USER MOD reduce.3.24.130724 H: found=0, std=0, add=654, rem=0, adj=15 USER MOD reduce.3.24.130724 removed 653 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Single : A 1 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 1 MET N :NH3+ -151:sc= -0.217 (180deg=-0.939) USER MOD Single : A 2 THR OG1 : rot 180:sc= 0 USER MOD Single : A 4 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 5 GLN : amide:sc= -1.52 K(o=-1.5,f=-3!) USER MOD Single : A 6 THR OG1 : rot 180:sc= 0.0784 USER MOD Single : A 10 THR OG1 : rot 180:sc= 0 USER MOD Single : A 11 ASN : amide:sc= -4.24! C(o=-4.2!,f=-6.2!) USER MOD Single : A 12 LYS NZ :NH3+ -147:sc= -0.297 (180deg=-1.24!) USER MOD Single : A 15 MET CE :methyl -152:sc= -0.202 (180deg=-1.29!) USER MOD Single : A 16 HIS : no HE2:sc= -0.0514 K(o=-0.051,f=-0.69) USER MOD Single : A 21 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 22 LYS NZ :NH3+ -167:sc= -2.7! (180deg=-3.05!) USER MOD Single : A 27 MET CE :methyl 151:sc= -0.0399 (180deg=-1) USER MOD Single : A 28 GLN : amide:sc= 0 K(o=0,f=-1.5!) USER MOD Single : A 38 ASN : amide:sc= -4.71! C(o=-4.7!,f=-12!) USER MOD Single : A 42 THR OG1 : rot 180:sc= 0 USER MOD Single : A 47 ASN : amide:sc= -2.12! C(o=-2.1!,f=-8.7!) USER MOD Single : A 48 SER OG : rot 180:sc= 0 USER MOD Single : A 54 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 57 SER OG : rot -77:sc= 1.18 USER MOD Single : A 59 LYS NZ :NH3+ -160:sc= -0.0611 (180deg=-0.477) USER MOD Single : A 62 GLN : amide:sc=-0.00959 K(o=-0.0096,f=-1.4!) USER MOD Single : A 68 THR OG1 : rot 164:sc= -4.76! USER MOD Single : A 71 GLN : amide:sc= -5.33! C(o=-5.3!,f=-4.7!) USER MOD Single : A 84 ASN : amide:sc= -2.04 X(o=-2,f=-1.9!) USER MOD Single : A 85 SER OG : rot 88:sc= 0.653 USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 48.568 -14.525 18.386 1.00 0.00 N ATOM 2 CA MET A 1 48.386 -13.997 17.004 1.00 0.00 C ATOM 3 C MET A 1 49.592 -13.144 16.625 1.00 0.00 C ATOM 4 O MET A 1 49.454 -11.959 16.321 1.00 0.00 O ATOM 5 CB MET A 1 47.111 -13.154 16.948 1.00 0.00 C ATOM 6 CG MET A 1 45.917 -14.003 17.389 1.00 0.00 C ATOM 7 SD MET A 1 44.425 -12.978 17.417 1.00 0.00 S ATOM 8 CE MET A 1 43.318 -14.210 18.146 1.00 0.00 C ATOM 0 H1 MET A 1 48.072 -15.434 18.478 1.00 0.00 H new ATOM 0 H2 MET A 1 49.581 -14.663 18.574 1.00 0.00 H new ATOM 0 H3 MET A 1 48.178 -13.847 19.071 1.00 0.00 H new ATOM 0 HA MET A 1 48.299 -14.825 16.301 1.00 0.00 H new ATOM 0 HB2 MET A 1 47.210 -12.283 17.595 1.00 0.00 H new ATOM 0 HB3 MET A 1 46.952 -12.783 15.936 1.00 0.00 H new ATOM 0 HG2 MET A 1 45.782 -14.842 16.706 1.00 0.00 H new ATOM 0 HG3 MET A 1 46.101 -14.423 18.378 1.00 0.00 H new ATOM 0 HE1 MET A 1 42.321 -13.783 18.256 1.00 0.00 H new ATOM 0 HE2 MET A 1 43.269 -15.084 17.497 1.00 0.00 H new ATOM 0 HE3 MET A 1 43.697 -14.506 19.124 1.00 0.00 H new ATOM 20 N THR A 2 50.772 -13.754 16.646 1.00 0.00 N ATOM 21 CA THR A 2 51.995 -13.039 16.303 1.00 0.00 C ATOM 22 C THR A 2 52.867 -13.883 15.377 1.00 0.00 C ATOM 23 O THR A 2 52.765 -15.109 15.360 1.00 0.00 O ATOM 24 CB THR A 2 52.777 -12.700 17.574 1.00 0.00 C ATOM 25 OG1 THR A 2 53.056 -13.896 18.290 1.00 0.00 O ATOM 26 CG2 THR A 2 51.948 -11.759 18.450 1.00 0.00 C ATOM 0 H THR A 2 50.907 -14.734 16.895 1.00 0.00 H new ATOM 0 HA THR A 2 51.722 -12.118 15.788 1.00 0.00 H new ATOM 0 HB THR A 2 53.713 -12.211 17.305 1.00 0.00 H new ATOM 0 HG1 THR A 2 53.558 -13.681 19.103 1.00 0.00 H new ATOM 0 HG21 THR A 2 52.506 -11.518 19.355 1.00 0.00 H new ATOM 0 HG22 THR A 2 51.736 -10.842 17.900 1.00 0.00 H new ATOM 0 HG23 THR A 2 51.011 -12.245 18.720 1.00 0.00 H new ATOM 34 N VAL A 3 53.724 -13.217 14.609 1.00 0.00 N ATOM 35 CA VAL A 3 54.608 -13.915 13.685 1.00 0.00 C ATOM 36 C VAL A 3 56.022 -13.348 13.765 1.00 0.00 C ATOM 37 O VAL A 3 56.243 -12.168 13.494 1.00 0.00 O ATOM 38 CB VAL A 3 54.082 -13.779 12.255 1.00 0.00 C ATOM 39 CG1 VAL A 3 55.028 -14.497 11.292 1.00 0.00 C ATOM 40 CG2 VAL A 3 52.690 -14.408 12.163 1.00 0.00 C ATOM 0 H VAL A 3 53.824 -12.202 14.608 1.00 0.00 H new ATOM 0 HA VAL A 3 54.635 -14.969 13.963 1.00 0.00 H new ATOM 0 HB VAL A 3 54.024 -12.724 11.988 1.00 0.00 H new ATOM 0 HG11 VAL A 3 54.653 -14.400 10.273 1.00 0.00 H new ATOM 0 HG12 VAL A 3 56.021 -14.051 11.357 1.00 0.00 H new ATOM 0 HG13 VAL A 3 55.086 -15.552 11.558 1.00 0.00 H new ATOM 0 HG21 VAL A 3 52.314 -14.312 11.144 1.00 0.00 H new ATOM 0 HG22 VAL A 3 52.749 -15.463 12.430 1.00 0.00 H new ATOM 0 HG23 VAL A 3 52.014 -13.898 12.849 1.00 0.00 H new ATOM 50 N LYS A 4 56.974 -14.195 14.142 1.00 0.00 N ATOM 51 CA LYS A 4 58.363 -13.766 14.256 1.00 0.00 C ATOM 52 C LYS A 4 59.267 -14.630 13.383 1.00 0.00 C ATOM 53 O LYS A 4 58.835 -15.649 12.843 1.00 0.00 O ATOM 54 CB LYS A 4 58.819 -13.856 15.713 1.00 0.00 C ATOM 55 CG LYS A 4 58.544 -15.263 16.248 1.00 0.00 C ATOM 56 CD LYS A 4 58.696 -15.269 17.771 1.00 0.00 C ATOM 57 CE LYS A 4 58.478 -16.686 18.301 1.00 0.00 C ATOM 58 NZ LYS A 4 58.699 -16.706 19.774 1.00 0.00 N ATOM 0 H LYS A 4 56.811 -15.175 14.372 1.00 0.00 H new ATOM 0 HA LYS A 4 58.432 -12.733 13.917 1.00 0.00 H new ATOM 0 HB2 LYS A 4 59.882 -13.629 15.787 1.00 0.00 H new ATOM 0 HB3 LYS A 4 58.292 -13.117 16.316 1.00 0.00 H new ATOM 0 HG2 LYS A 4 57.538 -15.579 15.971 1.00 0.00 H new ATOM 0 HG3 LYS A 4 59.236 -15.976 15.800 1.00 0.00 H new ATOM 0 HD2 LYS A 4 59.688 -14.914 18.049 1.00 0.00 H new ATOM 0 HD3 LYS A 4 57.976 -14.586 18.221 1.00 0.00 H new ATOM 0 HE2 LYS A 4 57.467 -17.020 18.070 1.00 0.00 H new ATOM 0 HE3 LYS A 4 59.162 -17.378 17.811 1.00 0.00 H new ATOM 0 HZ1 LYS A 4 58.551 -17.670 20.134 1.00 0.00 H new ATOM 0 HZ2 LYS A 4 59.672 -16.404 19.983 1.00 0.00 H new ATOM 0 HZ3 LYS A 4 58.029 -16.058 20.234 1.00 0.00 H new ATOM 72 N GLN A 5 60.522 -14.217 13.251 1.00 0.00 N ATOM 73 CA GLN A 5 61.481 -14.960 12.441 1.00 0.00 C ATOM 74 C GLN A 5 62.908 -14.629 12.866 1.00 0.00 C ATOM 75 O GLN A 5 63.258 -13.461 13.041 1.00 0.00 O ATOM 76 CB GLN A 5 61.294 -14.618 10.962 1.00 0.00 C ATOM 77 CG GLN A 5 60.127 -15.427 10.394 1.00 0.00 C ATOM 78 CD GLN A 5 59.958 -15.126 8.908 1.00 0.00 C ATOM 79 OE1 GLN A 5 59.325 -14.136 8.542 1.00 0.00 O ATOM 80 NE2 GLN A 5 60.491 -15.926 8.025 1.00 0.00 N ATOM 0 H GLN A 5 60.898 -13.377 13.691 1.00 0.00 H new ATOM 0 HA GLN A 5 61.306 -16.025 12.590 1.00 0.00 H new ATOM 0 HB2 GLN A 5 61.101 -13.551 10.846 1.00 0.00 H new ATOM 0 HB3 GLN A 5 62.207 -14.839 10.409 1.00 0.00 H new ATOM 0 HG2 GLN A 5 60.307 -16.492 10.540 1.00 0.00 H new ATOM 0 HG3 GLN A 5 59.210 -15.183 10.930 1.00 0.00 H new ATOM 0 HE21 GLN A 5 61.015 -16.746 8.330 1.00 0.00 H new ATOM 0 HE22 GLN A 5 60.383 -15.731 7.030 1.00 0.00 H new ATOM 89 N THR A 6 63.727 -15.662 13.031 1.00 0.00 N ATOM 90 CA THR A 6 65.114 -15.467 13.437 1.00 0.00 C ATOM 91 C THR A 6 65.988 -15.149 12.228 1.00 0.00 C ATOM 92 O THR A 6 65.988 -15.882 11.239 1.00 0.00 O ATOM 93 CB THR A 6 65.637 -16.727 14.130 1.00 0.00 C ATOM 94 OG1 THR A 6 64.557 -17.620 14.363 1.00 0.00 O ATOM 95 CG2 THR A 6 66.284 -16.348 15.463 1.00 0.00 C ATOM 0 H THR A 6 63.457 -16.636 12.891 1.00 0.00 H new ATOM 0 HA THR A 6 65.155 -14.627 14.130 1.00 0.00 H new ATOM 0 HB THR A 6 66.378 -17.210 13.494 1.00 0.00 H new ATOM 0 HG1 THR A 6 64.891 -18.428 14.805 1.00 0.00 H new ATOM 0 HG21 THR A 6 66.656 -17.246 15.955 1.00 0.00 H new ATOM 0 HG22 THR A 6 67.113 -15.663 15.283 1.00 0.00 H new ATOM 0 HG23 THR A 6 65.545 -15.864 16.102 1.00 0.00 H new ATOM 103 N VAL A 7 66.732 -14.051 12.316 1.00 0.00 N ATOM 104 CA VAL A 7 67.610 -13.644 11.224 1.00 0.00 C ATOM 105 C VAL A 7 69.009 -13.342 11.748 1.00 0.00 C ATOM 106 O VAL A 7 69.180 -12.540 12.666 1.00 0.00 O ATOM 107 CB VAL A 7 67.042 -12.404 10.533 1.00 0.00 C ATOM 108 CG1 VAL A 7 67.941 -12.018 9.357 1.00 0.00 C ATOM 109 CG2 VAL A 7 65.633 -12.708 10.018 1.00 0.00 C ATOM 0 H VAL A 7 66.745 -13.431 13.126 