB THR A 66 108.180 0.341 10.764 1.00 0.00 C ATOM 970 OG1 THR A 66 108.970 -0.564 10.008 1.00 0.00 O ATOM 971 CG2 THR A 66 108.013 1.648 9.985 1.00 0.00 C ATOM 0 H THR A 66 110.847 0.621 11.413 1.00 0.00 H new ATOM 0 HA THR A 66 108.261 1.295 12.701 1.00 0.00 H new ATOM 0 HB THR A 66 107.193 -0.086 10.943 1.00 0.00 H new ATOM 0 HG1 THR A 66 108.537 -0.734 9.145 1.00 0.00 H new ATOM 0 HG21 THR A 66 107.528 1.443 9.031 1.00 0.00 H new ATOM 0 HG22 THR A 66 107.400 2.340 10.562 1.00 0.00 H new ATOM 0 HG23 THR A 66 108.992 2.093 9.806 1.00 0.00 H new ATOM 979 N ALA A 67 107.937 -1.066 13.607 1.00 0.00 N ATOM 980 CA ALA A 67 107.875 -2.360 14.280 1.00 0.00 C ATOM 981 C ALA A 67 106.436 -2.865 14.269 1.00 0.00 C ATOM 982 O ALA A 67 105.506 -2.058 14.314 1.00 0.00 O ATOM 983 CB ALA A 67 108.368 -2.229 15.723 1.00 0.00 C ATOM 0 H ALA A 67 107.123 -0.470 13.760 1.00 0.00 H new ATOM 0 HA ALA A 67 108.515 -3.069 13.755 1.00 0.00 H new ATOM 0 HB1 ALA A 67 108.317 -3.201 16.215 1.00 0.00 H new ATOM 0 HB2 ALA A 67 109.399 -1.875 15.725 1.00 0.00 H new ATOM 0 HB3 ALA A 67 107.740 -1.518 16.259 1.00 0.00 H new ATOM 989 N GLY A 68 106.249 -4.184 14.173 1.00 0.00 N ATOM 990 CA GLY A 68 104.892 -4.726 14.126 1.00 0.00 C ATOM 991 C GLY A 68 104.845 -6.246 14.308 1.00 0.00 C ATOM 992 O GLY A 68 105.883 -6.904 14.263 1.00 0.00 O ATOM 0 H GLY A 68 106.996 -4.877 14.128 1.00 0.00 H new ATOM 0 HA2 GLY A 68 104.292 -4.254 14.904 1.00 0.00 H new ATOM 0 HA3 GLY A 68 104.436 -4.466 13.170 1.00 0.00 H new ATOM 996 N PRO A 69 103.674 -6.813 14.520 1.00 0.00 N ATOM 997 CA PRO A 69 103.514 -8.285 14.651 1.00 0.00 C ATOM 998 C PRO A 69 103.098 -8.956 13.339 1.00 0.00 C ATOM 999 O PRO A 69 102.169 -8.505 12.661 1.00 0.00 O ATOM 1000 CB PRO A 69 102.407 -8.410 15.699 1.00 0.00 C ATOM 1001 CG PRO A 69 101.567 -7.181 15.551 1.00 0.00 C ATOM 1002 CD PRO A 69 102.360 -6.169 14.715 1.00 0.00 C ATOM 0 HA PRO A 69 104.447 -8.779 14.924 1.00 0.00 H new ATOM 0 HB2 PRO A 69 101.815 -9.311 15.537 1.00 0.00 H new ATOM 0 HB3 PRO A 69 102.825 -8.480 16.703 1.00 0.00 H new ATOM 0 HG2 PRO A 69 100.622 -7.421 15.065 1.00 0.00 H new ATOM 0 HG3 PRO A 69 101.326 -6.763 16.528 1.00 0.00 H new ATOM 0 HD2 PRO A 69 101.870 -5.968 13.763 1.00 0.00 H new ATOM 0 HD3 PRO A 69 102.457 -5.214 15.232 1.00 0.00 H new ATOM 1010 N ALA A 70 103.901 -9.933 12.927 1.00 0.00 N ATOM 1011 CA ALA A 70 103.563 -10.815 11.815 1.00 0.00 C ATOM 1012 C ALA A 70 102.615 -11.930 12.254 1.00 0.00 C ATOM 1013 O ALA A 70 102.768 -12.476 13.350 1.00 0.00 O ATOM 1014 CB ALA A 70 104.843 -11.423 11.231 1.00 0.00 C ATOM 0 H ALA A 70 104.804 -10.135 13.355 1.00 0.00 H new ATOM 0 HA ALA A 70 103.055 -10.221 11.055 1.00 0.00 H new ATOM 0 HB1 ALA A 70 104.587 -12.081 10.401 1.00 0.00 H new ATOM 0 HB2 ALA A 70 105.495 -10.625 10.874 1.00 0.00 H new ATOM 0 HB3 ALA A 70 105.359 -11.995 12.002 1.00 0.00 H new ATOM 1020 N TYR A 71 101.678 -12.295 11.380 1.00 0.00 N ATOM 1021 CA TYR A 71 100.846 -13.473 11.589 1.00 0.00 C ATOM 1022 C TYR A 71 101.124 -14.464 10.464 1.00 0.00 C ATOM 1023 O TYR A 71 101.049 -14.100 9.289 1.00 0.00 O ATOM 1024 CB TYR A 71 99.365 -13.084 11.581 1.00 0.00 C ATOM 1025 CG TYR A 71 99.006 -12.066 12.637 1.00 0.00 C ATOM 1026 CD1 TYR A 71 98.720 -12.485 13.944 1.00 0.00 C ATOM 1027 CD2 TYR A 71 98.957 -10.706 12.312 1.00 0.00 C ATOM 1028 CE1 TYR A 71 98.385 -11.541 14.922 1.00 0.00 C ATOM 1029 CE2 TYR A 71 98.623 -9.763 13.291 1.00 0.00 C ATOM 1030 CZ TYR A 71 98.338 -10.179 14.596 1.00 0.00 C ATOM 1031 OH TYR A 71 98.008 -9.250 15.560 1.00 0.00 O ATOM 0 H TYR A 71 101.478 -11.788 10.518 1.00 0.00 H new ATOM 0 HA TYR A 71 101.079 -13.922 12.554 1.00 0.00 H new ATOM 0 HB2 TYR A 71 99.107 -12.685 10.600 1.00 0.00 H new ATOM 0 HB3 TYR A 71 98.761 -13.979 11.730 1.00 0.00 H new ATOM 0 HD1 TYR A 71 98.758 -13.535 14.196 1.00 0.00 H new ATOM 0 HD2 TYR A 71 99.177 -10.384 11.305 1.00 0.00 H new ATOM 0 HE1 TYR A 71 98.163 -11.863 15.929 1.00 0.00 H new ATOM 0 HE2 TYR A 71 98.585 -8.714 13.039 1.00 0.00 H new ATOM 0 HH TYR A 71 98.023 -8.352 15.168 1.00 0.00 H new ATOM 1144 N SER A 78 100.009 -14.594 4.275 1.00 0.00 N ATOM 1145 CA SER A 78 100.494 -14.098 5.557 1.00 0.00 C ATOM 1146 C SER A 78 100.201 -12.608 5.654 1.00 0.00 C ATOM 1147 O SER A 78 100.032 -11.947 4.630 1.00 0.00 O ATOM 1148 CB SER A 78 101.997 -14.340 5.682 1.00 0.00 C ATOM 1149 OG SER A 78 102.257 -15.732 5.583 1.00 0.00 O ATOM 0 HA SER A 78 99.989 -14.627 6.365 1.00 0.00 H new ATOM 0 HB2 SER A 78 102.530 -13.802 4.898 1.00 0.00 H new ATOM 0 HB3 SER A 78 102.361 -13.957 6.636 1.00 0.00 H new ATOM 0 HG SER A 78 102.727 -15.918 4.744 1.00 0.00 H new ATOM 1155 N ILE A 79 100.087 -12.093 6.875 1.00 0.00 N ATOM 1156 CA ILE A 79 99.753 -10.684 7.057 1.00 0.00 C ATOM 1157 C ILE A 79 100.563 -10.106 8.206 1.00 0.00 C ATOM 1158 O ILE A 79 100.611 -10.690 9.287 1.00 0.00 O ATOM 1159 CB ILE A 79 98.253 -10.521 7.343 1.00 0.00 C ATOM 1160 CG1 ILE A 79 97.435 -11.159 6.214 1.00 0.00 C ATOM 1161 CG2 ILE A 79 97.902 -9.031 7.434 1.00 0.00 C ATOM 1162 CD1 ILE A 79 95.947 -11.132 6.572 1.00 0.00 C ATOM 0 H ILE A 79 100.218 -12.619 7.739 1.00 0.00 H new ATOM 0 HA ILE A 79 99.994 -10.147 6.140 1.00 0.00 H new ATOM 0 HB ILE A 79 98.019 -11.013 8.287 1.00 0.00 H new ATOM 0 HG12 ILE A 79 97.604 -10.621 5.281 1.00 0.00 H new ATOM 0 HG13 ILE A 79 97.761 -12.187 6.052 1.00 0.00 H new ATOM 0 HG21 ILE A 79 96.837 -8.920 7.637 1.00 0.00 H new ATOM 0 HG22 ILE A 79 98.475 -8.571 8.239 1.00 0.00 H new ATOM 0 HG23 ILE A 79 98.145 -8.542 6.491 1.00 0.00 H new ATOM 0 HD11 ILE A 79 95.371 -11.587 5.766 1.00 0.00 H new ATOM 0 HD12 ILE A 79 95.784 -11.690 7.494 1.00 0.00 H new ATOM 0 HD13 ILE A 79 95.625 -10.100 6.711 1.00 0.00 H new ATOM 1174 N TYR A 80 101.210 -8.972 7.970 1.00 0.00 N ATOM 1175 CA TYR A 80 101.895 -8.266 9.047 1.00 0.00 C ATOM 1176 C TYR A 80 101.668 -6.768 8.921 1.00 0.00 C ATOM 1177 O TYR A 80 101.628 -6.232 7.814 1.00 0.00 O ATOM 1178 CB TYR A 80 103.389 -8.591 9.036 1.00 0.00 C ATOM 1179 CG TYR A 80 104.143 -8.062 7.839 1.00 0.00 C ATOM 1180 CD1 TYR A 80 104.165 -8.800 6.650 1.00 0.00 C ATOM 1181 CD2 TYR A 80 104.840 -6.852 7.927 1.00 0.00 C ATOM 1182 CE1 TYR A 80 104.886 -8.328 5.546 1.00 0.00 C ATOM 1183 CE2 TYR A 80 105.558 -6.377 6.821 1.00 0.00 C ATOM 1184 CZ TYR A 80 105.582 -7.117 5.633 1.00 0.00 C ATOM 1185 OH TYR A 80 106.298 -6.656 4.547 1.00 0.00 O ATOM 0 H TYR A 80 101.275 -8.525 7.055 1.00 0.00 H new ATOM 0 HA TYR A 80 101.483 -8.598 10.000 1.00 0.00 H new ATOM 0 HB2 TYR A 80 103.841 -8.186 9.941 1.00 0.00 H new ATOM 0 HB3 TYR A 80 103.511 -9.673 9.076 1.00 0.00 H new ATOM 0 HD1 TYR A 80 103.626 -9.734 6.584 1.00 0.00 H new ATOM 0 HD2 TYR A 80 104.825 -6.285 8.846 1.00 0.00 H new ATOM 0 HE1 TYR A 80 104.905 -8.898 4.629 1.00 0.00 H new ATOM 0 HE2 TYR A 80 106.092 -5.441 6.885 1.00 0.00 H new ATOM 0 HH TYR A 80 105.695 -6.537 3.784 1.00 0.00 H new ATOM 1195 N GLY A 81 101.512 -6.106 10.064 1.00 0.00 N ATOM 1196 CA GLY A 81 101.253 -4.668 10.076 1.00 0.00 C ATOM 1197 C GLY A 81 102.185 -3.960 11.048 1.00 0.00 C ATOM 1198 O GLY A 81 102.398 -4.435 12.162 1.00 0.00 O ATOM 0 H GLY A 81 101.560 -6.537 10.987 1.00 0.00 H new ATOM 0 HA2 GLY A 81 101.388 -4.261 9.074 1.00 0.00 H new ATOM 0 HA3 GLY A 81 100.217 -4.483 10.358 1.00 0.00 H new ATOM 1202 N VAL A 82 102.712 -2.809 10.638 1.00 0.00 N ATOM 1203 CA VAL A 82 103.714 -2.107 11.434 1.00 0.00 C ATOM 1204 C VAL A 82 103.389 -0.621 11.535 1.00 0.00 C ATOM 1205 O VAL A 82 102.699 -0.066 10.680 1.00 0.00 O ATOM 1206 CB VAL A 82 105.102 -2.271 10.802 1.00 0.00 C ATOM 1207 CG1 VAL A 82 105.508 -3.747 10.800 1.00 0.00 C ATOM 1208 CG2 VAL A 82 105.077 -1.752 9.359 1.00 0.00 C ATOM 0 H VAL A 82 102.463 -2.345 9.764 1.00 0.00 H new ATOM 0 HA VAL A 82 103.708 -2.541 12.434 1.00 0.00 H new ATOM 0 HB VAL A 82 105.824 -1.700 11.386 1.00 0.00 H new ATOM 0 HG11 VAL A 82 106.495 -3.852 10.349 1.00 0.00 H new ATOM 0 HG12 VAL A 82 105.536 -4.118 11.824 1.00 0.00 H new ATOM 0 HG13 VAL A 82 104.783 -4.323 10.225 1.00 0.00 H new ATOM 0 HG21 VAL A 82 106.064 -1.870 8.913 1.00 0.00 H new ATOM 0 HG22 VAL A 82 104.348 -2.319 8.781 1.00 0.00 H new ATOM 0 HG23 VAL A 82 104.801 -0.697 9.356 1.00 0.00 H new ATOM 1218 N VAL A 83 103.912 0.012 12.579 1.00 0.00 N ATOM 1219 CA VAL A 83 103.807 1.459 12.736 1.00 0.00 C ATOM 1220 C VAL A 83 105.193 2.007 13.055 1.00 0.00 C ATOM 1221 O VAL A 83 105.958 1.356 13.769 1.00 0.00 O ATOM 1222 CB VAL A 83 102.812 1.797 13.855 1.00 0.00 C ATOM 1223 CG1 VAL A 83 103.283 1.196 15.182 1.00 0.00 C ATOM 1224 CG2 VAL A 83 102.695 3.317 14.000 1.00 0.00 C ATOM 0 H VAL A 83 104.415 -0.456 13.333 1.00 0.00 H new ATOM 0 HA VAL A 83 103.438 1.915 11.817 1.00 0.00 H new ATOM 0 HB VAL A 83 101.840 1.377 13.598 1.00 0.00 H new ATOM 0 HG11 VAL A 83 102.569 1.443 15.967 1.00 0.00 H new ATOM 0 HG12 VAL A 83 103.356 0.113 15.085 1.00 0.00 H new ATOM 0 HG13 VAL A 83 104.261 1.604 15.439 1.00 0.00 H new ATOM 0 HG21 VAL A 83 101.988 3.553 14.795 1.00 0.00 H new ATOM 0 HG22 VAL A 83 103.671 3.735 14.246 1.00 0.00 H new ATOM 0 HG23 VAL A 83 102.343 3.746 13.062 1.00 0.00 H new ATOM 1234 N GLY A 84 105.536 3.166 12.494 1.00 0.00 N ATOM 1235 CA GLY A 84 106.871 3.712 12.689 1.00 0.00 C ATOM 1236 C GLY A 84 106.861 5.230 12.715 1.00 0.00 C ATOM 1237 O GLY A 84 105.842 5.865 12.449 1.00 0.00 O ATOM 0 H GLY A 84 104.919 3.733 11.912 1.00 0.00 H new ATOM 0 HA2 GLY A 84 107.285 3.335 13.624 1.00 0.00 H new ATOM 0 HA3 GLY A 84 107.526 3.366 11.889 1.00 0.00 H new ATOM 1241 N VAL A 85 108.027 5.800 12.991 1.00 0.00 N ATOM 1242 CA VAL A 85 108.184 7.248 13.001 1.00 0.00 C ATOM 1243 C VAL A 85 109.120 7.647 11.869 1.00 0.00 C ATOM 1244 O VAL A 85 110.158 7.013 11.671 1.00 0.00 O ATOM 1245 CB VAL A 85 108.765 7.712 14.343 1.00 0.00 C ATOM 1246 CG1 VAL A 85 108.846 9.240 14.369 1.00 0.00 C ATOM 1247 CG2 VAL A 85 107.862 7.239 15.488 1.00 0.00 C ATOM 0 H VAL A 85 108.877 5.282 13.211 1.00 0.00 H new ATOM 0 HA VAL A 85 107.211 7.720 12.865 1.00 0.00 H new ATOM 0 HB VAL A 85 109.762 7.289 14.464 1.00 0.00 H new ATOM 0 HG11 VAL A 85 109.259 9.566 15.323 1.00 0.00 H new ATOM 0 HG12 VAL A 85 109.489 9.584 13.559 1.00 0.00 H new ATOM 0 HG13 VAL A 85 107.848 9.659 14.243 1.00 0.00 H new ATOM 0 HG21 VAL A 85 108.278 7.570 16.440 1.00 0.00 H new ATOM 0 HG22 VAL A 85 106.864 7.659 15.362 1.00 0.00 H new ATOM 0 HG23 VAL A 85 107.801 6.151 15.478 1.00 0.00 H new ATOM 1257 N GLY A 86 108.735 8.665 11.104 1.00 0.00 N ATOM 1258 CA GLY A 86 109.576 9.141 10.007 1.00 0.00 C ATOM 1259 C GLY A 86 110.030 10.577 10.244 1.00 0.00 C ATOM 1260 O GLY A 86 109.225 11.439 10.588 1.00 0.00 O ATOM 0 H GLY A 86 107.857 9.172 11.220 1.00 0.00 H new ATOM 0 HA2 GLY A 86 110.447 8.493 9.905 1.00 0.00 H new ATOM 0 HA3 GLY A 86 109.023 9.081 9.069 1.00 0.00 H new ATOM 1264 N TYR A 87 111.328 10.811 10.072 1.00 0.00 N ATOM 1265 CA TYR A 87 111.893 12.152 10.212 1.00 0.00 C ATOM 1266 C TYR A 87 112.513 12.571 8.882 1.00 0.00 C ATOM 1267 O TYR A 87 113.443 11.923 8.411 1.00 0.00 O ATOM 1268 CB TYR A 87 112.986 12.159 11.287 1.00 0.00 C ATOM 1269 CG TYR A 87 112.602 11.465 12.575 1.00 0.00 C ATOM 1270 CD1 TYR A 87 112.818 10.088 12.711 1.00 0.00 C ATOM 1271 CD2 TYR A 87 112.042 12.194 13.629 1.00 0.00 C ATOM 1272 CE1 TYR A 87 112.473 9.439 13.904 1.00 0.00 C ATOM 1273 CE2 TYR A 87 111.696 11.544 14.822 1.00 0.00 C ATOM 1274 CZ TYR A 87 111.913 10.168 14.959 1.00 0.00 C ATOM 1275 OH TYR A 87 111.573 9.529 16.135 1.00 0.00 O ATOM 0 H TYR A 87 112.010 10.090 9.835 1.00 0.00 H new ATOM 0 HA TYR A 87 111.100 12.842 10.500 1.00 0.00 H new ATOM 0 HB2 TYR A 87 113.878 11.681 10.883 1.00 0.00 H new ATOM 0 HB3 TYR A 87 113.252 13.192 11.511 1.00 0.00 H new ATOM 0 HD1 TYR A 87 113.251 9.526 11.896 1.00 0.00 H new ATOM 0 HD2 TYR A 87 111.876 13.256 13.524 1.00 0.00 H new ATOM 0 HE1 TYR A 87 112.639 8.377 14.009 1.00 0.00 H new ATOM 0 HE2 TYR A 87 111.262 12.105 15.636 1.00 0.00 H new ATOM 0 HH TYR A 87 111.198 10.180 16.764 1.00 0.00 H new ATOM 1285 N GLY A 88 112.010 13.652 8.290 1.00 0.00 N ATOM 1286 CA GLY A 88 112.485 14.093 6.978 1.00 0.00 C ATOM 1287 C GLY A 88 112.989 15.534 7.017 1.00 0.00 C ATOM 1288 O GLY A 88 112.505 16.346 7.804 1.00 0.00 O ATOM 0 H GLY A 88 111.278 14.236 8.694 1.00 0.00 H new ATOM 0 HA2 GLY A 88 113.287 13.436 6.641 1.00 0.00 H new ATOM 0 HA3 GLY A 88 111.677 14.009 6.251 1.00 0.00 H new ATOM 1540 N ASP A 104 110.942 17.328 10.184 1.00 0.00 N ATOM 1541 CA ASP A 104 109.497 17.217 10.358 1.00 0.00 C ATOM 1542 C ASP A 104 109.133 15.776 10.694 1.00 0.00 C ATOM 1543 O ASP A 104 109.737 14.846 10.159 1.00 0.00 O ATOM 1544 CB ASP A 104 108.778 17.649 9.078 1.00 0.00 C ATOM 1545 CG ASP A 104 107.274 17.710 9.322 1.00 0.00 C ATOM 1546 OD1 ASP A 104 106.815 18.730 9.812 1.00 0.00 O ATOM 1547 OD2 ASP A 104 106.603 16.740 9.014 1.00 0.00 O ATOM 0 HA ASP A 104 109.185 17.869 11.174 1.00 0.00 H new ATOM 0 HB2 ASP A 104 109.143 18.625 8.757 1.00 0.00 H new ATOM 0 HB3 ASP A 104 108.996 16.947 8.273 1.00 0.00 H