1.00 0.00 H new ATOM 0 HA VAL A 7 67.672 -14.462 10.507 1.00 0.00 H new ATOM 0 HB VAL A 7 67.000 -11.579 11.244 1.00 0.00 H new ATOM 0 HG11 VAL A 7 67.536 -11.134 8.864 1.00 0.00 H new ATOM 0 HG12 VAL A 7 68.945 -11.802 9.722 1.00 0.00 H new ATOM 0 HG13 VAL A 7 67.983 -12.843 8.645 1.00 0.00 H new ATOM 0 HG21 VAL A 7 65.227 -11.824 9.525 1.00 0.00 H new ATOM 0 HG22 VAL A 7 65.676 -13.533 9.307 1.00 0.00 H new ATOM 0 HG23 VAL A 7 64.991 -12.984 10.855 1.00 0.00 H new ATOM 119 N GLU A 8 70.009 -13.990 11.159 1.00 0.00 N ATOM 120 CA GLU A 8 71.391 -13.783 11.574 1.00 0.00 C ATOM 121 C GLU A 8 71.881 -12.404 11.144 1.00 0.00 C ATOM 122 O GLU A 8 71.672 -11.988 10.005 1.00 0.00 O ATOM 123 CB GLU A 8 72.288 -14.860 10.960 1.00 0.00 C ATOM 124 CG GLU A 8 73.663 -14.822 11.629 1.00 0.00 C ATOM 125 CD GLU A 8 74.528 -15.963 11.106 1.00 0.00 C ATOM 126 OE1 GLU A 8 74.031 -16.741 10.308 1.00 0.00 O ATOM 127 OE2 GLU A 8 75.676 -16.044 11.512 1.00 0.00 O ATOM 0 H GLU A 8 69.889 -14.658 10.398 1.00 0.00 H new ATOM 0 HA GLU A 8 71.437 -13.848 12.661 1.00 0.00 H new ATOM 0 HB2 GLU A 8 71.835 -15.843 11.091 1.00 0.00 H new ATOM 0 HB3 GLU A 8 72.389 -14.696 9.887 1.00 0.00 H new ATOM 0 HG2 GLU A 8 74.148 -13.866 11.429 1.00 0.00 H new ATOM 0 HG3 GLU A 8 73.553 -14.904 12.710 1.00 0.00 H new ATOM 134 N ILE A 9 72.532 -11.700 12.064 1.00 0.00 N ATOM 135 CA ILE A 9 73.049 -10.368 11.768 1.00 0.00 C ATOM 136 C ILE A 9 74.534 -10.432 11.430 1.00 0.00 C ATOM 137 O ILE A 9 75.370 -10.667 12.304 1.00 0.00 O ATOM 138 CB ILE A 9 72.837 -9.447 12.971 1.00 0.00 C ATOM 139 CG1 ILE A 9 71.341 -9.354 13.283 1.00 0.00 C ATOM 140 CG2 ILE A 9 73.376 -8.053 12.648 1.00 0.00 C ATOM 141 CD1 ILE A 9 70.555 -9.205 11.979 1.00 0.00 C ATOM 0 H ILE A 9 72.713 -12.026 13.013 1.00 0.00 H new ATOM 0 HA ILE A 9 72.509 -9.972 10.908 1.00 0.00 H new ATOM 0 HB ILE A 9 73.366 -9.850 13.835 1.00 0.00 H new ATOM 0 HG12 ILE A 9 71.014 -10.246 13.817 1.00 0.00 H new ATOM 0 HG13 ILE A 9 71.147 -8.503 13.936 1.00 0.00 H new ATOM 0 HG21 ILE A 9 73.225 -7.397 13.505 1.00 0.00 H new ATOM 0 HG22 ILE A 9 74.441 -8.118 12.424 1.00 0.00 H new ATOM 0 HG23 ILE A 9 72.847 -7.649 11.785 1.00 0.00 H new ATOM 0 HD11 ILE A 9 69.490 -9.139 12.202 1.00 0.00 H new ATOM 0 HD12 ILE A 9 70.875 -8.300 11.463 1.00 0.00 H new ATOM 0 HD13 ILE A 9 70.739 -10.070 11.342 1.00 0.00 H new ATOM 153 N THR A 10 74.857 -10.223 10.158 1.00 0.00 N ATOM 154 CA THR A 10 76.247 -10.260 9.717 1.00 0.00 C ATOM 155 C THR A 10 76.503 -9.191 8.660 1.00 0.00 C ATOM 156 O THR A 10 77.290 -9.394 7.736 1.00 0.00 O ATOM 157 CB THR A 10 76.574 -11.640 9.140 1.00 0.00 C ATOM 158 OG1 THR A 10 76.469 -12.618 10.166 1.00 0.00 O ATOM 159 CG2 THR A 10 77.997 -11.636 8.580 1.00 0.00 C ATOM 0 H THR A 10 74.181 -10.028 9.419 1.00 0.00 H new ATOM 0 HA THR A 10 76.887 -10.064 10.577 1.00 0.00 H new ATOM 0 HB THR A 10 75.872 -11.876 8.340 1.00 0.00 H new ATOM 0 HG1 THR A 10 76.676 -13.502 9.798 1.00 0.00 H new ATOM 0 HG21 THR A 10 78.229 -12.619 8.169 1.00 0.00 H new ATOM 0 HG22 THR A 10 78.076 -10.886 7.793 1.00 0.00 H new ATOM 0 HG23 THR A 10 78.701 -11.401 9.378 1.00 0.00 H new ATOM 167 N ASN A 11 75.834 -8.051 8.803 1.00 0.00 N ATOM 168 CA ASN A 11 75.999 -6.956 7.855 1.00 0.00 C ATOM 169 C ASN A 11 74.742 -6.788 7.008 1.00 0.00 C ATOM 170 O ASN A 11 74.745 -6.064 6.012 1.00 0.00 O ATOM 171 CB ASN A 11 77.198 -7.229 6.945 1.00 0.00 C ATOM 172 CG ASN A 11 77.479 -6.010 6.073 1.00 0.00 C ATOM 173 OD1 ASN A 11 76.626 -5.133 5.937 1.00 0.00 O ATOM 174 ND2 ASN A 11 78.631 -5.902 5.470 1.00 0.00 N ATOM 0 H ASN A 11 75.177 -7.863 9.560 1.00 0.00 H new ATOM 0 HA ASN A 11 76.171 -6.037 8.416 1.00 0.00 H new ATOM 0 HB2 ASN A 11 78.075 -7.466 7.547 1.00 0.00 H new ATOM 0 HB3 ASN A 11 76.998 -8.097 6.317 1.00 0.00 H new ATOM 0 HD21 ASN A 11 78.826 -5.090 4.885 1.00 0.00 H new ATOM 0 HD22 ASN A 11 79.337 -6.630 5.584 1.00 0.00 H new ATOM 181 N LYS A 12 73.669 -7.462 7.408 1.00 0.00 N ATOM 182 CA LYS A 12 72.410 -7.380 6.677 1.00 0.00 C ATOM 183 C LYS A 12 71.420 -6.482 7.414 1.00 0.00 C ATOM 184 O LYS A 12 70.354 -6.157 6.891 1.00 0.00 O ATOM 185 CB LYS A 12 71.810 -8.777 6.512 1.00 0.00 C ATOM 186 CG LYS A 12 72.779 -9.659 5.721 1.00 0.00 C ATOM 187 CD LYS A 12 72.423 -11.131 5.937 1.00 0.00 C ATOM 188 CE LYS A 12 73.238 -12.001 4.978 1.00 0.00 C ATOM 189 NZ LYS A 12 73.017 -11.537 3.579 1.00 0.00 N ATOM 0 H LYS A 12 73.645 -8.067 8.229 1.00 0.00 H new ATOM 0 HA LYS A 12 72.609 -6.952 5.694 1.00 0.00 H new ATOM 0 HB2 LYS A 12 71.615 -9.218 7.489 1.00 0.00 H new ATOM 0 HB3 LYS A 12 70.853 -8.714 5.994 1.00 0.00 H new ATOM 0 HG2 LYS A 12 72.727 -9.413 4.660 1.00 0.00 H new ATOM 0 HG3 LYS A 12 73.803 -9.471 6.042 1.00 0.00 H new ATOM 0 HD2 LYS A 12 72.628 -11.418 6.968 1.00 0.00 H new ATOM 0 HD3 LYS A 12 71.357 -11.287 5.769 1.00 0.00 H new ATOM 0 HE2 LYS A 12 74.297 -11.944 5.229 1.00 0.00 H new ATOM 0 HE3 LYS A 12 72.943 -13.046 5.077 1.00 0.00 H new ATOM 0 HZ1 LYS A 12 73.060 -12.351 2.933 1.00 0.00 H new ATOM 0 HZ2 LYS A 12 72.083 -11.086 3.506 1.00 0.00 H new ATOM 0 HZ3 LYS A 12 73.754 -10.850 3.321 1.00 0.00 H new ATOM 203 N LEU A 13 71.781 -6.087 8.630 1.00 0.00 N ATOM 204 CA LEU A 13 70.917 -5.226 9.430 1.00 0.00 C ATOM 205 C LEU A 13 70.645 -3.914 8.702 1.00 0.00 C ATOM 206 O LEU A 13 70.153 -2.954 9.295 1.00 0.00 O ATOM 207 CB LEU A 13 71.575 -4.937 10.780 1.00 0.00 C ATOM 208 CG LEU A 13 70.502 -4.536 11.796 1.00 0.00 C ATOM 209 CD1 LEU A 13 70.089 -5.762 12.612 1.00 0.00 C ATOM 210 CD2 LEU A 13 71.065 -3.466 12.734 1.00 0.00 C ATOM 0 H LEU A 13 72.658 -6.346 9.081 1.00 0.00 H new ATOM 0 HA LEU A 13 69.970 -5.741 9.591 1.00 0.00 H new ATOM 0 HB2 LEU A 13 72.112 -5.818 11.131 1.00 0.00 H new ATOM 0 HB3 LEU A 13 72.309 -4.138 10.675 1.00 0.00 H new ATOM 0 HG LEU A 13 69.633 -4.140 11.271 1.00 0.00 H new ATOM 0 HD11 LEU A 13 69.325 -5.477 13.335 1.00 0.00 H new ATOM 0 HD12 LEU A 13 69.690 -6.526 11.945 1.00 0.00 H new ATOM 0 HD13 LEU A 13 70.957 -6.158 13.138 1.00 0.00 H new ATOM 0 HD21 LEU A 13 70.302 -3.179 13.458 1.00 0.00 H new ATOM 0 HD22 LEU A 13 71.933 -3.863 13.260 1.00 0.00 H new ATOM 0 HD23 LEU A 13 71.361 -2.592 12.153 1.00 0.00 H new ATOM 222 N GLY A 14 70.970 -3.879 7.414 1.00 0.00 N ATOM 223 CA GLY A 14 70.757 -2.678 6.614 1.00 0.00 C ATOM 224 C GLY A 14 72.072 -1.948 6.369 1.00 0.00 C ATOM 225 O GLY A 14 72.910 -1.839 7.264 1.00 0.00 O ATOM 0 H GLY A 14 71.379 -4.662 6.905 1.00 0.00 H new ATOM 0 HA2 GLY A 14 70.303 -2.947 5.660 1.00 0.00 H new ATOM 0 HA3 GLY A 14 70.058 -2.015 7.124 1.00 0.00 H new ATOM 229 N MET A 15 72.246 -1.447 5.150 1.00 0.00 N ATOM 230 CA MET A 15 73.465 -0.726 4.797 1.00 0.00 C ATOM 231 C MET A 15 73.675 0.461 5.732 1.00 0.00 C ATOM 232 O MET A 15 74.787 0.706 6.199 1.00 0.00 O ATOM 233 CB MET A 15 73.379 -0.232 3.352 1.00 0.00 C ATOM 234 CG MET A 15 73.425 -1.428 2.399 1.00 0.00 C ATOM 235 SD MET A 15 75.044 -2.227 2.511 1.00 0.00 S ATOM 236 CE MET A 15 76.007 -0.899 1.747 1.00 0.00 C ATOM 0 H MET A 15 71.565 -1.526 4.395 1.00 0.00 H new ATOM 0 HA MET A 15 74.310 -1.407 4.898 1.00 0.00 H new ATOM 0 HB2 MET A 15 72.457 0.330 3.203 1.00 0.00 H new ATOM 0 HB3 MET A 15 74.204 0.448 3.139 1.00 0.00 H new ATOM 0 HG2 MET A 15 72.639 -2.139 2.652 1.00 0.00 H new ATOM 0 HG3 MET A 15 73.240 -1.099 1.376 1.00 0.00 H new ATOM 0 HE1 MET A 15 76.889 -1.320 1.265 1.00 0.00 H new ATOM 0 HE2 MET A 15 75.396 -0.388 1.003 1.00 0.00 H new ATOM 0 HE3 MET A 15 76.317 -0.188 2.512 1.00 0.00 H new ATOM 246 N HIS A 16 72.599 1.193 6.000 1.00 0.00 N ATOM 247 CA HIS A 16 72.676 2.352 6.881 1.00 0.00 C ATOM 248 C HIS A 16 71.280 2.788 7.317 1.00 0.00 C ATOM 249 O HIS A 16 70.687 3.687 6.723 1.00 0.00 O ATOM 250 CB HIS A 16 73.371 3.509 6.160 1.00 0.00 C ATOM 251 CG HIS A 16 73.813 4.534 7.169 1.00 0.00 C ATOM 252 ND1 HIS A 16 72.934 5.447 7.730 1.00 0.00 N