new ATOM 1552 N TYR A 105 108.150 15.595 11.572 1.00 0.00 N ATOM 1553 CA TYR A 105 107.776 14.256 12.018 1.00 0.00 C ATOM 1554 C TYR A 105 106.501 13.785 11.326 1.00 0.00 C ATOM 1555 O TYR A 105 105.585 14.573 11.088 1.00 0.00 O ATOM 1556 CB TYR A 105 107.545 14.271 13.529 1.00 0.00 C ATOM 1557 CG TYR A 105 108.705 14.841 14.312 1.00 0.00 C ATOM 1558 CD1 TYR A 105 108.756 16.212 14.588 1.00 0.00 C ATOM 1559 CD2 TYR A 105 109.725 13.997 14.761 1.00 0.00 C ATOM 1560 CE1 TYR A 105 109.830 16.739 15.315 1.00 0.00 C ATOM 1561 CE2 TYR A 105 110.800 14.525 15.489 1.00 0.00 C ATOM 1562 CZ TYR A 105 110.851 15.896 15.765 1.00 0.00 C ATOM 1563 OH TYR A 105 111.909 16.416 16.482 1.00 0.00 O ATOM 0 H TYR A 105 107.603 16.350 11.985 1.00 0.00 H new ATOM 0 HA TYR A 105 108.585 13.572 11.764 1.00 0.00 H new ATOM 0 HB2 TYR A 105 106.650 14.854 13.746 1.00 0.00 H new ATOM 0 HB3 TYR A 105 107.353 13.253 13.869 1.00 0.00 H new ATOM 0 HD1 TYR A 105 107.967 16.863 14.240 1.00 0.00 H new ATOM 0 HD2 TYR A 105 109.685 12.939 14.547 1.00 0.00 H new ATOM 0 HE1 TYR A 105 109.870 17.797 15.528 1.00 0.00 H new ATOM 0 HE2 TYR A 105 111.589 13.874 15.837 1.00 0.00 H new ATOM 0 HH TYR A 105 112.529 15.695 16.719 1.00 0.00 H new ATOM 1573 N GLY A 106 106.445 12.495 11.007 1.00 0.00 N ATOM 1574 CA GLY A 106 105.232 11.912 10.447 1.00 0.00 C ATOM 1575 C GLY A 106 105.022 10.509 10.998 1.00 0.00 C ATOM 1576 O GLY A 106 105.973 9.867 11.436 1.00 0.00 O ATOM 0 H GLY A 106 107.218 11.840 11.125 1.00 0.00 H new ATOM 0 HA2 GLY A 106 104.373 12.538 10.689 1.00 0.00 H new ATOM 0 HA3 GLY A 106 105.305 11.877 9.360 1.00 0.00 H new ATOM 1580 N PHE A 107 103.783 10.028 10.963 1.00 0.00 N ATOM 1581 CA PHE A 107 103.490 8.674 11.421 1.00 0.00 C ATOM 1582 C PHE A 107 103.237 7.775 10.219 1.00 0.00 C ATOM 1583 O PHE A 107 102.386 8.079 9.382 1.00 0.00 O ATOM 1584 CB PHE A 107 102.256 8.683 12.325 1.00 0.00 C ATOM 1585 CG PHE A 107 102.443 9.497 13.583 1.00 0.00 C ATOM 1586 CD1 PHE A 107 103.034 8.920 14.712 1.00 0.00 C ATOM 1587 CD2 PHE A 107 102.023 10.834 13.620 1.00 0.00 C ATOM 1588 CE1 PHE A 107 103.207 9.675 15.878 1.00 0.00 C ATOM 1589 CE2 PHE A 107 102.195 11.589 14.786 1.00 0.00 C ATOM 1590 CZ PHE A 107 102.787 11.011 15.914 1.00 0.00 C ATOM 0 H PHE A 107 102.973 10.549 10.626 1.00 0.00 H new ATOM 0 HA PHE A 107 104.342 8.295 11.986 1.00 0.00 H new ATOM 0 HB2 PHE A 107 101.408 9.080 11.767 1.00 0.00 H new ATOM 0 HB3 PHE A 107 102.007 7.658 12.598 1.00 0.00 H new ATOM 0 HD1 PHE A 107 103.357 7.890 14.684 1.00 0.00 H new ATOM 0 HD2 PHE A 107 101.567 11.281 12.749 1.00 0.00 H new ATOM 0 HE1 PHE A 107 103.664 9.228 16.749 1.00 0.00 H new ATOM 0 HE2 PHE A 107 101.870 12.619 14.815 1.00 0.00 H new ATOM 0 HZ PHE A 107 102.920 11.595 16.813 1.00 0.00 H new ATOM 1600 N SER A 108 103.973 6.668 10.128 1.00 0.00 N ATOM 1601 CA SER A 108 103.815 5.757 8.994 1.00 0.00 C ATOM 1602 C SER A 108 103.156 4.454 9.430 1.00 0.00 C ATOM 1603 O SER A 108 103.510 3.886 10.460 1.00 0.00 O ATOM 1604 CB SER A 108 105.183 5.450 8.385 1.00 0.00 C ATOM 1605 OG SER A 108 105.798 6.667 7.981 1.00 0.00 O ATOM 0 H SER A 108 104.673 6.383 10.813 1.00 0.00 H new ATOM 0 HA SER A 108 103.178 6.241 8.254 1.00 0.00 H new ATOM 0 HB2 SER A 108 105.811 4.935 9.112 1.00 0.00 H new ATOM 0 HB3 SER A 108 105.073 4.783 7.530 1.00 0.00 H new ATOM 0 HG SER A 108 106.677 6.476 7.591 1.00 0.00 H new ATOM 1611 N TYR A 109 102.190 3.994 8.639 1.00 0.00 N ATOM 1612 CA TYR A 109 101.554 2.701 8.878 1.00 0.00 C ATOM 1613 C TYR A 109 101.623 1.868 7.605 1.00 0.00 C ATOM 1614 O TYR A 109 101.390 2.398 6.521 1.00 0.00 O ATOM 1615 CB TYR A 109 100.092 2.901 9.280 1.00 0.00 C ATOM 1616 CG TYR A 109 99.911 3.747 10.517 1.00 0.00 C ATOM 1617 CD1 TYR A 109 99.976 3.157 11.786 1.00 0.00 C ATOM 1618 CD2 TYR A 109 99.676 5.121 10.396 1.00 0.00 C ATOM 1619 CE1 TYR A 109 99.807 3.942 12.932 1.00 0.00 C ATOM 1620 CE2 TYR A 109 99.507 5.907 11.543 1.00 0.00 C ATOM 1621 CZ TYR A 109 99.572 5.317 12.811 1.00 0.00 C ATOM 1622 OH TYR A 109 99.405 6.091 13.941 1.00 0.00 O ATOM 0 H TYR A 109 101.831 4.497 7.828 1.00 0.00 H new ATOM 0 HA TYR A 109 102.075 2.187 9.686 1.00 0.00 H new ATOM 0 HB2 TYR A 109 99.557 3.366 8.452 1.00 0.00 H new ATOM 0 HB3 TYR A 109 99.634 1.926 9.448 1.00 0.00 H new ATOM 0 HD1 TYR A 109 100.157 2.096 11.880 1.00 0.00 H new ATOM 0 HD2 TYR A 109 99.625 5.576 9.418 1.00 0.00 H new ATOM 0 HE1 TYR A 109 99.858 3.487 13.910 1.00 0.00 H new ATOM 0 HE2 TYR A 109 99.327 6.968 11.449 1.00 0.00 H new ATOM 0 HH TYR A 109 99.252 7.023 13.679 1.00 0.00 H new ATOM 1632 N GLY A 110 101.941 0.581 7.726 1.00 0.00 N ATOM 1633 CA GLY A 110 102.082 -0.257 6.538 1.00 0.00 C ATOM 1634 C GLY A 110 101.627 -1.687 6.795 1.00 0.00 C ATOM 1635 O GLY A 110 101.590 -2.141 7.938 1.00 0.00 O ATOM 0 H GLY A 110 102.103 0.104 8.613 1.00 0.00 H new ATOM 0 HA2 GLY A 110 101.498 0.169 5.722 1.00 0.00 H new ATOM 0 HA3 GLY A 110 103.124 -0.260 6.217 1.00 0.00 H new ATOM 1639 N ALA A 111 101.299 -2.388 5.717 1.00 0.00 N ATOM 1640 CA ALA A 111 100.934 -3.797 5.814 1.00 0.00 C ATOM 1641 C ALA A 111 101.403 -4.532 4.567 1.00 0.00 C ATOM 1642 O ALA A 111 101.444 -3.950 3.482 1.00 0.00 O ATOM 1643 CB ALA A 111 99.418 -3.940 5.959 1.00 0.00 C ATOM 0 H ALA A 111 101.278 -2.008 4.771 1.00 0.00 H new ATOM 0 HA ALA A 111 101.414 -4.229 6.692 1.00 0.00 H new ATOM 0 HB1 ALA A 111 99.157 -4.996 6.030 1.00 0.00 H new ATOM 0 HB2 ALA A 111 99.088 -3.423 6.860 1.00 0.00 H new ATOM 0 HB3 ALA A 111 98.927 -3.503 5.090 1.00 0.00 H new ATOM 1649 N GLY A 112 101.743 -5.807 4.718 1.00 0.00 N ATOM 1650 CA GLY A 112 102.254 -6.575 3.587 1.00 0.00 C ATOM 1651 C GLY A 112 101.887 -8.049 3.684 1.00 0.00 C ATOM 1652 O GLY A 112 101.501 -8.538 4.747 1.00 0.00 O ATOM 0 H GLY A 112 101.676 -6.324 5.595 1.00 0.00 H new ATOM 0 HA2 GLY A 112 101.856 -6.163 2.660 1.00 0.00 H new ATOM 0 HA3 GLY A 112 103.338 -6.474 3.541 1.00 0.00 H new ATOM 1656 N LEU A 113 102.034 -8.740 2.557 1.00 0.00 N ATOM 1657 CA LEU A 113 101.775 -10.173 2.486 1.00 0.00 C ATOM 1658 C LEU A 113 103.096 -10.912 2.331 1.00 0.00 C ATOM 1659 O LEU A 113 104.018 -10.394 1.699 1.00 0.00 O ATOM 1660 CB LEU A 113 100.857 -10.493 1.302 1.00 0.00 C ATOM 1661 CG LEU A 113 99.557 -9.696 1.416 1.00 0.00 C ATOM 1662 CD1 LEU A 113 98.694 -9.948 0.177 1.00 0.00 C ATOM 1663 CD2 LEU A 113 98.785 -10.140 2.662 1.00 0.00 C ATOM 0 H LEU A 113 102.334 -8.326 1.674 1.00 0.00 H new ATOM 0 HA LEU A 113 101.279 -10.493 3.403 1.00 0.00 H new ATOM 0 HB2 LEU A 113 