ATOM 253 CD2 HIS A 16 75.039 4.804 7.726 1.00 0.00 C ATOM 254 CE1 HIS A 16 73.635 6.215 8.583 1.00 0.00 C ATOM 255 NE2 HIS A 16 74.924 5.865 8.619 1.00 0.00 N ATOM 0 H HIS A 16 71.670 1.006 5.623 1.00 0.00 H new ATOM 0 HA HIS A 16 73.251 2.076 7.765 1.00 0.00 H new ATOM 0 HB2 HIS A 16 74.230 3.139 5.600 1.00 0.00 H new ATOM 0 HB3 HIS A 16 72.692 3.963 5.438 1.00 0.00 H new ATOM 0 HD1 HIS A 16 71.936 5.523 7.532 1.00 0.00 H new ATOM 0 HD2 HIS A 16 75.953 4.274 7.505 1.00 0.00 H new ATOM 0 HE1 HIS A 16 73.208 7.017 9.167 1.00 0.00 H new ATOM 263 N ALA A 17 70.764 2.143 8.358 1.00 0.00 N ATOM 264 CA ALA A 17 69.437 2.472 8.866 1.00 0.00 C ATOM 265 C ALA A 17 68.399 2.375 7.752 1.00 0.00 C ATOM 266 O ALA A 17 67.219 2.650 7.965 1.00 0.00 O ATOM 267 CB ALA A 17 69.435 3.888 9.445 1.00 0.00 C ATOM 0 H ALA A 17 71.240 1.395 8.863 1.00 0.00 H new ATOM 0 HA ALA A 17 69.181 1.759 9.650 1.00 0.00 H new ATOM 0 HB1 ALA A 17 68.440 4.126 9.822 1.00 0.00 H new ATOM 0 HB2 ALA A 17 70.156 3.949 10.260 1.00 0.00 H new ATOM 0 HB3 ALA A 17 69.707 4.600 8.666 1.00 0.00 H new ATOM 273 N ARG A 18 68.849 1.981 6.565 1.00 0.00 N ATOM 274 CA ARG A 18 67.949 1.851 5.424 1.00 0.00 C ATOM 275 C ARG A 18 66.650 1.168 5.840 1.00 0.00 C ATOM 276 O ARG A 18 65.566 1.738 5.706 1.00 0.00 O ATOM 277 CB ARG A 18 68.624 1.037 4.318 1.00 0.00 C ATOM 278 CG ARG A 18 68.934 1.949 3.130 1.00 0.00 C ATOM 279 CD ARG A 18 67.626 2.393 2.472 1.00 0.00 C ATOM 280 NE ARG A 18 67.467 1.744 1.175 1.00 0.00 N ATOM 281 CZ ARG A 18 68.055 2.229 0.087 1.00 0.00 C ATOM 282 NH1 ARG A 18 67.898 1.630 -1.062 1.00 0.00 N ATOM 283 NH2 ARG A 18 68.789 3.305 0.167 1.00 0.00 N ATOM 0 H ARG A 18 69.822 1.748 6.369 1.00 0.00 H new ATOM 0 HA ARG A 18 67.718 2.849 5.052 1.00 0.00 H new ATOM 0 HB2 ARG A 18 69.543 0.586 4.693 1.00 0.00 H new ATOM 0 HB3 ARG A 18 67.973 0.221 4.004 1.00 0.00 H new ATOM 0 HG2 ARG A 18 69.499 2.819 3.464 1.00 0.00 H new ATOM 0 HG3 ARG A 18 69.557 1.423 2.407 1.00 0.00 H new ATOM 0 HD2 ARG A 18 66.783 2.144 3.117 1.00 0.00 H new ATOM 0 HD3 ARG A 18 67.623 3.476 2.347 1.00 0.00 H new ATOM 0 HE ARG A 18 66.894 0.903 1.102 1.00 0.00 H new ATOM 0 HH11 ARG A 18 67.324 0.789 -1.125 1.00 0.00 H new ATOM 0 HH12 ARG A 18 68.350 2.003 -1.897 1.00 0.00 H new ATOM 0 HH21 ARG A 18 68.911 3.773 1.065 1.00 0.00 H new ATOM 0 HH22 ARG A 18 69.241 3.678 -0.668 1.00 0.00 H new ATOM 297 N PRO A 19 66.745 -0.033 6.338 1.00 0.00 N ATOM 298 CA PRO A 19 65.559 -0.818 6.786 1.00 0.00 C ATOM 299 C PRO A 19 64.942 -0.249 8.062 1.00 0.00 C ATOM 300 O PRO A 19 63.738 -0.003 8.123 1.00 0.00 O ATOM 301 CB PRO A 19 66.119 -2.222 7.029 1.00 0.00 C ATOM 302 CG PRO A 19 67.577 -2.031 7.290 1.00 0.00 C ATOM 303 CD PRO A 19 68.000 -0.776 6.528 1.00 0.00 C ATOM 0 HA PRO A 19 64.755 -0.799 6.050 1.00 0.00 H new ATOM 0 HB2 PRO A 19 65.628 -2.699 7.877 1.00 0.00 H new ATOM 0 HB3 PRO A 19 65.956 -2.865 6.164 1.00 0.00 H new ATOM 0 HG2 PRO A 19 67.767 -1.918 8.357 1.00 0.00 H new ATOM 0 HG3 PRO A 19 68.147 -2.898 6.955 1.00 0.00 H new ATOM 0 HD2 PRO A 19 68.727 -0.193 7.093 1.00 0.00 H new ATOM 0 HD3 PRO A 19 68.464 -1.026 5.574 1.00 0.00 H new ATOM 311 N ALA A 20 65.776 -0.043 9.075 1.00 0.00 N ATOM 312 CA ALA A 20 65.301 0.499 10.343 1.00 0.00 C ATOM 313 C ALA A 20 64.504 1.779 10.113 1.00 0.00 C ATOM 314 O ALA A 20 63.352 1.888 10.534 1.00 0.00 O ATOM 315 CB ALA A 20 66.488 0.794 11.262 1.00 0.00 C ATOM 0 H ALA A 20 66.776 -0.241 9.044 1.00 0.00 H new ATOM 0 HA ALA A 20 64.653 -0.241 10.813 1.00 0.00 H new ATOM 0 HB1 ALA A 20 66.125 1.198 12.207 1.00 0.00 H new ATOM 0 HB2 ALA A 20 67.040 -0.127 11.450 1.00 0.00 H new ATOM 0 HB3 ALA A 20 67.146 1.521 10.785 1.00 0.00 H new ATOM 321 N MET A 21 65.123 2.743 9.442 1.00 0.00 N ATOM 322 CA MET A 21 64.461 4.012 9.161 1.00 0.00 C ATOM 323 C MET A 21 63.181 3.782 8.363 1.00 0.00 C ATOM 324 O MET A 21 62.129 4.332 8.687 1.00 0.00 O ATOM 325 CB MET A 21 65.398 4.927 8.372 1.00 0.00 C ATOM 326 CG MET A 21 66.398 5.582 9.328 1.00 0.00 C ATOM 327 SD MET A 21 65.525 6.176 10.797 1.00 0.00 S ATOM 328 CE MET A 21 65.000 7.770 10.120 1.00 0.00 C ATOM 0 H MET A 21 66.076 2.672 9.084 1.00 0.00 H new ATOM 0 HA MET A 21 64.206 4.485 10.109 1.00 0.00 H new ATOM 0 HB2 MET A 21 65.928 4.354 7.612 1.00 0.00 H new ATOM 0 HB3 MET A 21 64.823 5.692 7.851 1.00 0.00 H new ATOM 0 HG2 MET A 21 67.168 4.865 9.614 1.00 0.00 H new ATOM 0 HG3 MET A 21 66.903 6.411 8.832 1.00 0.00 H new ATOM 0 HE1 MET A 21 64.432 8.316 10.873 1.00 0.00 H new ATOM 0 HE2 MET A 21 65.877 8.351 9.835 1.00 0.00 H new ATOM 0 HE3 MET A 21 64.374 7.604 9.243 1.00 0.00 H new ATOM 338 N LYS A 22 63.280 2.964 7.319 1.00 0.00 N ATOM 339 CA LYS A 22 62.122 2.668 6.483 1.00 0.00 C ATOM 340 C LYS A 22 61.026 1.996 7.303 1.00 0.00 C ATOM 341 O LYS A 22 59.840 2.257 7.104 1.00 0.00 O ATOM 342 CB LYS A 22 62.533 1.751 5.329 1.00 0.00 C ATOM 343 CG LYS A 22 61.364 1.600 4.354 1.00 0.00 C ATOM 344 CD LYS A 22 61.824 0.822 3.120 1.00 0.00 C ATOM 345 CE LYS A 22 60.693 0.782 2.090 1.00 0.00 C ATOM 346 NZ LYS A 22 59.513 0.084 2.674 1.00 0.00 N ATOM 0 H LYS A 22 64.142 2.498 7.034 1.00 0.00 H new ATOM 0 HA LYS A 22 61.737 3.606 6.083 1.00 0.00 H new ATOM 0 HB2 LYS A 22 63.399 2.165 4.813 1.00 0.00 H new ATOM 0 HB3 LYS A 22 62.828 0.775 5.714 1.00 0.00 H new ATOM 0 HG2 LYS A 22 60.538 1.079 4.838 1.00 0.00 H new ATOM 0 HG3 LYS A 22 60.993 2.582 4.060 1.00 0.00 H new ATOM 0 HD2 LYS A 22 62.707 1.293 2.688 1.00 0.00 H new ATOM 0 HD3 LYS A 22 62.110 -0.192 3.402 1.00 0.00 H new ATOM 0 HE2 LYS A 22 60.420 1.795 1.794 1.00 0.00 H new ATOM 0 HE3 LYS A 22 61.025 0.266 1.189 1.00 0.00 H new ATOM 0 HZ1 LYS A 22 58.833 -0.139 1.919 1.00 0.00 H new ATOM 0 HZ2 LYS A 22 59.823 -0.797 3.133 1.00 0.00 H new ATOM 0 HZ3 LYS A 22 59.059 0.700 3.378 1.00 0.00 H new ATOM 360 N LEU A 23 61.432 1.130 8.227 1.00 0.00 N ATOM 361 CA LEU A 23 60.475 0.426 9.072 1.00 0.00 C ATOM 362 C LEU A 23 59.480 1.406 9.687 1.00 0.00 C ATOM 363 O LEU A 23 58.269 1.200 9.621 1.00 0.00 O ATOM 364 CB LEU A 23 61.212 -0.321 10.185 1.00 0.00 C ATOM 365 CG LEU A 23 61.310 -1.804 9.827 1.00 0.00 C ATOM 366 CD1 LEU A 23 62.353 -2.478 10.720 1.00 0.00 C ATOM 367 CD2 LEU A 23 59.949 -2.471 10.043 1.00 0.00 C ATOM 0 H LEU A 23 62.409 0.901 8.408 1.00 0.00 H new ATOM 0 HA LEU A 23 59.930 -0.288 8.454 1.00 0.00 H new ATOM 0 HB2 LEU A 23 62.209 0.098 10.320 1.00 0.00 H new ATOM 0 HB3 LEU A 23 60.684 -0.199 11.131 1.00 0.00 H new ATOM 0 HG LEU A 23 61.605 -1.906 8.783 1.00 0.00 H new ATOM 0 HD11 LEU A 23 62.422 -3.535 10.464 1.00 0.00 H new ATOM 0 HD12 LEU A 23 63.323 -2.004 10.569 1.00 0.00 H new ATOM 0 HD13 LEU A 23 62.058 -2.376 11.764 1.00 0.00 H new ATOM 0 HD21 LEU A 23 60.018 -3.529 9.788 1.00 0.00 H new ATOM 0 HD22 LEU A 23 59.655 -2.368 11.088 1.00 0.00 H new ATOM 0 HD23 LEU A 23 59.204 -1.992 9.407 1.00 0.00 H new ATOM 379 N PHE A 24 60.002 2.473 10.284 1.00 0.00 N ATOM 380 CA PHE A 24 59.150 3.480 10.907 1.00 0.00 C ATOM 381 C PHE A 24 58.048 3.918 9.948 1.00 0.00 C ATOM 382 O PHE A 24 56.892 4.066 10.342 1.00 0.00 O ATOM 383 CB PHE A 24 59.987 4.693 11.314 1.00 0.00 C ATOM 384 CG PHE A 24 60.391 4.563 12.764 1.00 0.00 C ATOM 385 CD1 PHE A 24 61.527 3.824 13.111 1.00 0.00 C ATOM 386 CD2 PHE A 24 59.628 5.182 13.761 1.00 0.00 C ATOM 387 CE1 PHE A 24 61.901 3.703 14.454 1.00 0.00 C ATOM 388 CE2 PHE A 24 60.001 5.061 15.105 1.00 0.00 C ATOM 389 CZ PHE A 24 61.138 4.322 15.451 1.00 0.00 C ATOM 0 H PHE A 24 61.002 2.662 10.349 1.00 0.00 H new ATOM 0 HA PHE A 24 58.691 3.042 11.793 1.00 0.00 H new ATOM 0 HB2 PHE A 24 60.873 4.765 10.684 1.00 0.00 H new ATOM 0 HB3 PHE A 24 59.415 5.609 11.165 1.00 0.00 H new ATOM 0 HD1 PHE A 24 62.116 3.347 12.342 1.00 0.00 H new ATOM 0 HD2 PHE A 24 58.751 5.753 13.493 1.00 0.00 H new ATOM 0 HE1 PHE A 24 62.778 3.132 14.721 1.00 0.00 H new ATOM 0 HE2 PHE A 24 59.412 5.538 