101.360 -10.251 0.366 1.00 0.00 H new ATOM 0 HB3 LEU A 113 100.638 -11.560 1.280 1.00 0.00 H new ATOM 0 HG LEU A 113 99.794 -8.635 1.493 1.00 0.00 H new ATOM 0 HD11 LEU A 113 97.767 -9.380 0.258 1.00 0.00 H new ATOM 0 HD12 LEU A 113 99.236 -9.633 -0.714 1.00 0.00 H new ATOM 0 HD13 LEU A 113 98.463 -11.011 0.104 1.00 0.00 H new ATOM 0 HD21 LEU A 113 97.859 -9.569 2.739 1.00 0.00 H new ATOM 0 HD22 LEU A 113 98.551 -11.202 2.586 1.00 0.00 H new ATOM 0 HD23 LEU A 113 99.394 -9.965 3.549 1.00 0.00 H new ATOM 1675 N GLN A 114 103.192 -12.116 2.896 1.00 0.00 N ATOM 1676 CA GLN A 114 104.464 -12.836 2.899 1.00 0.00 C ATOM 1677 C GLN A 114 104.275 -14.306 2.549 1.00 0.00 C ATOM 1678 O GLN A 114 103.405 -14.983 3.099 1.00 0.00 O ATOM 1679 CB GLN A 114 105.119 -12.718 4.278 1.00 0.00 C ATOM 1680 CG GLN A 114 106.526 -13.323 4.236 1.00 0.00 C ATOM 1681 CD GLN A 114 107.225 -13.173 5.588 1.00 0.00 C ATOM 1682 OE1 GLN A 114 106.727 -12.494 6.489 1.00 0.00 O ATOM 1683 NE2 GLN A 114 108.367 -13.774 5.786 1.00 0.00 N ATOM 0 H GLN A 114 102.420 -12.605 3.349 1.00 0.00 H new ATOM 0 HA GLN A 114 105.106 -12.388 2.141 1.00 0.00 H new ATOM 0 HB2 GLN A 114 105.172 -11.671 4.578 1.00 0.00 H new ATOM 0 HB3 GLN A 114 104.514 -13.233 5.024 1.00 0.00 H new ATOM 0 HG2 GLN A 114 106.465 -14.378 3.969 1.00 0.00 H new ATOM 0 HG3 GLN A 114 107.115 -12.832 3.461 1.00 0.00 H new ATOM 0 HE21 GLN A 114 108.783 -14.337 5.044 1.00 0.00 H new ATOM 0 HE22 GLN A 114 108.844 -13.681 6.683 1.00 0.00 H new ATOM 1692 N PHE A 115 105.101 -14.790 1.628 1.00 0.00 N ATOM 1693 CA PHE A 115 105.137 -16.210 1.306 1.00 0.00 C ATOM 1694 C PHE A 115 106.589 -16.629 1.154 1.00 0.00 C ATOM 1695 O PHE A 115 107.325 -16.021 0.376 1.00 0.00 O ATOM 1696 CB PHE A 115 104.377 -16.491 0.009 1.00 0.00 C ATOM 1697 CG PHE A 115 104.406 -17.945 -0.399 1.00 0.00 C ATOM 1698 CD1 PHE A 115 103.607 -18.878 0.273 1.00 0.00 C ATOM 1699 CD2 PHE A 115 105.232 -18.360 -1.450 1.00 0.00 C ATOM 1700 CE1 PHE A 115 103.635 -20.225 -0.106 1.00 0.00 C ATOM 1701 CE2 PHE A 115 105.261 -19.707 -1.830 1.00 0.00 C ATOM 1702 CZ PHE A 115 104.461 -20.640 -1.158 1.00 0.00 C ATOM 0 H PHE A 115 105.754 -14.219 1.092 1.00 0.00 H new ATOM 0 HA PHE A 115 104.660 -16.777 2.105 1.00 0.00 H new ATOM 0 HB2 PHE A 115 103.341 -16.175 0.128 1.00 0.00 H new ATOM 0 HB3 PHE A 115 104.804 -15.888 -0.792 1.00 0.00 H new ATOM 0 HD1 PHE A 115 102.969 -18.558 1.084 1.00 0.00 H new ATOM 0 HD2 PHE A 115 105.848 -17.640 -1.968 1.00 0.00 H new ATOM 0 HE1 PHE A 115 103.019 -20.945 0.413 1.00 0.00 H new ATOM 0 HE2 PHE A 115 105.899 -20.026 -2.640 1.00 0.00 H new ATOM 0 HZ PHE A 115 104.481 -21.679 -1.451 1.00 0.00 H new ATOM 1712 N ASN A 116 107.016 -17.649 1.898 1.00 0.00 N ATOM 1713 CA ASN A 116 108.434 -17.998 1.930 1.00 0.00 C ATOM 1714 C ASN A 116 108.674 -19.504 1.778 1.00 0.00 C ATOM 1715 O ASN A 116 108.134 -20.297 2.549 1.00 0.00 O ATOM 1716 CB ASN A 116 109.017 -17.556 3.274 1.00 0.00 C ATOM 1717 CG ASN A 116 108.264 -18.225 4.419 1.00 0.00 C ATOM 1718 OD1 ASN A 116 107.187 -17.772 4.807 1.00 0.00 O ATOM 1719 ND2 ASN A 116 108.769 -19.287 4.986 1.00 0.00 N ATOM 0 H ASN A 116 106.414 -18.237 2.475 1.00 0.00 H new ATOM 0 HA ASN A 116 108.914 -17.494 1.091 1.00 0.00 H new ATOM 0 HB2 ASN A 116 110.074 -17.816 3.323 1.00 0.00 H new ATOM 0 HB3 ASN A 116 108.950 -16.472 3.369 1.00 0.00 H new ATOM 0 HD21 ASN A 116 108.271 -19.742 5.751 1.00 0.00 H new ATOM 0 HD22 ASN A 116 109.661 -19.662 4.664 1.00 0.00 H new ATOM 1726 N PRO A 117 109.464 -19.915 0.815 1.00 0.00 N ATOM 1727 CA PRO A 117 110.135 -21.239 0.842 1.00 0.00 C ATOM 1728 C PRO A 117 111.568 -21.077 1.341 1.00 0.00 C ATOM 1729 O PRO A 117 112.020 -19.956 1.580 1.00 0.00 O ATOM 1730 CB PRO A 117 110.096 -21.702 -0.621 1.00 0.00 C ATOM 1731 CG PRO A 117 109.749 -20.496 -1.441 1.00 0.00 C ATOM 1732 CD PRO A 117 109.717 -19.296 -0.493 1.00 0.00 C ATOM 0 HA PRO A 117 109.658 -21.958 1.508 1.00 0.00 H new ATOM 0 HB2 PRO A 117 111.059 -22.113 -0.924 1.00 0.00 H new ATOM 0 HB3 PRO A 117 109.356 -22.490 -0.759 1.00 0.00 H new ATOM 0 HG2 PRO A 117 110.485 -20.343 -2.230 1.00 0.00 H new ATOM 0 HG3 PRO A 117 108.783 -20.627 -1.928 1.00 0.00 H new ATOM 0 HD2 PRO A 117 110.659 -18.747 -0.504 1.00 0.00 H new ATOM 0 HD3 PRO A 117 108.933 -18.589 -0.763 1.00 0.00 H new ATOM 1740 N MET A 118 112.279 -22.185 1.497 1.00 0.00 N ATOM 1741 CA MET A 118 113.637 -22.138 2.028 1.00 0.00 C ATOM 1742 C MET A 118 114.531 -21.214 1.202 1.00 0.00 C ATOM 1743 O MET A 118 114.383 -21.107 -0.015 1.00 0.00 O ATOM 1744 CB MET A 118 114.234 -23.548 2.034 1.00 0.00 C ATOM 1745 CG MET A 118 115.497 -23.567 2.895 1.00 0.00 C ATOM 1746 SD MET A 118 116.327 -25.166 2.717 1.00 0.00 S ATOM 1747 CE MET A 118 114.989 -26.194 3.373 1.00 0.00 C ATOM 0 H MET A 118 111.943 -23.120 1.266 1.00 0.00 H new ATOM 0 HA MET A 118 113.587 -21.745 3.044 1.00 0.00 H new ATOM 0 HB2 MET A 118 113.506 -24.260 2.423 1.00 0.00 H new ATOM 0 HB3 MET A 118 114.471 -23.858 1.016 1.00 0.00 H new ATOM 0 HG2 MET A 118 116.167 -22.762 2.594 1.00 0.00 H new ATOM 0 HG3 MET A 118 115.240 -23.393 3.940 1.00 0.00 H new ATOM 0 HE1 MET A 118 115.412 -27.052 3.895 1.00 0.00 H new ATOM 0 HE2 MET A 118 114.387 -25.608 4.067 1.00 0.00 H new ATOM 0 HE3 MET A 118 114.361 -26.541 2.552 1.00 0.00 H new ATOM 1757 N GLU A 119 115.466 -20.546 1.887 1.00 0.00 N ATOM 1758 CA GLU A 119 116.524 -19.754 1.248 1.00 0.00 C ATOM 1759 C GLU A 119 115.965 -18.430 0.682 1.00 0.00 C ATOM 1760 O GLU A 119 114.921 -17.960 1.132 1.00 0.00 O ATOM 1761 CB GLU A 119 117.232 -20.606 0.170 1.00 0.00 C ATOM 1762 CG GLU A 119 118.738 -20.297 0.122 1.00 0.00 C ATOM 1763 CD GLU A 119 119.439 -21.041 -1.021 1.00 0.00 C ATOM 1764 OE1 GLU A 119 118.792 -21.812 -1.717 1.00 0.00 O ATOM 1765 OE2 GLU A 119 120.627 -20.825 -1.185 1.00 0.00 O ATOM 0 H GLU A 119 115.511 -20.539 2.906 1.00 0.00 H new ATOM 0 HA GLU A 119 117.267 -19.476 1.996 1.00 0.00 H new ATOM 0 HB2 GLU A 119 117.081 -21.665 0.382 1.00 0.00 H new ATOM 0 HB3 GLU A 119 116.786 -20.409 -0.805 1.00 0.00 H new ATOM 0 HG2 GLU A 119 118.885 -19.224 0.000 1.00 0.00 H new ATOM 0 HG3 GLU A 119 119.196 -20.576 1.071 1.00 0.00 H new ATOM 1772 N ASN A 120 116.651 -17.836 -0.303 1.00 0.00 N ATOM 1773 CA ASN A 120 116.349 -16.493 -0.814 1.00 0.00 C ATOM 1774 C ASN A 120 114.954 -16.360 -1.436 1.00 0.00 C ATOM 1775 O ASN A 120 114.502 -15.247 -1.707 1.00 0.00 O ATOM 1776 CB ASN A 120 117.398 -16.104 -1.858 1.00 0.00 C ATOM 1777 CG ASN A 120 118.791 -16.147 -1.239 1.00 