15.874 1.00 0.00 H new ATOM 0 HZ PHE A 24 61.427 4.229 16.488 1.00 0.00 H new ATOM 399 N GLU A 25 58.415 4.121 8.686 1.00 0.00 N ATOM 400 CA GLU A 25 57.447 4.542 7.680 1.00 0.00 C ATOM 401 C GLU A 25 56.606 3.355 7.218 1.00 0.00 C ATOM 402 O GLU A 25 55.423 3.503 6.912 1.00 0.00 O ATOM 403 CB GLU A 25 58.174 5.152 6.479 1.00 0.00 C ATOM 404 CG GLU A 25 57.148 5.647 5.458 1.00 0.00 C ATOM 405 CD GLU A 25 57.856 6.345 4.302 1.00 0.00 C ATOM 406 OE1 GLU A 25 59.070 6.455 4.358 1.00 0.00 O ATOM 407 OE2 GLU A 25 57.175 6.759 3.380 1.00 0.00 O ATOM 0 H GLU A 25 59.367 4.002 8.338 1.00 0.00 H new ATOM 0 HA GLU A 25 56.789 5.289 8.125 1.00 0.00 H new ATOM 0 HB2 GLU A 25 58.806 5.978 6.805 1.00 0.00 H new ATOM 0 HB3 GLU A 25 58.829 4.410 6.022 1.00 0.00 H new ATOM 0 HG2 GLU A 25 56.562 4.808 5.083 1.00 0.00 H new ATOM 0 HG3 GLU A 25 56.450 6.334 5.936 1.00 0.00 H new ATOM 414 N LEU A 26 57.225 2.180 7.171 1.00 0.00 N ATOM 415 CA LEU A 26 56.524 0.975 6.746 1.00 0.00 C ATOM 416 C LEU A 26 55.399 0.639 7.719 1.00 0.00 C ATOM 417 O LEU A 26 54.281 0.329 7.307 1.00 0.00 O ATOM 418 CB LEU A 26 57.502 -0.199 6.670 1.00 0.00 C ATOM 419 CG LEU A 26 56.919 -1.293 5.776 1.00 0.00 C ATOM 420 CD1 LEU A 26 57.307 -1.026 4.321 1.00 0.00 C ATOM 421 CD2 LEU A 26 57.474 -2.652 6.208 1.00 0.00 C ATOM 0 H LEU A 26 58.204 2.037 7.420 1.00 0.00 H new ATOM 0 HA LEU A 26 56.095 1.155 5.760 1.00 0.00 H new ATOM 0 HB2 LEU A 26 58.460 0.137 6.273 1.00 0.00 H new ATOM 0 HB3 LEU A 26 57.691 -0.593 7.668 1.00 0.00 H new ATOM 0 HG LEU A 26 55.833 -1.295 5.868 1.00 0.00 H new ATOM 0 HD11 LEU A 26 56.891 -1.807 3.684 1.00 0.00 H new ATOM 0 HD12 LEU A 26 56.914 -0.058 4.012 1.00 0.00 H new ATOM 0 HD13 LEU A 26 58.393 -1.023 4.229 1.00 0.00 H new ATOM 0 HD21 LEU A 26 57.059 -3.433 5.571 1.00 0.00 H new ATOM 0 HD22 LEU A 26 58.560 -2.647 6.116 1.00 0.00 H new ATOM 0 HD23 LEU A 26 57.199 -2.845 7.245 1.00 0.00 H new ATOM 433 N MET A 27 55.702 0.703 9.011 1.00 0.00 N ATOM 434 CA MET A 27 54.706 0.403 10.035 1.00 0.00 C ATOM 435 C MET A 27 53.534 1.375 9.942 1.00 0.00 C ATOM 436 O MET A 27 52.385 0.999 10.174 1.00 0.00 O ATOM 437 CB MET A 27 55.341 0.499 11.423 1.00 0.00 C ATOM 438 CG MET A 27 56.208 -0.736 11.675 1.00 0.00 C ATOM 439 SD MET A 27 56.830 -0.700 13.375 1.00 0.00 S ATOM 440 CE MET A 27 58.412 0.103 13.020 1.00 0.00 C ATOM 0 H MET A 27 56.621 0.958 9.373 1.00 0.00 H new ATOM 0 HA MET A 27 54.338 -0.610 9.873 1.00 0.00 H new ATOM 0 HB2 MET A 27 55.947 1.402 11.496 1.00 0.00 H new ATOM 0 HB3 MET A 27 54.565 0.573 12.185 1.00 0.00 H new ATOM 0 HG2 MET A 27 55.626 -1.642 11.509 1.00 0.00 H new ATOM 0 HG3 MET A 27 57.041 -0.758 10.972 1.00 0.00 H new ATOM 0 HE1 MET A 27 58.731 0.678 13.889 1.00 0.00 H new ATOM 0 HE2 MET A 27 59.161 -0.655 12.791 1.00 0.00 H new ATOM 0 HE3 MET A 27 58.298 0.770 12.165 1.00 0.00 H new ATOM 450 N GLN A 28 53.832 2.623 9.599 1.00 0.00 N ATOM 451 CA GLN A 28 52.794 3.641 9.478 1.00 0.00 C ATOM 452 C GLN A 28 51.745 3.217 8.455 1.00 0.00 C ATOM 453 O GLN A 28 50.546 3.398 8.671 1.00 0.00 O ATOM 454 CB GLN A 28 53.416 4.972 9.053 1.00 0.00 C ATOM 455 CG GLN A 28 52.403 6.100 9.263 1.00 0.00 C ATOM 456 CD GLN A 28 53.057 7.447 8.981 1.00 0.00 C ATOM 457 OE1 GLN A 28 54.250 7.509 8.684 1.00 0.00 O ATOM 458 NE2 GLN A 28 52.344 8.538 9.058 1.00 0.00 N ATOM 0 H GLN A 28 54.777 2.953 9.401 1.00 0.00 H new ATOM 0 HA GLN A 28 52.312 3.759 10.448 1.00 0.00 H new ATOM 0 HB2 GLN A 28 54.318 5.166 9.634 1.00 0.00 H new ATOM 0 HB3 GLN A 28 53.715 4.928 8.006 1.00 0.00 H new ATOM 0 HG2 GLN A 28 51.546 5.958 8.605 1.00 0.00 H new ATOM 0 HG3 GLN A 28 52.027 6.076 10.286 1.00 0.00 H new ATOM 0 HE21 GLN A 28 51.356 8.485 9.304 1.00 0.00 H new ATOM 0 HE22 GLN A 28 52.775 9.443 8.872 1.00 0.00 H new ATOM 467 N GLY A 29 52.203 2.653 7.343 1.00 0.00 N ATOM 468 CA GLY A 29 51.295 2.208 6.294 1.00 0.00 C ATOM 469 C GLY A 29 50.944 0.733 6.466 1.00 0.00 C ATOM 470 O GLY A 29 49.922 0.266 5.964 1.00 0.00 O ATOM 0 H GLY A 29 53.191 2.494 7.146 1.00 0.00 H new ATOM 0 HA2 GLY A 29 50.385 2.807 6.317 1.00 0.00 H new ATOM 0 HA3 GLY A 29 51.755 2.365 5.319 1.00 0.00 H new ATOM 474 N PHE A 30 51.799 0.006 7.178 1.00 0.00 N ATOM 475 CA PHE A 30 51.569 -1.415 7.410 1.00 0.00 C ATOM 476 C PHE A 30 50.786 -1.627 8.701 1.00 0.00 C ATOM 477 O PHE A 30 51.189 -1.161 9.767 1.00 0.00 O ATOM 478 CB PHE A 30 52.906 -2.153 7.495 1.00 0.00 C ATOM 479 CG PHE A 30 53.375 -2.509 6.105 1.00 0.00 C ATOM 480 CD1 PHE A 30 53.241 -1.586 5.062 1.00 0.00 C ATOM 481 CD2 PHE A 30 53.946 -3.764 5.859 1.00 0.00 C ATOM 482 CE1 PHE A 30 53.676 -1.916 3.773 1.00 0.00 C ATOM 483 CE2 PHE A 30 54.382 -4.095 4.570 1.00 0.00 C ATOM 484 CZ PHE A 30 54.247 -3.171 3.528 1.00 0.00 C ATOM 0 H PHE A 30 52.651 0.374 7.601 1.00 0.00 H new ATOM 0 HA PHE A 30 50.988 -1.811 6.577 1.00 0.00 H new ATOM 0 HB2 PHE A 30 53.648 -1.527 7.991 1.00 0.00 H new ATOM 0 HB3 PHE A 30 52.797 -3.056 8.096 1.00 0.00 H new ATOM 0 HD1 PHE A 30 52.801 -0.618 5.252 1.00 0.00 H new ATOM 0 HD2 PHE A 30 54.050 -4.477 6.664 1.00 0.00 H new ATOM 0 HE1 PHE A 30 53.571 -1.203 2.968 1.00 0.00 H new ATOM 0 HE2 PHE A 30 54.822 -5.063 4.380 1.00 0.00 H new ATOM 0 HZ PHE A 30 54.583 -3.426 2.534 1.00 0.00 H new ATOM 494 N ASP A 31 49.666 -2.335 8.599 1.00 0.00 N ATOM 495 CA ASP A 31 48.834 -2.604 9.767 1.00 0.00 C ATOM 496 C ASP A 31 49.435 -3.729 10.604 1.00 0.00 C ATOM 497 O ASP A 31 49.221 -4.907 10.323 1.00 0.00 O ATOM 498 CB ASP A 31 47.422 -2.993 9.324 1.00 0.00 C ATOM 499 CG ASP A 31 46.691 -1.770 8.781 1.00 0.00 C ATOM 500 OD1 ASP A 31 47.214 -0.678 8.927 1.00 0.00 O ATOM 501 OD2 ASP A 31 45.619 -1.944 8.226 1.00 0.00 O ATOM 0 H ASP A 31 49.315 -2.730 7.727 1.00 0.00 H new ATOM 0 HA ASP A 31 48.788 -1.700 10.374 1.00 0.00 H new ATOM 0 HB2 ASP A 31 47.472 -3.767 8.558 1.00 0.00 H new ATOM 0 HB3 ASP A 31 46.871 -3.413 10.165 1.00 0.00 H new ATOM 506 N ALA A 32 50.186 -3.355 11.635 1.00 0.00 N ATOM 507 CA ALA A 32 50.813 -4.340 12.507 1.00 0.00 C ATOM 508 C ALA A 32 51.994 -3.723 13.251 1.00 0.00 C ATOM 509 O ALA A 32 52.620 -2.781 12.768 1.00 0.00 O ATOM 510 CB ALA A 32 51.296 -5.535 11.683 1.00 0.00 C ATOM 0 H ALA A 32 50.374 -2.384 11.885 1.00 0.00 H new ATOM 0 HA ALA A 32 50.074 -4.675 13.235 1.00 0.00 H new ATOM 0 HB1 ALA A 32 51.763 -6.266 12.342 1.00 0.00 H new ATOM 0 HB2 ALA A 32 50.447 -5.994 11.176 1.00 0.00 H new ATOM 0 HB3 ALA A 32 52.022 -5.197 10.943 1.00 0.00 H new ATOM 516 N GLU A 33 52.290 -4.262 14.430 1.00 0.00 N ATOM 517 CA GLU A 33 53.398 -3.755 15.231 1.00 0.00 C ATOM 518 C GLU A 33 54.624 -4.651 15.083 1.00 0.00 C ATOM 519 O GLU A 33 54.533 -5.870 15.223 1.00 0.00 O ATOM 520 CB GLU A 33 52.988 -3.688 16.704 1.00 0.00 C ATOM 521 CG GLU A 33 54.089 -2.996 17.510 1.00 0.00 C ATOM 522 CD GLU A 33 53.623 -2.771 18.944 1.00 0.00 C ATOM 523 OE1 GLU A 33 52.481 -3.088 19.231 1.00 0.00 O ATOM 524 OE2 GLU A 33 54.416 -2.285 19.735 1.00 0.00 O ATOM 0 H GLU A 33 51.783 -5.042 14.848 1.00 0.00 H new ATOM 0 HA GLU A 33 53.649 -2.755 14.876 1.00 0.00 H new ATOM 0 HB2 GLU A 33 52.050 -3.142 16.807 1.00 0.00 H new ATOM 0 HB3 GLU A 33 52.816 -4.693 17.091 1.00 0.00 H new ATOM 0 HG2 GLU A 33 54.993 -3.605 17.504 1.00 0.00 H new ATOM 0 HG3 GLU A 33 54.344 -2.042 17.048 1.00 0.00 H new ATOM 531 N VAL A 34 55.768 -4.037 14.799 1.00 0.00 N ATOM 532 CA VAL A 34 57.007 -4.789 14.634 1.00 0.00 C ATOM 533 C VAL A 34 57.916 -4.595 15.844 1.00 0.00 C ATOM 534 O VAL A 34 58.062 -3.483 16.350 1.00 0.00 O ATOM 535 CB VAL A 34 57.732 -4.330 13.369 1.00 0.00 C ATOM 536 CG1 VAL A 34 59.080 -5.045 13.264 1.00 0.00 C ATOM 537 CG2 VAL A 34 56.880 -4.667 12.143 1.00 0.00 C ATOM 0 H VAL A 34 55.863 -3.029 14.679 1.00 0.00 H new ATOM 0 HA VAL A 34 56.759 -5.847 14.546 1.00 0.00 H new ATOM 0 HB VAL A 34 57.895 -3.253 13.415 1.00 0.00 H new ATOM 0 HG11 VAL A 34 59.596 -4.717 12.362 1.00 0.00 H new ATOM 0 HG12 VAL A 34 59.688 -4.806 14.137 1.00 0.00 H new ATOM 0 HG13 VAL A 34 58.918 -6.122 13.218 1.00 0.00 H new ATOM 0 HG21 VAL A 34 57.396 -4.340 11.240 1.00 0.00 H new ATOM 0 HG22 VAL A 34 56.717 -5.744 12.098 1.00 0.00 H new ATOM 0 HG23 VAL A 34 55.919 -4.157 12.216 1.00 0.00 H new ATOM 547 N LEU A 35 58.523 -5.684 16.303 1.00 0.00 N ATOM 548 CA LEU A 35 59.415 -5.621 17.455 1.00 0.00 C ATOM 549 C LEU A 35 60.671 -6.449 17.207 1.00 0.00 C ATOM 550 O LEU A 35 60.597 -7.582 16.730 1.00 0.00 O ATOM 551 CB LEU A 35 58.695 -6.142 18.701 1.00 0.00 C ATOM 552 CG LEU A 35 59.707 -6.334 19.832 1.00 0.00 C ATOM 553 CD1 LEU A 35 59.142 -5.751 21.128 1.00 0.00 C ATOM 554 CD2 LEU A 35 59.978 -7.829 20.023 1.00 0.00 C ATOM 0 H LEU A 35 58.415 -6.614 15.899 1.00 0.00 H new ATOM 0 HA LEU A 35 59.705 -4.582 17.610 1.00 0.00 H new ATOM 0 HB2 LEU A 35 57.920 -5.439 19.007 1.00 0.00 H new ATOM 0 HB3 LEU A 35 58.198 -7.086 18.479 1.00 0.00 H new ATOM 0 HG LEU A 35 60.636 -5.823 19.579 1.00 0.00 H new ATOM 0 HD11 LEU A 35 59.863 -5.888 21.934 1.00 0.00 H new ATOM 0 HD12 LEU A 35 58.946 -4.687 20.993 1.00 0.00 H new ATOM 0 HD13 LEU A 35 58.213 -6.262 21.382 1.00 0.00 H new ATOM 0 HD21 LEU A 35 60.699 -7.968 20.829 1.00 0.00 H new ATOM 0 HD22 LEU A 35 59.048 -8.338 20.276 1.00 0.00 H new ATOM 0 HD23 LEU A 35 60.380 -8.247 19.100 1.00 0.00 H new ATOM 566 N LEU A 36 61.825 -5.877 17.536 1.00 0.00 N ATOM 567 CA LEU A 36 63.094 -6.572 17.345 1.00 0.00 C ATOM 568 C LEU A 36 63.642 -7.060 18.682 1.00 0.00 C ATOM 569 O LEU A 36 63.380 -6.464 19.726 1.00 0.00 O ATOM 570 CB LEU A 36 64.109 -5.637 16.686 1.00 0.00 C ATOM 571 CG LEU A 36 63.505 -5.044 15.412 1.00 0.00 C ATOM 572 CD1 LEU A 36 63.428 -3.521 15.543 1.00 0.00 C ATOM 573 CD2 LEU A 36 64.386 -5.407 14.214 1.00 0.00 C ATOM 0 H LEU A 36 61.908 -4.941 17.933 1.00 0.00 H new ATOM 0 HA LEU A 36 62.922 -7.433 16.699 1.00 0.00 H new ATOM 0 HB2 LEU A 36 64.385 -4.839 17.375 1.00 0.00 H new ATOM 0 HB3 LEU A 36 65.022 -6.183 16.448 1.00 0.00 H new ATOM 0 HG LEU A 36 62.503 -5.447 15.264 1.00 0.00 H new ATOM 0 HD11 LEU A 36 62.998 -3.099 14.635 1.00 0.00 H new ATOM 0 HD12 LEU A 36 62.802 -3.260 16.396 1.00 0.00 H new ATOM 0 HD13 LEU A 36 64.430 -3.117 15.691 1.00 0.00 H new ATOM 0 HD21 LEU A 36 63.957 -4.985 13.305 1.00 0.00 H new ATOM 0 HD22 LEU A 36 65.388 -5.004 14.363 1.00 0.00 H new ATOM 0 HD23 LEU A 36 64.442 -6.491 14.119 1.00 0.00 H new ATOM 585 N ARG A 37 64.404 -8.148 18.642 1.00 0.00 N ATOM 586 CA ARG A 37 64.984 -8.708 19.858 1.00 0.00 C ATOM 587 C ARG A 37 66.331 -9.358 19.559 1.00 0.00 C ATOM 588 O ARG A 37 66.469 -10.104 18.589 1.00 0.00 O ATOM 589 CB ARG A 37 64.035 -9.745 20.459 1.00 0.00 C ATOM 590 CG ARG A 37 63.063 -9.054 21.417 1.00 0.00 C ATOM 591 CD ARG A 37 61.877 -9.979 21.698 1.00 0.00 C ATOM 592 NE ARG A 37 60.978 -9.366 22.668 1.00 0.00 N ATOM 593 CZ ARG A 37 59.803 -9.916 22.958 1.00 0.00 C ATOM 594 NH1 ARG A 37 59.015 -9.348 23.829 1.00 0.00 N ATOM 595 NH2 ARG A 37 59.438 -11.023 22.371 1.00 0.00 N ATOM 0 H ARG A 37 64.633 -8.656 17.788 1.00 0.00 H new ATOM 0 HA ARG A 37 65.136 -7.899 20.572 1.00 0.00 H new ATOM 0 HB2 ARG A 37 63.483 -10.251 19.667 1.00 0.00 H new ATOM 0 HB3 ARG A 37 64.603 -10.509 20.989 1.00 0.00 H new ATOM 0 HG2 ARG A 37 63.571 -8.803 22.348 1.00 0.00 H new ATOM 0 HG3 ARG A 37 62.712 -8.118 20.983 1.00 0.00 H new ATOM 0 HD2 ARG A 37 61.339 -10.184 20.772 1.00 0.00 H new ATOM 0 HD3 ARG A 37 62.235 -10.936 22.077 1.00 0.00 H new ATOM 0 HE ARG A 37 61.255 -8.501 23.132 1.00 0.00 H new ATOM 0 HH11 ARG A 37 59.301 -8.482 24.287 1.00 0.00 H new ATOM 0 HH12 ARG A 37 58.113 -9.769 24.052 1.00 0.00 H new ATOM 0 HH21 ARG A 37 60.054 -11.466 21.690 1.00 0.00 H new ATOM 0 HH22 ARG A 37 58.536 -11.445 22.594 1.00 0.00 H new ATOM 609 N ASN A 38 67.320 -9.074 20.400 1.00 0.00 N ATOM 610 CA ASN A 38 68.651 -9.638 20.216 1.00 0.00 C ATOM 611 C ASN A 38 68.799 -10.933 21.011 1.00 0.00 C ATOM 612 O ASN A 38 68.075 -11.163 21.980 1.00 0.00 O ATOM 613 CB ASN A 38 69.712 -8.634 20.673 1.00 0.00 C ATOM 614 CG ASN A 38 69.740 -7.439 19.726 1.00 0.00 C ATOM 615 OD1 ASN A 38 69.159 -7.491 18.641 1.00 0.00 O ATOM 616 ND2 ASN A 38 70.385 -6.358 20.073 1.00 0.00 N ATOM 0 H ASN A 38 67.226 -8.461 21.210 1.00 0.00 H new ATOM 0 HA ASN A 38 68.789 -9.856 19.157 1.00 0.00 H new ATOM 0 HB2 ASN A 38 69.495 -8.300 21.688 1.00 0.00 H new ATOM 0 HB3 ASN A 38 70.691 -9.112 20.697 1.00 0.00 H new ATOM 0 HD21 ASN A 38 70.408 -5.554 19.445 1.00 0.00 H new ATOM 0 HD22 ASN A 38 70.865 -6.317 20.972 1.00 0.00 H new ATOM 623 N ASP A 39 69.739 -11.773 20.593 1.00 0.00 N ATOM 624 CA ASP A 39 69.972 -13.042 21.274 1.00 0.00 C ATOM 625 C ASP A 39 70.185 -12.818 22.767 1.00 0.00 C ATOM 626 O ASP A 39 69.838 -13.667 23.589 1.00 0.00 O ATOM 627 CB ASP A 39 71.199 -13.735 20.680 1.00 0.00 C ATOM 628 CG ASP A 39 71.341 -15.136 21.267 1.00 0.00 C ATOM 629 OD1 ASP A 39 70.613 -15.444 22.197 1.00 0.00 O ATOM 630 OD2 ASP A 39 72.176 -15.879 20.780 1.00 0.00 O ATOM 0 H ASP A 39 70.348 -11.601 19.793 1.00 0.00 H new ATOM 0 HA ASP A 39 69.095 -13.674 21.135 1.00 0.00 H new ATOM 0 HB2 ASP A 39 71.105 -13.794 19.596 1.00 0.00 H new ATOM 0 HB3 ASP A 39 72.095 -13.151 20.891 1.00 0.00 H new ATOM 635 N GLU A 40 70.758 -11.669 23.113 1.00 0.00 N ATOM 636 CA GLU A 40 71.013 -11.344 24.511 1.00 0.00 C ATOM 637 C GLU A 40 69.701 -11.143 25.264 1.00 0.00 C ATOM 638 O GLU A 40 69.683 -11.068 26.492 1.00 0.00 O ATOM 639 CB GLU A 40 71.858 -10.072 24.607 1.00 0.00 C ATOM 640 CG GLU A 40 73.235 -10.327 23.992 1.00 0.00 C ATOM 641 CD GLU A 40 74.031 -9.027 23.938 1.00 0.00 C ATOM 642 OE1 GLU A 40 73.445 -7.986 24.187 1.00 0.00 O ATOM 643 OE2 GLU A 40 75.214 -9.092 23.649 1.00 0.00 O ATOM 0 H GLU A 40 71.052 -10.953 22.449 1.00 0.00 H new ATOM 0 HA GLU A 40 71.555 -12.175 24.963 1.00 0.00 H new ATOM 0 HB2 GLU A 40 71.362 -9.253 24.087 1.00 0.00 H new ATOM 0 HB3 GLU A 40 71.964 -9.770 25.649 1.00 0.00 H new ATOM 0 HG2 GLU A 40 73.774 -11.069 24.581 1.00 0.00 H new ATOM 0 HG3 GLU A 40 73.124 -10.737 22.988 1.00 0.00 H new ATOM 650 N GLY A 41 68.605 -11.059 24.517 1.00 0.00 N ATOM 651 CA GLY A 41 67.292 -10.867 25.124 1.00 0.00 C ATOM 652 C GLY A 41 66.955 -9.385 25.236 1.00 0.00 C ATOM 653 O GLY A 41 66.038 -9.000 25.962 1.00 0.00 O ATOM 0 H GLY A 41 68.599 -11.120 23.499 1.00 0.00 H new ATOM 0 HA2 GLY A 41 66.533 -11.372 24.526 1.00 0.00 H new ATOM 0 HA3 GLY A 41 67.274 -11.324 26.114 1.00 0.00 H new ATOM 657 N THR A 42 67.699 -8.556 24.510 1.00 0.00 N ATOM 658 CA THR A 42 67.469 -7.117 24.535 1.00 0.00 C ATOM 659 C THR A 42 66.378 -6.731 23.541 1.00 0.00 C ATOM 660 O THR A 42 66.557 -6.858 22.329 1.00 0.00 O ATOM 661 CB THR A 42 68.763 -6.374 24.191 1.00 0.00 C ATOM 662 OG1 THR A 42 69.553 -6.239 25.364 1.00 0.00 O ATOM 663 CG2 THR A 42 68.426 -4.989 23.637 1.00 0.00 C ATOM 0 H THR A 42 68.461 -8.854 23.901 1.00 0.00 H new ATOM 0 HA THR A 42 67.146 -6.837 25.538 1.00 0.00 H new ATOM 0 HB THR A 42 69.319 -6.936 23.440 1.00 0.00 H new ATOM 0 HG1 THR A 42 70.383 -5.765 25.147 1.00 0.00 H new ATOM 0 HG21 THR A 42 69.348 -4.461 23.392 1.00 0.00 H new ATOM 0 HG22 THR A 42 67.819 -5.095 22.738 1.00 0.00 H new ATOM 0 HG23 THR A 42 67.871 -4.423 24.385 1.00 0.00 H new ATOM 671 N GLU A 43 65.249 -6.261 24.060 1.00 0.00 N ATOM 672 CA GLU A 43 64.136 -5.861 23.208 1.00 0.00 C ATOM 673 C GLU A 43 64.460 -4.560 22.480 1.00 0.00 C ATOM 674 O GLU A 43 64.363 -3.475 23.054 1.00 0.00 O ATOM 675 CB GLU A 43 62.873 -5.676 24.051 1.00 0.00 C ATOM 676 CG GLU A 43 62.612 -6.943 24.867 1.00 0.00 C ATOM 677 CD GLU A 43 61.353 -6.771 25.711 1.00 0.00 C ATOM 678 OE1 GLU A 43 61.204 -5.717 26.308 1.00 0.00 O ATOM 679 OE2 GLU A 43 60.558 -7.695 25.748 1.00 0.00 O ATOM 0 H GLU A 43 65.081 -6.148 25.060 1.00 0.00 H new ATOM 0 HA GLU A 43 63.967 -6.645 22.470 1.00 0.00 