0.00 C ATOM 1778 OD1 ASN A 120 119.717 -16.695 -1.836 1.00 0.00 O ATOM 1779 ND2 ASN A 120 118.996 -15.596 -0.074 1.00 0.00 N ATOM 0 H ASN A 120 117.440 -18.280 -0.773 1.00 0.00 H new ATOM 0 HA ASN A 120 116.371 -15.825 0.047 1.00 0.00 H new ATOM 0 HB2 ASN A 120 117.347 -16.785 -2.708 1.00 0.00 H new ATOM 0 HB3 ASN A 120 117.191 -15.104 -2.238 1.00 0.00 H new ATOM 0 HD21 ASN A 120 119.926 -15.619 0.344 1.00 0.00 H new ATOM 0 HD22 ASN A 120 118.226 -15.143 0.418 1.00 0.00 H new ATOM 1786 N VAL A 121 114.273 -17.479 -1.660 1.00 0.00 N ATOM 1787 CA VAL A 121 113.094 -17.524 -2.529 1.00 0.00 C ATOM 1788 C VAL A 121 111.829 -16.986 -1.832 1.00 0.00 C ATOM 1789 O VAL A 121 110.715 -17.233 -2.298 1.00 0.00 O ATOM 1790 CB VAL A 121 112.849 -18.964 -3.044 1.00 0.00 C ATOM 1791 CG1 VAL A 121 111.853 -18.944 -4.214 1.00 0.00 C ATOM 1792 CG2 VAL A 121 114.155 -19.614 -3.538 1.00 0.00 C ATOM 0 H VAL A 121 114.519 -18.379 -1.248 1.00 0.00 H new ATOM 0 HA VAL A 121 113.301 -16.870 -3.376 1.00 0.00 H new ATOM 0 HB VAL A 121 112.451 -19.543 -2.211 1.00 0.00 H new ATOM 0 HG11 VAL A 121 111.688 -19.961 -4.569 1.00 0.00 H new ATOM 0 HG12 VAL A 121 110.907 -18.518 -3.879 1.00 0.00 H new ATOM 0 HG13 VAL A 121 112.257 -18.338 -5.025 1.00 0.00 H new ATOM 0 HG21 VAL A 121 113.948 -20.624 -3.892 1.00 0.00 H new ATOM 0 HG22 VAL A 121 114.571 -19.022 -4.353 1.00 0.00 H new ATOM 0 HG23 VAL A 121 114.872 -19.657 -2.719 1.00 0.00 H new ATOM 1802 N ALA A 122 111.973 -16.230 -0.734 1.00 0.00 N ATOM 1803 CA ALA A 122 110.805 -15.730 -0.008 1.00 0.00 C ATOM 1804 C ALA A 122 110.595 -14.246 -0.304 1.00 0.00 C ATOM 1805 O ALA A 122 111.547 -13.470 -0.308 1.00 0.00 O ATOM 1806 CB ALA A 122 111.028 -15.911 1.495 1.00 0.00 C ATOM 0 H ALA A 122 112.872 -15.957 -0.337 1.00 0.00 H new ATOM 0 HA ALA A 122 109.925 -16.288 -0.327 1.00 0.00 H new ATOM 0 HB1 ALA A 122 110.160 -15.539 2.039 1.00 0.00 H new ATOM 0 HB2 ALA A 122 111.170 -16.969 1.717 1.00 0.00 H new ATOM 0 HB3 ALA A 122 111.913 -15.354 1.801 1.00 0.00 H new ATOM 1812 N LEU A 123 109.339 -13.865 -0.548 1.00 0.00 N ATOM 1813 CA LEU A 123 109.024 -12.518 -1.025 1.00 0.00 C ATOM 1814 C LEU A 123 107.999 -11.843 -0.117 1.00 0.00 C ATOM 1815 O LEU A 123 107.114 -12.501 0.430 1.00 0.00 O ATOM 1816 CB LEU A 123 108.468 -12.599 -2.459 1.00 0.00 C ATOM 1817 CG LEU A 123 109.578 -12.523 -3.521 1.00 0.00 C ATOM 1818 CD1 LEU A 123 110.229 -11.139 -3.499 1.00 0.00 C ATOM 1819 CD2 LEU A 123 110.644 -13.601 -3.285 1.00 0.00 C ATOM 0 H LEU A 123 108.526 -14.469 -0.423 1.00 0.00 H new ATOM 0 HA LEU A 123 109.938 -11.924 -1.013 1.00 0.00 H new ATOM 0 HB2 LEU A 123 107.916 -13.531 -2.580 1.00 0.00 H new ATOM 0 HB3 LEU A 123 107.760 -11.786 -2.618 1.00 0.00 H new ATOM 0 HG LEU A 123 109.125 -12.697 -4.497 1.00 0.00 H new ATOM 0 HD11 LEU A 123 111.014 -11.094 -4.254 1.00 0.00 H new ATOM 0 HD12 LEU A 123 109.477 -10.380 -3.712 1.00 0.00 H new ATOM 0 HD13 LEU A 123 110.661 -10.956 -2.515 1.00 0.00 H new ATOM 0 HD21 LEU A 123 111.416 -13.523 -4.051 1.00 0.00 H new ATOM 0 HD22 LEU A 123 111.093 -13.460 -2.302 1.00 0.00 H new ATOM 0 HD23 LEU A 123 110.182 -14.587 -3.335 1.00 0.00 H new ATOM 1831 N ASP A 124 108.128 -10.525 0.028 1.00 0.00 N ATOM 1832 CA ASP A 124 107.155 -9.742 0.783 1.00 0.00 C ATOM 1833 C ASP A 124 106.831 -8.445 0.047 1.00 0.00 C ATOM 1834 O ASP A 124 107.724 -7.804 -0.505 1.00 0.00 O ATOM 1835 CB ASP A 124 107.705 -9.430 2.180 1.00 0.00 C ATOM 1836 CG ASP A 124 108.963 -8.563 2.093 1.00 0.00 C ATOM 1837 OD1 ASP A 124 109.662 -8.654 1.098 1.00 0.00 O ATOM 1838 OD2 ASP A 124 109.207 -7.821 3.030 1.00 0.00 O ATOM 0 H ASP A 124 108.895 -9.980 -0.366 1.00 0.00 H new ATOM 0 HA ASP A 124 106.239 -10.324 0.883 1.00 0.00 H new ATOM 0 HB2 ASP A 124 106.945 -8.916 2.768 1.00 0.00 H new ATOM 0 HB3 ASP A 124 107.935 -10.360 2.700 1.00 0.00 H new ATOM 1843 N PHE A 125 105.549 -8.075 0.028 1.00 0.00 N ATOM 1844 CA PHE A 125 105.126 -6.829 -0.611 1.00 0.00 C ATOM 1845 C PHE A 125 104.277 -6.013 0.356 1.00 0.00 C ATOM 1846 O PHE A 125 103.377 -6.557 0.993 1.00 0.00 O ATOM 1847 CB PHE A 125 104.314 -7.137 -1.871 1.00 0.00 C ATOM 1848 CG PHE A 125 105.099 -7.883 -2.924 1.00 0.00 C ATOM 1849 CD1 PHE A 125 105.887 -7.177 -3.840 1.00 0.00 C ATOM 1850 CD2 PHE A 125 105.039 -9.281 -2.982 1.00 0.00 C ATOM 1851 CE1 PHE A 125 106.616 -7.871 -4.816 1.00 0.00 C ATOM 1852 CE2 PHE A 125 105.768 -9.973 -3.957 1.00 0.00 C ATOM 1853 CZ PHE A 125 106.556 -9.268 -4.873 1.00 0.00 C ATOM 0 H PHE A 125 104.791 -8.616 0.445 1.00 0.00 H new ATOM 0 HA PHE A 125 106.011 -6.255 -0.886 1.00 0.00 H new ATOM 0 HB2 PHE A 125 103.439 -7.726 -1.595 1.00 0.00 H new ATOM 0 HB3 PHE A 125 103.948 -6.202 -2.296 1.00 0.00 H new ATOM 0 HD1 PHE A 125 105.934 -6.099 -3.795 1.00 0.00 H new ATOM 0 HD2 PHE A 125 104.431 -9.825 -2.275 1.00 0.00 H new ATOM 0 HE1 PHE A 125 107.224 -7.327 -5.524 1.00 0.00 H new ATOM 0 HE2 PHE A 125 105.722 -11.051 -4.002 1.00 0.00 H new ATOM 0 HZ PHE A 125 107.118 -9.802 -5.625 1.00 0.00 H new ATOM 1863 N SER A 126 104.553 -4.713 0.463 1.00 0.00 N ATOM 1864 CA SER A 126 103.850 -3.880 1.440 1.00 0.00 C ATOM 1865 C SER A 126 103.506 -2.506 0.877 1.00 0.00 C ATOM 1866 O SER A 126 104.172 -2.011 -0.030 1.00 0.00 O ATOM 1867 CB SER A 126 104.711 -3.706 2.690 1.00 0.00 C ATOM 1868 OG SER A 126 105.034 -4.985 3.212 1.00 0.00 O ATOM 0 H SER A 126 105.245 -4.221 -0.103 1.00 0.00 H new ATOM 0 HA SER A 126 102.918 -4.388 1.689 1.00 0.00 H new ATOM 0 HB2 SER A 126 105.621 -3.158 2.446 1.00 0.00 H new ATOM 0 HB3 SER A 126 104.176 -3.119 3.437 1.00 0.00 H new ATOM 0 HG SER A 126 105.397 -4.887 4.117 1.00 0.00 H new ATOM 1874 N TYR A 127 102.457 -1.903 1.431 1.00 0.00 N ATOM 1875 CA TYR A 127 102.088 -0.534 1.096 1.00 0.00 C ATOM 1876 C TYR A 127 102.045 0.290 2.379 1.00 0.00 C ATOM 1877 O TYR A 127 101.628 -0.212 3.421 1.00 0.00 O ATOM 1878 CB TYR A 127 100.718 -0.506 0.417 1.00 0.00 C ATOM 1879 CG TYR A 127 100.659 -1.320 -0.854 1.00 0.00 C ATOM 1880 CD1 TYR A 127 101.138 -0.781 -2.053 1.00 0.00 C ATOM 1881 CD2 TYR A 127 100.127 -2.615 -0.834 1.00 0.00 C ATOM 1882 CE1 TYR A 127 101.084 -1.535 -3.232 1.00 0.00 C ATOM 1883 CE2 TYR A 127 100.072 -3.370 -2.012 1.00 0.00 C ATOM 1884 CZ TYR A 127 100.550 -2.829 -3.211 1.00 0.00 C ATOM 1885 OH TYR A 127 100.497 -3.573 -4.373 1.00 0.00 O ATOM 0 H TYR A 127 101.846 -2.346 2.117 1.00 0.00 H new ATOM 0 HA TYR A 127 102.823 -0.116 0.409 1.00 0.00 H new ATOM 0 HB2 TYR A 127 99.968 -0.880 1.114 1.00 0.00 H new ATOM 0 HB3 TYR A 127 100.455 0.527 0.190 1.00 0.00 H new ATOM 0 HD1 TYR A 127 101.550 0.217 -2.069 1.00 0.00 H new ATOM 0 HD2 TYR A 127 99.758 -3.032 0.091 1.00 0.00 H new ATOM 0 HE1 TYR A 127 101.454 -1.118 -4.157 1.00 0.00 H new ATOM 0 HE2 TYR A 127 99.661 -4.369 -1.995 1.00 0.00 H new ATOM 0 HH TYR A 127 100.099 -4.448 -4.183 1.00 0.00 H new ATOM 1895 N GLU A 128 102.495 1.542 2.307 1.00 0.00 N ATOM 1896 CA GLU A 128 102.546 2.400 3.488 1.00 0.00 C ATOM 1897 C GLU A 128 101.780 3.693 3.238 1.00 0.00 C ATOM 1898 O GLU A 128 101.698 4.172 2.108 1.00 0.00 O ATOM 1899 CB GLU A 128 103.999 2.731 3.832 1.00 0.00 C ATOM 1900 CG GLU A 128 104.765 1.439 4.136 1.00 0.00 C ATOM 1901 CD GLU A 128 106.205 1.720 4.574 1.00 0.00 C ATOM 1902 OE1 GLU A 128 106.657 2.851 4.454 1.00 0.00 O ATOM 1903 OE2 GLU A 128 106.845 0.787 5.029 1.00 0.00 O ATOM 0 H GLU A 128 102.827 1.982 1.449 1.00 0.00 H new ATOM 0 HA GLU A 128 102.087 1.868 4.321 1.00 0.00 H new ATOM 0 HB2 GLU A 128 104.469 3.257 3.001 1.00 0.00 H new ATOM 0 HB3 GLU A 128 104.036 3.398 4.693 1.00 0.00 H new ATOM 0 HG2 GLU A 128 104.248 0.886 4.920 1.00 0.00 H new ATOM 0 HG3 GLU A 128 104.772 0.804 3.250 1.00 0.00 H new ATOM 1910 N GLN A 129 101.217 4.253 4.306 1.00 0.00 N ATOM 1911 CA GLN A 129 100.452 5.488 4.205 1.00 0.00 C ATOM 1912 C GLN A 129 100.955 6.511 5.216 1.00 0.00 C ATOM 1913 O GLN A 129 101.234 6.176 6.368 1.00 0.00 O ATOM 1914 CB GLN A 129 98.970 5.203 4.459 1.00 0.00 C ATOM 1915 CG GLN A 129 98.148 6.462 4.177 1.00 0.00 C ATOM 1916 CD GLN A 129 98.043 6.691 2.673 1.00 0.00 C ATOM 1917 OE1 GLN A 129 97.451 5.880 1.960 1.00 0.00 O ATOM 1918 NE2 GLN A 129 98.584 7.754 2.143 1.00 0.00 N ATOM 0 H GLN A 129 101.277 3.870 5.249 1.00 0.00 H new ATOM 0 HA GLN A 129 100.578 5.893 3.201 1.00 0.00 H new ATOM 0 HB2 GLN A 129 98.632 4.386 3.821 1.00 0.00 H new ATOM 0 HB3 GLN A 129 98.823 4.884 5.491 1.00 0.00 H new ATOM 0 HG2 GLN A 129 97.152 6.360 4.608 1.00 0.00 H new ATOM 0 HG3 GLN A 129 98.614 7.325 4.653 1.00 0.00 H new ATOM 0 HE21 GLN A 129 99.074 8.425 2.734 1.00 0.00 H new ATOM 0 HE22 GLN A 129 98.517 7.913 1.138 1.00 0.00 H new ATOM 1927 N SER A 130 101.093 7.747 4.750 1.00 0.00 N ATOM 1928 CA SER A 130 101.407 8.878 5.613 1.00 0.00 C ATOM 1929 C SER A 130 100.224 9.833 5.580 1.00 0.00 C ATOM 1930 O SER A 130 99.696 10.104 4.497 1.00 0.00 O ATOM 1931 CB SER A 130 102.667 9.606 5.148 1.00 0.00 C ATOM 1932 OG SER A 130 103.684 8.651 4.873 1.00 0.00 O ATOM 0 H SER A 130 100.990 7.992 3.765 1.00 0.00 H new ATOM 0 HA SER A 130 101.593 8.517 6.624 1.00 0.00 H new ATOM 0 HB2 SER A 130 102.453 10.194 4.256 1.00 0.00 H new ATOM 0 HB3 SER A 130 103.003 10.302 5.916 1.00 0.00 H new ATOM 0 HG SER A 130 104.494 9.113 4.573 1.00 0.00 H new ATOM 1938 N ARG A 131 99.945 10.471 6.711 1.00 0.00 N ATOM 1939 CA ARG A 131 98.629 11.046 6.976 1.00 0.00 C ATOM 1940 C ARG A 131 98.586 12.475 6.460 1.00 0.00 C ATOM 1941 O ARG A 131 99.586 13.194 6.495 1.00 0.00 O ATOM 1942 CB ARG A 131 98.339 11.028 8.478 1.00 0.00 C ATOM 1943 CG ARG A 131 96.903 11.489 8.728 1.00 0.00 C ATOM 1944 CD ARG A 131 96.633 11.529 10.234 1.00 0.00 C ATOM 1945 NE ARG A 131 95.226 11.850 10.489 1.00 0.00 N ATOM 1946 CZ ARG A 131 94.762 12.241 11.685 1.00 0.00 C ATOM 1947 NH1 ARG A 131 95.540 12.366 12.732 1.00 0.00 N ATOM 1948 NH2 ARG A 131 93.489 12.505 11.812 1.00 0.00 N ATOM 0 H ARG A 131 100.618 10.604 7.466 1.00 0.00 H new ATOM 0 HA ARG A 131 97.871 10.453 6.465 1.00 0.00 H new ATOM 0 HB2 ARG A 131 98.483 10.023 8.875 1.00 0.00 H new ATOM 0 HB3 ARG A 131 99.038 11.681 9.001 1.00 0.00 H new ATOM 0 HG2 ARG A 131 96.746 12.476 8.294 1.00 0.00 H new ATOM 0 HG3 ARG A 131 96.202 10.811 8.240 1.00 0.00 H new ATOM 0 HD2 ARG A 131 96.880 10.566 10.681 1.00 0.00 H new ATOM 0 HD3 ARG A 131 97.274 12.273 10.706 1.00 0.00 H new ATOM 0 HE ARG A 131 94.565 11.772 9.716 1.00 0.00 H new ATOM 0 HH11 ARG A 131 96.537 12.163 12.654 1.00 0.00 H new ATOM 0 HH12 ARG A 131 95.149 12.666 13.625 1.00 0.00 H new ATOM 0 HH21 ARG A 131 92.866 12.412 11.009 1.00 0.00 H new ATOM 0 HH22 ARG A 131 93.118 12.804 12.714 1.00 0.00 H new ATOM 1962 N ILE A 132 97.413 12.879 5.980 1.00 0.00 N ATOM 1963 CA ILE A 132 97.352 13.826 4.878 1.00 0.00 C ATOM 1964 C ILE A 132 97.368 15.291 5.325 1.00 0.00 C ATOM 1965 O ILE A 132 96.370 15.890 5.728 1.00 0.00 O ATOM 1966 CB ILE A 132 96.107 13.524 4.023 1.00 0.00 C ATOM 1967 CG1 ILE A 132 96.091 14.428 2.785 1.00 0.00 C ATOM 1968 CG2 ILE A 132 94.817 13.729 4.826 1.00 0.00 C ATOM 1969 CD1 ILE A 132 95.239 13.783 1.691 1.00 0.00 C ATOM 0 H ILE A 132 96.507 12.570 6.332 1.00 0.00 H new ATOM 0 HA ILE A 132 98.258 13.695 4.286 1.00 0.00 H new ATOM 0 HB ILE A 132 96.156 12.480 3.715 1.00 0.00 H new ATOM 0 HG12 ILE A 132 95.689 15.408 3.043 1.00 0.00 H new ATOM 0 HG13 ILE A 132 97.107 14.585 2.424 1.00 0.00 H new ATOM 0 HG21 ILE A 132 93.956 13.508 4.195 1.00 0.00 H new ATOM 0 HG22 ILE A 132 94.815 13.062 5.688 1.00 0.00 H new ATOM 0 HG23 ILE A 132 94.761 14.763 5.167 1.00 0.00 H new ATOM 0 HD11 ILE A 132 95.228 14.427 0.811 1.00 0.00 H new ATOM 0 HD12 ILE A 132 95.660 12.813 1.426 1.00 0.00 H new ATOM 0 HD13 ILE A 132 94.220 13.649 2.055 1.00 0.00 H new ATOM 1981 N ARG A 133 98.580 15.822 5.253 1.00 0.00 N ATOM 1982 CA ARG A 133 98.837 17.252 5.156 1.00 0.00 C ATOM 1983 C ARG A 133 98.866 17.614 3.669 1.00 0.00 C ATOM 1984 O ARG A 133 98.603 16.761 2.813 1.00 0.00 O ATOM 1985 CB ARG A 133 100.177 17.601 5.808 1.00 0.00 C ATOM 1986 CG ARG A 133 100.110 17.303 7.307 1.00 0.00 C ATOM 1987 CD ARG A 133 101.402 17.766 7.985 1.00 0.00 C ATOM 1988 NE ARG A 133 102.563 17.118 7.366 1.00 0.00 N ATOM 1989 CZ ARG A 133 103.833 17.414 7.682 1.00 0.00 C ATOM 1990 NH1 ARG A 133 104.136 18.316 8.584 1.00 0.00 N ATOM 1991 NH2 ARG A 133 104.798 16.782 7.073 1.00 0.00 N ATOM 0 H ARG A 133 99.430 15.259 5.261 1.00 0.00 H new ATOM 0 HA ARG A 133 98.059 17.813 5.675 1.00 0.00 H new ATOM 0 HB2 ARG A 133 100.979 17.024 5.347 1.00 0.00 H new ATOM 0 HB3 ARG A 133 100.409 18.654 5.646 1.00 0.00 H new ATOM 0 HG2 ARG A 133 99.253 17.811 7.750 1.00 0.00 H new ATOM 0 HG3 ARG A 133 99.966 16.235 7.469 1.00 0.00 H new ATOM 0 HD2 ARG A 133 101.495 18.849 7.904 1.00 0.00 H new ATOM 0 HD3 ARG A 133 101.368 17.528 9.048 1.00 0.00 H new ATOM 0 HE ARG A 133 102.396 16.404 6.657 1.00 0.00 H new ATOM 0 HH11 ARG A 133 103.394 18.819 9.071 1.00 0.00 H new ATOM 0 HH12 ARG A 133 105.113 18.515 8.798 1.00 0.00 H new ATOM 0 HH21 ARG A 133 104.581 16.076 6.370 1.00 0.00 H new ATOM 0 HH22 ARG A 133 105.770 