H new ATOM 0 HB2 GLU A 43 62.989 -4.820 24.716 1.00 0.00 H new ATOM 0 HB3 GLU A 43 62.020 -5.465 23.406 1.00 0.00 H new ATOM 0 HG2 GLU A 43 62.499 -7.798 24.200 1.00 0.00 H new ATOM 0 HG3 GLU A 43 63.466 -7.153 25.511 1.00 0.00 H new ATOM 686 N ALA A 44 64.843 -4.677 21.213 1.00 0.00 N ATOM 687 CA ALA A 44 65.179 -3.503 20.415 1.00 0.00 C ATOM 688 C ALA A 44 63.928 -2.920 19.765 1.00 0.00 C ATOM 689 O ALA A 44 63.846 -2.810 18.542 1.00 0.00 O ATOM 690 CB ALA A 44 66.191 -3.879 19.332 1.00 0.00 C ATOM 0 H ALA A 44 64.928 -5.566 20.719 1.00 0.00 H new ATOM 0 HA ALA A 44 65.615 -2.753 21.074 1.00 0.00 H new ATOM 0 HB1 ALA A 44 66.436 -2.997 18.741 1.00 0.00 H new ATOM 0 HB2 ALA A 44 67.097 -4.266 19.799 1.00 0.00 H new ATOM 0 HB3 ALA A 44 65.763 -4.643 18.683 1.00 0.00 H new ATOM 696 N GLU A 45 62.955 -2.551 20.592 1.00 0.00 N ATOM 697 CA GLU A 45 61.712 -1.981 20.086 1.00 0.00 C ATOM 698 C GLU A 45 61.994 -1.003 18.950 1.00 0.00 C ATOM 699 O GLU A 45 62.693 -0.007 19.134 1.00 0.00 O ATOM 700 CB GLU A 45 60.974 -1.237 21.195 1.00 0.00 C ATOM 701 CG GLU A 45 60.888 -2.131 22.418 1.00 0.00 C ATOM 702 CD GLU A 45 59.967 -1.508 23.462 1.00 0.00 C ATOM 703 OE1 GLU A 45 59.244 -2.252 24.105 1.00 0.00 O ATOM 704 OE2 GLU A 45 59.997 -0.297 23.604 1.00 0.00 O ATOM 0 H GLU A 45 63.002 -2.636 21.607 1.00 0.00 H new ATOM 0 HA GLU A 45 61.096 -2.802 19.720 1.00 0.00 H new ATOM 0 HB2 GLU A 45 61.497 -0.313 21.441 1.00 0.00 H new ATOM 0 HB3 GLU A 45 59.974 -0.959 20.861 1.00 0.00 H new ATOM 0 HG2 GLU A 45 60.514 -3.114 22.133 1.00 0.00 H new ATOM 0 HG3 GLU A 45 61.882 -2.278 22.841 1.00 0.00 H new ATOM 711 N ALA A 46 61.443 -1.294 17.775 1.00 0.00 N ATOM 712 CA ALA A 46 61.643 -0.432 16.615 1.00 0.00 C ATOM 713 C ALA A 46 61.124 0.974 16.897 1.00 0.00 C ATOM 714 O ALA A 46 61.651 1.956 16.376 1.00 0.00 O ATOM 715 CB ALA A 46 60.914 -1.013 15.402 1.00 0.00 C ATOM 0 H ALA A 46 60.860 -2.113 17.602 1.00 0.00 H new ATOM 0 HA ALA A 46 62.711 -0.378 16.405 1.00 0.00 H new ATOM 0 HB1 ALA A 46 61.068 -0.364 14.540 1.00 0.00 H new ATOM 0 HB2 ALA A 46 61.306 -2.006 15.183 1.00 0.00 H new ATOM 0 HB3 ALA A 46 59.848 -1.083 15.618 1.00 0.00 H new ATOM 721 N ASN A 47 60.089 1.062 17.726 1.00 0.00 N ATOM 722 CA ASN A 47 59.507 2.355 18.071 1.00 0.00 C ATOM 723 C ASN A 47 60.385 3.084 19.082 1.00 0.00 C ATOM 724 O ASN A 47 59.895 3.880 19.884 1.00 0.00 O ATOM 725 CB ASN A 47 58.108 2.158 18.655 1.00 0.00 C ATOM 726 CG ASN A 47 58.193 1.386 19.967 1.00 0.00 C ATOM 727 OD1 ASN A 47 59.279 1.221 20.521 1.00 0.00 O ATOM 728 ND2 ASN A 47 57.105 0.901 20.500 1.00 0.00 N ATOM 0 H ASN A 47 59.639 0.261 18.168 1.00 0.00 H new ATOM 0 HA ASN A 47 59.440 2.957 17.165 1.00 0.00 H new ATOM 0 HB2 ASN A 47 57.636 3.126 18.823 1.00 0.00 H new ATOM 0 HB3 ASN A 47 57.482 1.617 17.945 1.00 0.00 H new ATOM 0 HD21 ASN A 47 57.154 0.384 21.378 1.00 0.00 H new ATOM 0 HD22 ASN A 47 56.206 1.039 20.039 1.00 0.00 H new ATOM 735 N SER A 48 61.684 2.806 19.040 1.00 0.00 N ATOM 736 CA SER A 48 62.622 3.441 19.958 1.00 0.00 C ATOM 737 C SER A 48 63.988 3.607 19.300 1.00 0.00 C ATOM 738 O SER A 48 64.591 2.635 18.847 1.00 0.00 O ATOM 739 CB SER A 48 62.763 2.598 21.225 1.00 0.00 C ATOM 740 OG SER A 48 63.943 2.986 21.918 1.00 0.00 O ATOM 0 H SER A 48 62.109 2.150 18.385 1.00 0.00 H new ATOM 0 HA SER A 48 62.236 4.426 20.218 1.00 0.00 H new ATOM 0 HB2 SER A 48 61.891 2.733 21.865 1.00 0.00 H new ATOM 0 HB3 SER A 48 62.809 1.540 20.968 1.00 0.00 H new ATOM 0 HG SER A 48 64.036 2.448 22.732 1.00 0.00 H new ATOM 746 N VAL A 49 64.469 4.845 19.251 1.00 0.00 N ATOM 747 CA VAL A 49 65.765 5.127 18.645 1.00 0.00 C ATOM 748 C VAL A 49 66.886 4.483 19.454 1.00 0.00 C ATOM 749 O VAL A 49 67.899 4.056 18.900 1.00 0.00 O ATOM 750 CB VAL A 49 65.989 6.638 18.571 1.00 0.00 C ATOM 751 CG1 VAL A 49 65.168 7.221 17.420 1.00 0.00 C ATOM 752 CG2 VAL A 49 65.551 7.283 19.888 1.00 0.00 C ATOM 0 H VAL A 49 63.985 5.663 19.621 1.00 0.00 H new ATOM 0 HA VAL A 49 65.773 4.709 17.638 1.00 0.00 H new ATOM 0 HB VAL A 49 67.046 6.840 18.401 1.00 0.00 H new ATOM 0 HG11 VAL A 49 65.328 8.298 17.368 1.00 0.00 H new ATOM 0 HG12 VAL A 49 65.480 6.762 16.482 1.00 0.00 H new ATOM 0 HG13 VAL A 49 64.110 7.019 17.589 1.00 0.00 H new ATOM 0 HG21 VAL A 49 65.710 8.360 19.836 1.00 0.00 H new ATOM 0 HG22 VAL A 49 64.494 7.080 20.058 1.00 0.00 H new ATOM 0 HG23 VAL A 49 66.137 6.869 20.709 1.00 0.00 H new ATOM 762 N ILE A 50 66.699 4.417 20.768 1.00 0.00 N ATOM 763 CA ILE A 50 67.702 3.824 21.644 1.00 0.00 C ATOM 764 C ILE A 50 67.935 2.361 21.280 1.00 0.00 C ATOM 765 O ILE A 50 69.058 1.863 21.360 1.00 0.00 O ATOM 766 CB ILE A 50 67.246 3.922 23.101 1.00 0.00 C ATOM 767 CG1 ILE A 50 67.242 5.390 23.535 1.00 0.00 C ATOM 768 CG2 ILE A 50 68.207 3.131 23.992 1.00 0.00 C ATOM 769 CD1 ILE A 50 66.449 5.536 24.835 1.00 0.00 C ATOM 0 H ILE A 50 65.868 4.764 21.247 1.00 0.00 H new ATOM 0 HA ILE A 50 68.636 4.371 21.517 1.00 0.00 H new ATOM 0 HB ILE A 50 66.241 3.510 23.195 1.00 0.00 H new ATOM 0 HG12 ILE A 50 68.264 5.740 23.679 1.00 0.00 H new ATOM 0 HG13 ILE A 50 66.799 6.010 22.755 1.00 0.00 H new ATOM 0 HG21 ILE A 50 67.882 3.201 25.030 1.00 0.00 H new ATOM 0 HG22 ILE A 50 68.212 2.086 23.683 1.00 0.00 H new ATOM 0 HG23 ILE A 50 69.212 3.542 23.898 1.00 0.00 H new ATOM 0 HD11 ILE A 50 66.446 6.581 25.144 1.00 0.00 H new ATOM 0 HD12 ILE A 50 65.424 5.202 24.675 1.00 0.00 H new ATOM 0 HD13 ILE A 50 66.911 4.929 25.613 1.00 0.00 H new ATOM 781 N ALA A 51 66.867 1.678 20.880 1.00 0.00 N ATOM 782 CA ALA A 51 66.967 0.272 20.505 1.00 0.00 C ATOM 783 C ALA A 51 67.796 0.115 19.235 1.00 0.00 C ATOM 784 O ALA A 51 68.666 -0.753 19.153 1.00 0.00 O ATOM 785 CB ALA A 51 65.571 -0.310 20.283 1.00 0.00 C ATOM 0 H ALA A 51 65.929 2.072 20.807 1.00 0.00 H new ATOM 0 HA ALA A 51 67.459 -0.267 21.315 1.00 0.00 H new ATOM 0 HB1 ALA A 51 65.655 -1.360 20.003 1.00 0.00 H new ATOM 0 HB2 ALA A 51 64.991 -0.224 21.202 1.00 0.00 H new ATOM 0 HB3 ALA A 51 65.071 0.239 19.485 1.00 0.00 H new ATOM 791 N LEU A 52 67.520 0.958 18.245 1.00 0.00 N ATOM 792 CA LEU A 52 68.246 0.902 16.982 1.00 0.00 C ATOM 793 C LEU A 52 69.748 1.007 17.222 1.00 0.00 C ATOM 794 O LEU A 52 70.544 0.367 16.534 1.00 0.00 O ATOM 795 CB LEU A 52 67.792 2.042 16.067 1.00 0.00 C ATOM 796 CG LEU A 52 66.930 1.477 14.937 1.00 0.00 C ATOM 797 CD1 LEU A 52 65.767 0.679 15.531 1.00 0.00 C ATOM 798 CD2 LEU A 52 66.378 2.629 14.094 1.00 0.00 C ATOM 0 H LEU A 52 66.804 1.683 18.292 1.00 0.00 H new ATOM 0 HA LEU A 52 68.032 -0.054 16.504 1.00 0.00 H new ATOM 0 HB2 LEU A 52 67.225 2.777 16.638 1.00 0.00 H new ATOM 0 HB3 LEU A 52 68.659 2.558 15.654 1.00 0.00 H new ATOM 0 HG LEU A 52 67.536 0.823 14.310 1.00 0.00 H new ATOM 0 HD11 LEU A 52 65.153 0.277 14.725 1.00 0.00 H new ATOM 0 HD12 LEU A 52 66.158 -0.141 16.133 1.00 0.00 H new ATOM 0 HD13 LEU A 52 65.160 1.332 16.158 1.00 0.00 H new ATOM 0 HD21 LEU A 52 65.763 2.228 13.288 1.00 0.00 H new ATOM 0 HD22 LEU A 52 65.772 3.282 14.722 1.00 0.00 H new ATOM 0 HD23 LEU A 52 67.205 3.199 13.670 1.00 0.00 H new ATOM 810 N LEU A 53 70.130 1.818 18.203 1.00 0.00 N ATOM 811 CA LEU A 53 71.540 2.000 18.526 1.00 0.00 C ATOM 812 C LEU A 53 72.112 0.737 19.160 1.00 0.00 C ATOM 813 O LEU A 53 73.269 0.383 18.928 1.00 0.00 O ATOM 814 CB LEU A 53 71.708 3.178 19.488 1.00 0.00 C ATOM 815 CG LEU A 53 72.349 4.354 18.750 1.00 0.00 C ATOM 816 CD1 LEU A 53 72.379 5.577 19.667 1.00 0.00 C ATOM 817 CD2 LEU A 53 73.778 3.984 18.347 1.00 0.00 C ATOM 0 H LEU A 53 69.488 2.356 18.785 1.00 0.00 H new ATOM 0 HA LEU A 53 72.081 2.206 17.602 1.00 0.00 H new ATOM 0 HB2 LEU A 53 70.739 3.473 19.891 1.00 0.00 H new ATOM 0 HB3 LEU A 53 72.329 2.884 20.334 1.00 0.00 H new ATOM 0 HG LEU A 53 71.767 4.584 17.858 1.00 0.00 H new ATOM 0 HD11 LEU A 53 72.836 6.415 19.141 1.00 0.00 H new ATOM 0 HD12 LEU A 53 71.361 5.841 19.955 1.00 0.00 H new ATOM 0 HD13 LEU A 53 72.961 5.348 20.560 1.00 0.00 H new ATOM 0 HD21 LEU A 53 74.236 4.821 17.821 1.00 0.00 H new ATOM 0 HD22 LEU A 53 74.360 3.754 19.240 1.00 0.00 H new ATOM 0 HD23 LEU A 53 73.757 3.112 17.693 1.00 0.00 H new ATOM 829 N MET A 54 71.295 0.061 19.961 1.00 0.00 N ATOM 830 CA MET A 54 71.730 -1.163 20.624 1.00 0.00 C ATOM 831 C MET A 54 71.938 -2.280 19.606 1.00 0.00 C ATOM 832 O MET A 54 72.839 -3.106 19.750 1.00 0.00 O ATOM 833 CB MET A 54 70.688 -1.597 21.656 1.00 0.00 C ATOM 834 CG MET A 54 70.636 -0.573 22.791 1.00 0.00 C ATOM 835 SD MET A 54 72.084 -0.780 23.857 1.00 0.00 S ATOM 836 CE MET A 54 71.658 0.494 25.068 1.00 0.00 C ATOM 0 H MET A 54 70.335 0.337 20.166 1.00 0.00 H new ATOM 0 HA MET A 54 72.677 -0.965 21.126 1.00 0.00 H new ATOM 0 HB2 MET A 54 69.709 -1.684 21.185 1.00 0.00 H new ATOM 0 HB3 MET A 54 70.940 -2.581 22.051 1.00 0.00 H new ATOM 0 HG2 MET A 54 70.613 0.437 22.383 1.00 0.00 H new ATOM 0 HG3 MET A 54 69.722 -0.703 23.371 1.00 0.00 H new ATOM 0 HE1 MET A 54 72.431 0.540 25.835 1.00 0.00 H new ATOM 0 HE2 MET A 54 71.583 1.460 24.569 1.00 0.00 H new ATOM 0 HE3 MET A 54 70.702 0.250 25.531 1.00 0.00 H new ATOM 846 N LEU A 55 71.096 -2.301 18.578 1.00 0.00 N ATOM 847 CA LEU A 55 71.196 -3.323 17.542 1.00 0.00 C ATOM 848 C LEU A 55 72.534 -3.223 16.818 1.00 0.00 C ATOM 849 O LEU A 55 73.091 -4.230 16.381 1.00 0.00 O ATOM 850 CB LEU A 55 70.056 -3.159 16.535 1.00 0.00 C ATOM 851 CG LEU A 55 68.721 -3.448 17.222 1.00 0.00 C ATOM 852 CD1 LEU A 55 67.572 -3.119 16.268 1.00 0.00 C ATOM 853 CD2 LEU A 55 68.656 -4.928 17.605 1.00 0.00 C ATOM 0 H LEU A 55 70.342 -1.628 18.440 1.00 0.00 H new ATOM 0 HA LEU A 55 71.124 -4.302 18.016 1.00 0.00 H new ATOM 0 HB2 LEU A 55 70.057 -2.147 16.131 1.00 0.00 H new ATOM 0 HB3 LEU A 55 70.199 -3.838 15.695 1.00 0.00 H new ATOM 0 HG LEU A 55 68.635 -2.834 18.119 1.00 0.00 H new ATOM 0 HD11 LEU A 55 66.621 -3.325 16.759 1.00 0.00 H new ATOM 0 HD12 LEU A 55 67.617 -2.065 15.994 1.00 0.00 H new ATOM 0 HD13 LEU A 55 67.658 -3.732 15.371 1.00 0.00 H new ATOM 0 HD21 LEU A 55 67.705 -5.136 18.095 1.00 0.00 H new ATOM 0 HD22 LEU A 55 68.743 -5.540 16.707 1.00 0.00 H new ATOM 0 HD23 LEU A 55 69.474 -5.164 18.286 1.00 0.00 H new ATOM 865 N ASP A 56 73.046 -2.003 16.696 1.00 0.00 N ATOM 866 CA ASP A 56 74.321 -1.783 16.023 1.00 0.00 C ATOM 867 C ASP A 56 75.399 -2.687 16.610 1.00 0.00 C ATOM 868 O ASP A 56 76.332 -3.090 15.915 1.00 0.00 O ATOM 869 CB ASP A 56 74.744 -0.320 16.170 1.00 0.00 C ATOM 870 CG ASP A 56 73.899 0.561 15.256 1.00 0.00 C ATOM 871 OD1 ASP A 56 73.208 0.013 14.412 1.00 0.00 O ATOM 872 OD2 ASP A 56 73.957 1.769 15.411 1.00 0.00 O ATOM 0 H ASP A 56 72.601 -1.157 17.052 1.00 0.00 H new ATOM 0 HA ASP A 56 74.198 -2.021 14.966 1.00 0.00 H new ATOM 0 HB2 ASP A 56 74.627 -0.001 17.206 1.00 0.00 H new ATOM 0 HB3 ASP A 56 75.799 -0.211 15.920 1.00 0.00 H new ATOM 877 N SER A 57 75.265 -3.003 17.895 1.00 0.00 N ATOM 878 CA SER A 57 76.235 -3.862 18.565 1.00 0.00 C ATOM 879 C SER A 57 75.931 -5.330 18.291 1.00 0.00 C ATOM 880 O SER A 57 76.692 -6.215 18.683 1.00 0.00 O ATOM 881 CB SER A 57 76.205 -3.605 20.072 1.00 0.00 C ATOM 882 OG SER A 57 74.969 -4.066 20.603 1.00 0.00 O ATOM 0 H SER A 57 74.501 -2.680 18.489 1.00 0.00 H new ATOM 0 HA SER A 57 77.227 -3.631 18.176 1.00 0.00 H new ATOM 0 HB2 SER A 57 77.036 -4.118 20.557 1.00 0.00 H new ATOM 0 HB3 SER A 57 76.326 -2.541 20.273 1.00 0.00 H new ATOM 0 HG SER A 57 74.262 -3.419 20.396 1.00 0.00 H new ATOM 888 N ALA A 58 74.814 -5.582 17.618 1.00 0.00 N ATOM 889 CA ALA A 58 74.419 -6.950 17.297 1.00 0.00 C ATOM 890 C ALA A 58 75.119 -7.426 16.029 1.00 0.00 C ATOM 891 O ALA A 58 74.590 -8.258 15.291 1.00 0.00 O ATOM 892 CB ALA A 58 72.903 -7.023 17.103 1.00 0.00 C ATOM 0 H ALA A 58 74.170 -4.864 17.286 1.00 0.00 H new ATOM 0 HA ALA A 58 74.711 -7.597 18.124 1.00 0.00 H new ATOM 0 HB1 ALA A 58 72.616 -8.047 16.864 1.00 0.00 H new ATOM 0 HB2 ALA A 58 72.403 -6.711 18.020 1.00 0.00 H new ATOM 0 HB3 ALA A 58 72.608 -6.363 16.287 1.00 0.00 H new ATOM 898 N LYS A 59 76.312 -6.893 15.781 1.00 0.00 N ATOM 899 CA LYS A 59 77.076 -7.273 14.599 1.00 0.00 C ATOM 900 C LYS A 59 77.627 -8.687 14.747 1.00 0.00 C ATOM 901 O LYS A 59 78.671 -8.896 15.365 1.00 0.00 O ATOM 902 CB LYS A 59 78.232 -6.293 14.387 1.00 0.00 C ATOM 903 CG LYS A 59 78.950 -6.626 13.079 1.00 0.00 C ATOM 904 CD LYS A 59 80.055 -5.597 12.827 1.00 0.00 C ATOM 905 CE LYS A 59 80.759 -5.916 11.506 1.00 0.00 C ATOM 906 NZ LYS A 59 81.418 -7.248 11.605 1.00 0.00 N ATOM 0 H LYS A 59 76.767 -6.202 16.378 1.00 0.00 H new ATOM 0 HA LYS A 59 76.411 -7.244 13.736 1.00 0.00 H new ATOM 0 HB2 LYS A 59 77.855 -5.271 14.357 1.00 0.00 H new ATOM 0 HB3 LYS A 59 78.930 -6.351 15.222 1.00 0.00 H new ATOM 0 HG2 LYS A 59 79.376 -7.628 13.131 1.00 0.00 H new ATOM 0 HG3 LYS A 59 78.241 -6.624 12.251 1.00 0.00 H new ATOM 0 HD2 LYS A 59 79.631 -4.594 12.792 1.00 0.00 H new ATOM 0 HD3 LYS A 59 80.773 -5.611 13.647 1.00 0.00 H new ATOM 0 HE2 LYS A 59 80.039 -5.914 10.688 1.00 0.00 H new ATOM 0 HE3 LYS A 59 81.499 -5.148 11.281 1.00 0.00 H new ATOM 0 HZ1 LYS A 59 82.157 -7.325 10.877 1.00 0.00 H new ATOM 0 HZ2 LYS A 59 81.847 -7.354 12.546 1.00 0.00 H new ATOM 0 HZ3 LYS A 59 80.711 -7.997 11.461 1.00 0.00 H new ATOM 920 N GLY A 60 76.918 -9.656 14.176 1.00 0.00 N ATOM 921 CA GLY A 60 77.345 -11.048 14.252 1.00 0.00 C ATOM 922 C GLY A 60 76.481 -11.831 15.233 1.00 0.00 C ATOM 923 O GLY A 60 76.733 -13.007 15.496 1.00 0.00 O ATOM 0 H GLY A 60 76.052 -9.504 13.659 1.00 0.00 H new ATOM 0 HA2 GLY A 60 77.285 -11.505 13.264 1.00 0.00 H new ATOM 0 HA3 GLY A 60 78.389 -11.096 14.563 1.00 0.00 H new ATOM 927 N ARG A 61 75.461 -11.172 15.772 1.00 0.00 N ATOM 928 CA ARG A 61 74.564 -11.818 16.724 1.00 0.00 C ATOM 929 C ARG A 61 73.219 -12.124 16.072 1.00 0.00 C ATOM 930 O ARG A 61 72.860 -11.525 15.058 1.00 0.00 O ATOM 931 CB ARG A 61 74.351 -10.911 17.938 1.00 0.00 C ATOM 932 CG ARG A 61 75.678 -10.724 18.675 1.00 0.00 C ATOM 933 CD ARG A 61 75.424 -10.029 20.014 1.00 0.00 C ATOM 934 NE ARG A 61 76.684 -9.814 20.717 1.00 0.00 N ATOM 935 CZ ARG A 61 77.274 -10.799 21.387 1.00 0.00 C ATOM 936 NH1 ARG A 61 78.401 -10.582 22.008 1.00 0.00 N ATOM 937 NH2 ARG A 61 76.727 -11.982 21.424 1.00 0.00 N ATOM 0 H ARG A 61 75.235 -10.198 15.568 1.00 0.00 H new ATOM 0 HA ARG A 61 75.019 -12.755 17.046 1.00 0.00 H new ATOM 0 HB2 ARG A 61 73.961 -9.945 17.619 1.00 0.00 H new ATOM 0 HB3 ARG A 61 73.610 -11.349 18.607 1.00 0.00 H new ATOM 0 HG2 ARG A 61 76.154 -11.691 18.839 1.00 0.00 H new ATOM 0 HG3 ARG A 61 76.362 -10.130 18.069 1.00 0.00 H new ATOM 0 HD2 ARG A 61 74.925 -9.075 19.848 1.00 0.00 H new ATOM 0 HD3 ARG A 61 74.757 -10.636 20.626 1.00 0.00 H new ATOM 0 HE ARG A 61 77.120 -8.892 20.694 1.00 0.00 H new ATOM 0 HH11 ARG A 61 78.829 -9.657 21.979 1.00 0.00 H new ATOM 0 HH12 ARG A 61 78.854 -11.338 22.522 1.00 0.00 H new ATOM 0 HH21 ARG A 61 75.846 -12.152 20.939 1.00 0.00 H new ATOM 0 HH22 ARG A 61 77.180 -12.737 21.938 1.00 0.00 H new ATOM 951 N GLN A 62 72.481 -13.058 16.660 1.00 0.00 N ATOM 952 CA GLN A 62 71.177 -13.435 16.127 1.00 0.00 C ATOM 953 C GLN A 62 70.070 -12.631 16.800 1.00 0.00 C ATOM 954 O GLN A 62 70.144 -12.330 17.992 1.00 0.00 O ATOM 955 CB GLN A 62 70.934 -14.929 16.352 1.00 0.00 C ATOM 956 CG GLN A 62 71.884 -15.740 15.468 1.00 0.00 C ATOM 957 CD GLN A 62 71.756 -17.225 15.791 1.00 0.00 C ATOM 958 OE1 GLN A 62 71.397 -17.590 16.910 1.00 0.00 O ATOM 959 NE2 GLN A 62 72.032 -18.109 14.871 1.00 0.00 N ATOM 0 H GLN A 62 72.760 -13.565 17.500 1.00 0.00 H new ATOM 0 HA GLN A 62 71.167 -13.222 15.058 1.00 0.00 H new ATOM 0 HB2 GLN A 62 71.093 -15.180 17.401 1.00 0.00 H new ATOM 0 HB3 GLN A 62 69.899 -15.179 16.117 1.00 0.00 H new ATOM 0 HG2 GLN A 62 71.653 -15.567 14.417 1.00 0.00 H new