16.994 7.300 1.00 0.00 H new ATOM 2005 N SER A 134 99.154 18.874 3.341 1.00 0.00 N ATOM 2006 CA SER A 134 99.102 19.308 1.941 1.00 0.00 C ATOM 2007 C SER A 134 99.928 18.395 1.014 1.00 0.00 C ATOM 2008 O SER A 134 99.771 18.461 -0.206 1.00 0.00 O ATOM 2009 CB SER A 134 99.623 20.740 1.829 1.00 0.00 C ATOM 2010 OG SER A 134 101.015 20.757 2.120 1.00 0.00 O ATOM 0 H SER A 134 99.420 19.599 4.007 1.00 0.00 H new ATOM 0 HA SER A 134 98.061 19.252 1.622 1.00 0.00 H new ATOM 0 HB2 SER A 134 99.445 21.127 0.826 1.00 0.00 H new ATOM 0 HB3 SER A 134 99.087 21.390 2.521 1.00 0.00 H new ATOM 0 HG SER A 134 101.353 21.674 2.047 1.00 0.00 H new ATOM 2016 N VAL A 135 100.799 17.548 1.570 1.00 0.00 N ATOM 2017 CA VAL A 135 101.421 16.470 0.802 1.00 0.00 C ATOM 2018 C VAL A 135 101.073 15.116 1.428 1.00 0.00 C ATOM 2019 O VAL A 135 101.230 14.922 2.634 1.00 0.00 O ATOM 2020 CB VAL A 135 102.941 16.654 0.770 1.00 0.00 C ATOM 2021 CG1 VAL A 135 103.279 17.971 0.073 1.00 0.00 C ATOM 2022 CG2 VAL A 135 103.491 16.680 2.198 1.00 0.00 C ATOM 0 H VAL A 135 101.088 17.589 2.547 1.00 0.00 H new ATOM 0 HA VAL A 135 101.041 16.500 -0.219 1.00 0.00 H new ATOM 0 HB VAL A 135 103.392 15.824 0.226 1.00 0.00 H new ATOM 0 HG11 VAL A 135 104.361 18.103 0.050 1.00 0.00 H new ATOM 0 HG12 VAL A 135 102.894 17.953 -0.946 1.00 0.00 H new ATOM 0 HG13 VAL A 135 102.824 18.798 0.618 1.00 0.00 H new ATOM 0 HG21 VAL A 135 104.573 16.811 2.169 1.00 0.00 H new ATOM 0 HG22 VAL A 135 103.040 17.507 2.747 1.00 0.00 H new ATOM 0 HG23 VAL A 135 103.253 15.741 2.697 1.00 0.00 H new ATOM 2032 N ASP A 136 100.594 14.183 0.603 1.00 0.00 N ATOM 2033 CA ASP A 136 100.206 12.852 1.078 1.00 0.00 C ATOM 2034 C ASP A 136 101.116 11.791 0.468 1.00 0.00 C ATOM 2035 O ASP A 136 101.449 11.871 -0.714 1.00 0.00 O ATOM 2036 CB ASP A 136 98.756 12.563 0.691 1.00 0.00 C ATOM 2037 CG ASP A 136 98.296 11.256 1.328 1.00 0.00 C ATOM 2038 OD1 ASP A 136 97.888 11.291 2.477 1.00 0.00 O ATOM 2039 OD2 ASP A 136 98.360 10.237 0.657 1.00 0.00 O ATOM 0 H ASP A 136 100.465 14.324 -0.399 1.00 0.00 H new ATOM 0 HA ASP A 136 100.303 12.826 2.163 1.00 0.00 H new ATOM 0 HB2 ASP A 136 98.114 13.381 1.017 1.00 0.00 H new ATOM 0 HB3 ASP A 136 98.666 12.500 -0.393 1.00 0.00 H new ATOM 2044 N VAL A 137 101.524 10.791 1.260 1.00 0.00 N ATOM 2045 CA VAL A 137 102.539 9.837 0.785 1.00 0.00 C ATOM 2046 C VAL A 137 101.936 8.466 0.493 1.00 0.00 C ATOM 2047 O VAL A 137 101.180 7.923 1.298 1.00 0.00 O ATOM 2048 CB VAL A 137 103.665 9.661 1.813 1.00 0.00 C ATOM 2049 CG1 VAL A 137 104.809 8.871 1.177 1.00 0.00 C ATOM 2050 CG2 VAL A 137 104.201 11.019 2.278 1.00 0.00 C ATOM 0 H VAL A 137 101.180 10.622 2.205 1.00 0.00 H new ATOM 0 HA VAL A 137 102.943 10.257 -0.136 1.00 0.00 H new ATOM 0 HB VAL A 137 103.264 9.128 2.675 1.00 0.00 H new ATOM 0 HG11 VAL A 137 105.611 8.744 1.904 1.00 0.00 H new ATOM 0 HG12 VAL A 137 104.445 7.893 0.863 1.00 0.00 H new ATOM 0 HG13 VAL A 137 105.187 9.413 0.310 1.00 0.00 H new ATOM 0 HG21 VAL A 137 104.998 10.866 3.006 1.00 0.00 H new ATOM 0 HG22 VAL A 137 104.592 11.568 1.422 1.00 0.00 H new ATOM 0 HG23 VAL A 137 103.395 11.590 2.738 1.00 0.00 H new ATOM 2060 N GLY A 138 102.280 7.914 -0.669 1.00 0.00 N ATOM 2061 CA GLY A 138 101.936 6.532 -0.996 1.00 0.00 C ATOM 2062 C GLY A 138 103.204 5.775 -1.375 1.00 0.00 C ATOM 2063 O GLY A 138 103.865 6.141 -2.343 1.00 0.00 O ATOM 0 H GLY A 138 102.797 8.403 -1.400 1.00 0.00 H new ATOM 0 HA2 GLY A 138 101.454 6.053 -0.144 1.00 0.00 H new ATOM 0 HA3 GLY A 138 101.224 6.508 -1.821 1.00 0.00 H new ATOM 2067 N THR A 139 103.562 4.740 -0.613 1.00 0.00 N ATOM 2068 CA THR A 139 104.818 4.030 -0.853 1.00 0.00 C ATOM 2069 C THR A 139 104.576 2.535 -1.019 1.00 0.00 C ATOM 2070 O THR A 139 103.832 1.937 -0.247 1.00 0.00 O ATOM 2071 CB THR A 139 105.778 4.265 0.315 1.00 0.00 C ATOM 2072 OG1 THR A 139 105.916 5.660 0.538 1.00 0.00 O ATOM 2073 CG2 THR A 139 107.146 3.662 -0.015 1.00 0.00 C ATOM 0 H THR A 139 103.009 4.379 0.164 1.00 0.00 H new ATOM 0 HA THR A 139 105.257 4.415 -1.774 1.00 0.00 H new ATOM 0 HB THR A 139 105.381 3.790 1.212 1.00 0.00 H new ATOM 0 HG1 THR A 139 106.529 5.812 1.287 1.00 0.00 H new ATOM 0 HG21 THR A 139 107.828 3.830 0.818 1.00 0.00 H new ATOM 0 HG22 THR A 139 107.040 2.591 -0.186 1.00 0.00 H new ATOM 0 HG23 THR A 139 107.545 4.135 -0.912 1.00 0.00 H new ATOM 2081 N TRP A 140 105.197 1.939 -2.035 1.00 0.00 N ATOM 2082 CA TRP A 140 105.091 0.493 -2.241 1.00 0.00 C ATOM 2083 C TRP A 140 106.485 -0.119 -2.270 1.00 0.00 C ATOM 2084 O TRP A 140 107.403 0.465 -2.845 1.00 0.00 O ATOM 2085 CB TRP A 140 104.349 0.185 -3.544 1.00 0.00 C ATOM 2086 CG TRP A 140 104.957 0.811 -4.759 1.00 0.00 C ATOM 2087 CD1 TRP A 140 106.015 0.318 -5.442 1.00 0.00 C ATOM 2088 CD2 TRP A 140 104.553 2.028 -5.451 1.00 0.00 C ATOM 2089 NE1 TRP A 140 106.290 1.155 -6.507 1.00 0.00 N ATOM 2090 CE2 TRP A 140 105.416 2.223 -6.557 1.00 0.00 C ATOM 2091 CE3 TRP A 140 103.536 2.972 -5.231 1.00 0.00 C ATOM 2092 CZ2 TRP A 140 105.272 3.318 -7.413 1.00 0.00 C ATOM 2093 CZ3 TRP A 140 103.387 4.073 -6.088 1.00 0.00 C ATOM 2094 CH2 TRP A 140 104.253 4.247 -7.176 1.00 0.00 C ATOM 0 H TRP A 140 105.773 2.426 -2.722 1.00 0.00 H new ATOM 0 HA TRP A 140 104.523 0.059 -1.418 1.00 0.00 H new ATOM 0 HB2 TRP A 140 104.316 -0.896 -3.684 1.00 0.00 H new ATOM 0 HB3 TRP A 140 103.318 0.526 -3.451 1.00 0.00 H new ATOM 0 HD1 TRP A 140 106.557 -0.583 -5.195 1.00 0.00 H new ATOM 0 HE1 TRP A 140 107.046 1.002 -7.174 1.00 0.00 H new ATOM 0 HE3 TRP A 140 102.863 2.849 -4.395 1.00 0.00 H new ATOM 0 HZ2 TRP A 140 105.942 3.446 -8.251 1.00 0.00 H new ATOM 0 HZ3 TRP A 140 102.600 4.791 -5.908 1.00 0.00 H new ATOM 0 HH2 TRP A 140 104.134 5.097 -7.831 1.00 0.00 H new ATOM 2105 N ILE A 141 106.648 -1.271 -1.621 1.00 0.00 N ATOM 2106 CA ILE A 141 107.968 -1.885 -1.495 1.00 0.00 C ATOM 2107 C ILE A 141 107.927 -3.371 -1.843 1.00 0.00 C ATOM 2108 O ILE A 141 106.915 -4.037 -1.626 1.00 0.00 O ATOM 2109 CB ILE A 141 108.501 -1.673 -0.063 1.00 0.00 C ATOM 2110 CG1 ILE A 141 107.647 -2.451 0.954 1.00 0.00 C ATOM 2111 CG2 ILE A 141 108.502 -0.172 0.295 1.00 0.00 C ATOM 2112 CD1 ILE A 141 108.283 -2.351 2.342 1.00 0.00 C ATOM 0 H ILE A 141 105.891 -1.793 -1.179 1.00 0.00 H new ATOM 0 HA ILE A 141 108.643 -1.405 -2.204 1.00 0.00 H new ATOM 0 HB ILE A 141 109.524 -2.048 -0.023 1.00 0.00 H new ATOM 0 HG12 ILE A 141 106.634 -2.048 0.977 1.00 0.00 H new ATOM 0 HG13 ILE A 141 107.568 -3.496 0.654 1.00 0.00 H new ATOM 0 HG21 ILE A 141 108.881 -0.040 1.308 1.00 0.00 H new ATOM 0 HG22 ILE A 141 109.140 0.368 -0.404 1.00 0.00 H new ATOM 0 HG23 ILE A 141 107.486 0.217 0.234 1.00 0.00 H new ATOM 0 HD11 ILE A 141 107.677 -2.903 3.061 1.00 0.00 H new ATOM 0 HD12 ILE A 141 109.287 -2.774 2.314 1.00 0.00 H new ATOM 0 HD13 ILE A 141 108.339 -1.305 2.642 1.00 0.00 H new ATOM 2124 N ALA A 142 109.052 -3.881 -2.337 1.00 0.00 N ATOM 2125 CA ALA A 142 109.179 -5.305 -2.623 1.00 0.00 C ATOM 2126 C ALA A 142 110.559 -5.783 -2.190 1.00 0.00 C ATOM 2127 O ALA A 142 111.563 -5.150 -2.520 1.00 0.00 O ATOM 2128 CB ALA A 142 108.990 -5.562 -4.121 1.00 0.00 C ATOM 0 H ALA A 142 109.885 -3.331 -2.547 1.00 0.00 H new ATOM 0 HA ALA A 142 108.412 -5.851 -2.074 1.00 0.00 H new ATOM 0 HB1 ALA A 142 109.087 -6.629 -4.322 1.00 0.00 H new ATOM 0 HB2 ALA A 142 108.000 -5.224 -4.426 1.00 0.00 H new ATOM 0 HB3 ALA A 142 109.749 -5.016 -4.682 1.00 0.00 H new ATOM 2134 N GLY A 143 110.608 -6.886 -1.446 1.00 0.00 N ATOM 2135 CA GLY A 143 111.872 -7.357 -0.886 1.00 0.00 C ATOM 2136 C GLY A 143 111.989 -8.875 -0.939 1.00 0.00 C ATOM 2137 O GLY A 143 110.983 -9.586 -0.922 1.00 0.00 O ATOM 0 H GLY A 143 109.798 -7.464 -1.219 1.00 0.00 H new ATOM 0 HA2 GLY A 143 112.701 -6.910 -1.435 1.00 0.00 H new ATOM 0 HA3 GLY A 143 111.958 -7.023 0.148 1.00 0.00 H new ATOM 2141 N VAL A 144 113.229 -9.357 -0.988 1.00 0.00 N ATOM 2142 CA VAL A 144 113.505 -10.789 -1.015 1.00 0.00 C ATOM 2143 C VAL A 144 114.336 -11.162 0.206 1.00 0.00 C ATOM 2144 O VAL A 144 115.180 -10.379 0.642 1.00 0.00 O ATOM 2145 CB VAL A 144 114.271 -11.161 -2.290 1.00 0.00 C ATOM 2146 CG1 VAL A 144 113.400 -10.876 -3.518 1.00 0.00 C ATOM 2147 CG2 VAL A 144 115.562 -10.339 -2.378 1.00 0.00 C ATOM 0 H VAL A 144 114.063 -8.771 -1.010 1.00 0.00 H new ATOM 0 HA VAL A 144 112.561 -11.334 -1.002 1.00 0.00 H new ATOM 0 HB VAL A 144 114.519 -12.222 -2.260 1.00 0.00 H new ATOM 0 HG11 VAL A 144 113.948 -11.142 -4.422 1.00 0.00 H new ATOM 0 HG12 VAL A 144 112.486 -11.467 -3.461 1.00 0.00 H new ATOM 0 HG13 VAL A 144 113.146 -9.816 -3.546 1.00 0.00 H new ATOM 0 HG21 VAL A 144 116.103 -10.607 -3.286 1.00 0.00 H new ATOM 0 HG22 VAL A 144 115.316 -9.277 -2.402 1.00 0.00 H new ATOM 0 HG23 VAL A 144 116.186 -10.547 -1.509 1.00 0.00 H new ATOM 2157 N GLY A 145 114.084 -12.339 0.769 1.00 0.00 N ATOM 2158 CA GLY A 145 114.790 -12.754 1.977 1.00 0.00 C ATOM 2159 C GLY A 145 114.843 -14.271 2.122 1.00 0.00 C ATOM 2160 O GLY A 145 114.298 -15.013 1.298 1.00 0.00 O ATOM 0 H GLY A 145 113.406 -13.014 0.415 1.00 0.00 H new ATOM 0 HA2 GLY A 145 115.805 -12.357 1.957 1.00 0.00 H new ATOM 0 HA3 GLY A 145 114.297 -12.325 2.849 1.00 0.00 H new ATOM 2164 N TYR A 146 115.510 -14.706 3.187 1.00 0.00 N ATOM 2165 CA TYR A 146 115.631 -16.123 3.504 1.00 0.00 C ATOM 2166 C TYR A 146 115.549 -16.334 5.014 1.00 0.00 C ATOM 2167 O TYR A 146 115.614 -15.372 5.783 1.00 0.00 O ATOM 2168 CB TYR A 146 116.958 -16.666 2.966 1.00 0.00 C ATOM 2169 CG TYR A 146 118.179 -16.090 3.646 1.00 0.00 C ATOM 2170 CD1 TYR A 146 118.708 -16.718 4.780 1.00 0.00 C ATOM 2171 CD2 TYR A 146 118.777 -14.928 3.144 1.00 0.00 C ATOM 2172 CE1 TYR A 146 119.839 -16.184 5.411 1.00 0.00 C ATOM 2173 CE2 TYR A 146 119.907 -14.393 3.776 1.00 0.00 C ATOM 2174 CZ TYR A 146 120.437 -15.020 4.909 1.00 0.00 C ATOM 2175 OH TYR A 146 121.551 -14.494 5.532 1.00 0.00 O ATOM 0 H TYR A 146 115.979 -14.089 3.850 1.00 0.00 H new ATOM 0 HA TYR A 146 114.810 -16.663 3.032 1.00 0.00 H new ATOM 0 HB2 TYR A 146 116.968 -17.750 3.081 1.00 0.00 H new ATOM 0 HB3 TYR A 146 117.018 -16.458 1.898 1.00 0.00 H new ATOM 0 HD1 TYR A 146 118.245 -17.613 5.168 1.00 0.00 H new ATOM 0 HD2 TYR A 146 118.367 -14.444 2.270 1.00 0.00 H new ATOM 0 HE1 TYR A 146 120.250 -16.669 6.284 1.00 0.00 H new ATOM 0 HE2 TYR A 146 120.369 -13.497 3.389 1.00 0.00 H new ATOM 0 HH TYR A 146 121.841 -13.687 5.057 1.00 0.00 H new ATOM 2185 N ARG A 147 115.426 -17.594 5.427 1.00 0.00 N ATOM 2186 CA ARG A 147 115.313 -17.933 6.845 1.00 0.00 C ATOM 2187 C ARG A 147 116.488 -18.805 7.277 1.00 0.00 C ATOM 2188 O ARG A 147 116.992 -19.612 6.496 1.00 0.00 O ATOM 2189 CB ARG A 147 114.000 -18.680 7.092 1.00 0.00 C ATOM 2190 CG ARG A 147 113.815 -18.931 8.590 1.00 0.00 C ATOM 2191 CD ARG A 147 112.554 -19.763 8.819 1.00 0.00 C ATOM 2192 NE ARG A 147 111.375 -19.046 8.325 1.00 0.00 N ATOM 2193 CZ ARG A 147 110.115 -19.422 8.591 1.00 0.00 C ATOM 2194 NH1 ARG A 147 109.839 -20.473 9.325 1.00 0.00 N ATOM 2195 NH2 ARG A 147 109.131 -18.719 8.103 1.00 0.00 N ATOM 0 H ARG A 147 115.402 -18.398 4.800 1.00 0.00 H new ATOM 0 HA ARG A 147 115.325 -17.013 7.429 1.00 0.00 H new ATOM 0 HB2 ARG A 147 113.163 -18.098 6.706 1.00 0.00 H new ATOM 0 HB3 ARG A 147 114.004 -19.628 6.554 1.00 0.00 H new ATOM 0 HG2 ARG A 147 114.684 -19.452 8.992 1.00 0.00 H new ATOM 0 HG3 ARG A 147 113.738 -17.982 9.121 1.00 0.00 H new ATOM 0 HD2 ARG A 147 112.645 -20.722 8.309 1.00 0.00 H new ATOM 0 HD3 ARG A 147 112.439 -19.977 9.882 1.00 0.00 H new ATOM 0 HE ARG A 147 111.520 -18.217 7.748 1.00 0.00 H new ATOM 0 HH11 ARG A 147 110.595 -21.035 9.715 1.00 0.00 H new ATOM 0 HH12 ARG A 147 108.868 -20.728 9.506 1.00 0.00 H new ATOM 0 HH21 ARG A 147 109.326 -17.898 7.530 1.00 0.00 H new ATOM 0 HH22 ARG A 147 108.167 -18.990 8.295 1.00 0.00 H new ATOM 2209 N PHE A 148 116.923 -18.641 8.525 1.00 0.00 N ATOM 2210 CA PHE A 148 118.052 -19.410 9.036 1.00 0.00 C ATOM 2211 C PHE A 148 117.563 -20.602 9.850 1.00 0.00 C ATOM 2212 O PHE A 148 116.563 -20.457 10.535 1.00 0.00 O ATOM 2213 CB PHE A 148 118.936 -18.521 9.911 1.00 0.00 C ATOM 2214 CG PHE A 148 120.202 -19.200 10.374 1.00 0.00 C ATOM 2215 CD1 PHE A 148 121.336 -19.201 9.554 1.00 0.00 C ATOM 2216 CD2 PHE A 148 120.242 -19.831 11.624 1.00 0.00 C ATOM 2217 CE1 PHE A 148 122.511 -19.832 9.983 1.00 0.00 C ATOM 2218 CE2 PHE A 148 121.416 -20.463 12.053 1.00 0.00 C ATOM 2219 CZ PHE A 148 122.550 -20.461 11.232 1.00 0.00 C ATOM 2220 OXT PHE A 148 118.193 -21.644 9.778 1.00 0.00 O ATOM 0 H PHE A 148 116.514 -17.989 9.194 1.00 0.00 H new ATOM 0 HA PHE A 148 118.631 -19.776 8.188 1.00 0.00 H new ATOM 0 HB2 PHE A 148 119.198 -17.622 9.353 1.00 0.00 H new ATOM 0 HB3 PHE A 148 118.365 -18.200 10.783 1.00 0.00 H new ATOM 0 HD1 PHE A 148 121.305 -18.715 8.590 1.00 0.00 H new ATOM 0 HD2 PHE A 148 119.367 -19.830 12.257 1.00 0.00 H new ATOM 0 HE1 PHE A 148 123.386 -19.833 9.350 1.00 0.00 H new ATOM 0 HE2 PHE A 148 121.446 -20.951 13.016 1.00 0.00 H new ATOM 0 HZ PHE A 148 123.456 -20.946 11.563 1.00 0.00 H new