ATOM 0 HG3 GLN A 62 72.911 -15.412 15.627 1.00 0.00 H new ATOM 0 HE21 GLN A 62 72.329 -17.805 13.944 1.00 0.00 H new ATOM 0 HE22 GLN A 62 71.950 -19.104 15.079 1.00 0.00 H new ATOM 968 N ILE A 63 69.045 -12.284 16.029 1.00 0.00 N ATOM 969 CA ILE A 63 67.927 -11.513 16.562 1.00 0.00 C ATOM 970 C ILE A 63 66.600 -12.176 16.207 1.00 0.00 C ATOM 971 O ILE A 63 66.527 -12.983 15.281 1.00 0.00 O ATOM 972 CB ILE A 63 67.957 -10.092 15.996 1.00 0.00 C ATOM 973 CG1 ILE A 63 67.730 -10.143 14.483 1.00 0.00 C ATOM 974 CG2 ILE A 63 69.316 -9.455 16.286 1.00 0.00 C ATOM 975 CD1 ILE A 63 67.695 -8.719 13.924 1.00 0.00 C ATOM 0 H ILE A 63 68.965 -12.522 15.040 1.00 0.00 H new ATOM 0 HA ILE A 63 68.021 -11.475 17.647 1.00 0.00 H new ATOM 0 HB ILE A 63 67.171 -9.498 16.463 1.00 0.00 H new ATOM 0 HG12 ILE A 63 68.526 -10.714 14.004 1.00 0.00 H new ATOM 0 HG13 ILE A 63 66.793 -10.655 14.262 1.00 0.00 H new ATOM 0 HG21 ILE A 63 69.337 -8.443 15.883 1.00 0.00 H new ATOM 0 HG22 ILE A 63 69.479 -9.420 17.363 1.00 0.00 H new ATOM 0 HG23 ILE A 63 70.103 -10.048 15.819 1.00 0.00 H new ATOM 0 HD11 ILE A 63 67.533 -8.755 12.847 1.00 0.00 H new ATOM 0 HD12 ILE A 63 66.884 -8.163 14.394 1.00 0.00 H new ATOM 0 HD13 ILE A 63 68.643 -8.223 14.132 1.00 0.00 H new ATOM 987 N GLU A 64 65.554 -11.831 16.951 1.00 0.00 N ATOM 988 CA GLU A 64 64.234 -12.400 16.706 1.00 0.00 C ATOM 989 C GLU A 64 63.219 -11.296 16.424 1.00 0.00 C ATOM 990 O GLU A 64 62.697 -10.670 17.347 1.00 0.00 O ATOM 991 CB GLU A 64 63.782 -13.213 17.920 1.00 0.00 C ATOM 992 CG GLU A 64 64.996 -13.876 18.572 1.00 0.00 C ATOM 993 CD GLU A 64 64.539 -14.903 19.603 1.00 0.00 C ATOM 994 OE1 GLU A 64 64.026 -15.932 19.197 1.00 0.00 O ATOM 995 OE2 GLU A 64 64.708 -14.644 20.784 1.00 0.00 O ATOM 0 H GLU A 64 65.594 -11.165 17.723 1.00 0.00 H new ATOM 0 HA GLU A 64 64.296 -13.052 15.835 1.00 0.00 H new ATOM 0 HB2 GLU A 64 63.279 -12.565 18.638 1.00 0.00 H new ATOM 0 HB3 GLU A 64 63.061 -13.971 17.615 1.00 0.00 H new ATOM 0 HG2 GLU A 64 65.609 -14.360 17.811 1.00 0.00 H new ATOM 0 HG3 GLU A 64 65.620 -13.121 19.051 1.00 0.00 H new ATOM 1002 N VAL A 65 62.944 -11.063 15.145 1.00 0.00 N ATOM 1003 CA VAL A 65 61.990 -10.032 14.754 1.00 0.00 C ATOM 1004 C VAL A 65 60.561 -10.545 14.893 1.00 0.00 C ATOM 1005 O VAL A 65 60.210 -11.591 14.347 1.00 0.00 O ATOM 1006 CB VAL A 65 62.243 -9.608 13.306 1.00 0.00 C ATOM 1007 CG1 VAL A 65 61.316 -8.447 12.944 1.00 0.00 C ATOM 1008 CG2 VAL A 65 63.699 -9.164 13.154 1.00 0.00 C ATOM 0 H VAL A 65 63.365 -11.570 14.367 1.00 0.00 H new ATOM 0 HA VAL A 65 62.122 -9.173 15.412 1.00 0.00 H new ATOM 0 HB VAL A 65 62.047 -10.449 12.641 1.00 0.00 H new ATOM 0 HG11 VAL A 65 61.497 -8.145 11.912 1.00 0.00 H new ATOM 0 HG12 VAL A 65 60.278 -8.762 13.054 1.00 0.00 H new ATOM 0 HG13 VAL A 65 61.511 -7.605 13.608 1.00 0.00 H new ATOM 0 HG21 VAL A 65 63.881 -8.861 12.123 1.00 0.00 H new ATOM 0 HG22 VAL A 65 63.894 -8.323 13.819 1.00 0.00 H new ATOM 0 HG23 VAL A 65 64.360 -9.991 13.412 1.00 0.00 H new ATOM 1018 N GLU A 66 59.740 -9.802 15.628 1.00 0.00 N ATOM 1019 CA GLU A 66 58.349 -10.191 15.833 1.00 0.00 C ATOM 1020 C GLU A 66 57.407 -9.125 15.283 1.00 0.00 C ATOM 1021 O GLU A 66 57.644 -7.929 15.448 1.00 0.00 O ATOM 1022 CB GLU A 66 58.078 -10.392 17.326 1.00 0.00 C ATOM 1023 CG GLU A 66 56.599 -10.720 17.536 1.00 0.00 C ATOM 1024 CD GLU A 66 56.364 -11.176 18.972 1.00 0.00 C ATOM 1025 OE1 GLU A 66 57.324 -11.212 19.725 1.00 0.00 O ATOM 1026 OE2 GLU A 66 55.229 -11.482 19.298 1.00 0.00 O ATOM 0 H GLU A 66 60.011 -8.933 16.089 1.00 0.00 H new ATOM 0 HA GLU A 66 58.171 -11.126 15.302 1.00 0.00 H new ATOM 0 HB2 GLU A 66 58.699 -11.199 17.714 1.00 0.00 H new ATOM 0 HB3 GLU A 66 58.344 -9.491 17.879 1.00 0.00 H new ATOM 0 HG2 GLU A 66 55.989 -9.843 17.320 1.00 0.00 H new ATOM 0 HG3 GLU A 66 56.289 -11.502 16.842 1.00 0.00 H new ATOM 1033 N ALA A 67 56.339 -9.567 14.627 1.00 0.00 N ATOM 1034 CA ALA A 67 55.368 -8.642 14.055 1.00 0.00 C ATOM 1035 C ALA A 67 53.946 -9.124 14.322 1.00 0.00 C ATOM 1036 O ALA A 67 53.623 -10.290 14.093 1.00 0.00 O ATOM 1037 CB ALA A 67 55.592 -8.516 12.548 1.00 0.00 C ATOM 0 H ALA A 67 56.125 -10.553 14.479 1.00 0.00 H new ATOM 0 HA ALA A 67 55.503 -7.668 14.525 1.00 0.00 H new ATOM 0 HB1 ALA A 67 54.863 -7.823 12.128 1.00 0.00 H new ATOM 0 HB2 ALA A 67 56.598 -8.141 12.360 1.00 0.00 H new ATOM 0 HB3 ALA A 67 55.475 -9.493 12.080 1.00 0.00 H new ATOM 1043 N THR A 68 53.101 -8.221 14.806 1.00 0.00 N ATOM 1044 CA THR A 68 51.714 -8.566 15.100 1.00 0.00 C ATOM 1045 C THR A 68 50.762 -7.627 14.367 1.00 0.00 C ATOM 1046 O THR A 68 50.907 -6.406 14.431 1.00 0.00 O ATOM 1047 CB THR A 68 51.462 -8.479 16.606 1.00 0.00 C ATOM 1048 OG1 THR A 68 52.386 -9.317 17.288 1.00 0.00 O ATOM 1049 CG2 THR A 68 50.035 -8.933 16.914 1.00 0.00 C ATOM 0 H THR A 68 53.349 -7.251 15.002 1.00 0.00 H new ATOM 0 HA THR A 68 51.533 -9.586 14.761 1.00 0.00 H new ATOM 0 HB THR A 68 51.592 -7.449 16.937 1.00 0.00 H new ATOM 0 HG1 THR A 68 52.406 -9.077 18.238 1.00 0.00 H new ATOM 0 HG21 THR A 68 49.857 -8.870 17.988 1.00 0.00 H new ATOM 0 HG22 THR A 68 49.328 -8.290 16.391 1.00 0.00 H new ATOM 0 HG23 THR A 68 49.902 -9.963 16.584 1.00 0.00 H new ATOM 1057 N GLY A 69 49.788 -8.205 13.672 1.00 0.00 N ATOM 1058 CA GLY A 69 48.816 -7.409 12.931 1.00 0.00 C ATOM 1059 C GLY A 69 48.524 -8.033 11.571 1.00 0.00 C ATOM 1060 O GLY A 69 49.255 -8.909 11.108 1.00 0.00 O ATOM 0 H GLY A 69 49.651 -9.214 13.606 1.00 0.00 H new ATOM 0 HA2 GLY A 69 47.893 -7.329 13.505 1.00 0.00 H new ATOM 0 HA3 GLY A 69 49.196 -6.396 12.797 1.00 0.00 H new ATOM 1064 N PRO A 70 47.474 -7.597 10.932 1.00 0.00 N ATOM 1065 CA PRO A 70 47.069 -8.116 9.594 1.00 0.00 C ATOM 1066 C PRO A 70 48.247 -8.191 8.625 1.00 0.00 C ATOM 1067 O PRO A 70 48.401 -9.171 7.897 1.00 0.00 O ATOM 1068 CB PRO A 70 46.029 -7.103 9.113 1.00 0.00 C ATOM 1069 CG PRO A 70 45.459 -6.498 10.353 1.00 0.00 C ATOM 1070 CD PRO A 70 46.556 -6.556 11.419 1.00 0.00 C ATOM 0 HA PRO A 70 46.684 -9.134 9.649 1.00 0.00 H new ATOM 0 HB2 PRO A 70 46.485 -6.343 8.479 1.00 0.00 H new ATOM 0 HB3 PRO A 70 45.253 -7.588 8.520 1.00 0.00 H new ATOM 0 HG2 PRO A 70 45.149 -5.469 10.173 1.00 0.00 H new ATOM 0 HG3 PRO A 70 44.574 -7.045 10.679 1.00 0.00 H new ATOM 0 HD2 PRO A 70 47.061 -5.596 11.524 1.00 0.00 H new ATOM 0 HD3 PRO A 70 46.148 -6.810 12.397 1.00 0.00 H new ATOM 1078 N GLN A 71 49.072 -7.150 8.623 1.00 0.00 N ATOM 1079 CA GLN A 71 50.232 -7.109 7.740 1.00 0.00 C ATOM 1080 C GLN A 71 51.477 -7.605 8.468 1.00 0.00 C ATOM 1081 O GLN A 71 52.598 -7.433 7.989 1.00 0.00 O ATOM 1082 CB GLN A 71 50.463 -5.679 7.246 1.00 0.00 C ATOM 1083 CG GLN A 71 49.288 -5.245 6.368 1.00 0.00 C ATOM 1084 CD GLN A 71 49.514 -3.826 5.859 1.00 0.00 C ATOM 1085 OE1 GLN A 71 50.581 -3.519 5.326 1.00 0.00 O ATOM 1086 NE2 GLN A 71 48.569 -2.936 5.992 1.00 0.00 N ATOM 0 H GLN A 71 48.961 -6.329 9.218 1.00 0.00 H new ATOM 0 HA GLN A 71 50.039 -7.761 6.888 1.00 0.00 H new ATOM 0 HB2 GLN A 71 50.566 -5.002 8.094 1.00 0.00 H new ATOM 0 HB3 GLN A 71 51.393 -5.624 6.680 1.00 0.00 H new ATOM 0 HG2 GLN A 71 49.180 -5.929 5.526 1.00 0.00 H new ATOM 0 HG3 GLN A 71 48.360 -5.292 6.938 1.00 0.00 H new ATOM 0 HE21 GLN A 71 47.686 -3.192 6.434 1.00 0.00 H new ATOM 0 HE22 GLN A 71 48.713 -1.984 5.654 1.00 0.00 H new ATOM 1095 N GLU A 72 51.273 -8.221 9.627 1.00 0.00 N ATOM 1096 CA GLU A 72 52.386 -8.739 10.413 1.00 0.00 C ATOM 1097 C GLU A 72 53.351 -9.521 9.527 1.00 0.00 C ATOM 1098 O GLU A 72 54.569 -9.369 9.632 1.00 0.00 O ATOM 1099 CB GLU A 72 51.862 -9.649 11.526 1.00 0.00 C ATOM 1100 CG GLU A 72 51.334 -10.949 10.916 1.00 0.00 C ATOM 1101 CD GLU A 72 50.594 -11.758 11.976 1.00 0.00 C ATOM 1102 OE1 GLU A 72 50.537 -11.305 13.108 1.00 0.00 O ATOM 1103 OE2 GLU A 72 50.095 -12.820 11.641 1.00 0.00 O ATOM 0 H GLU A 72 50.353 -8.373 10.041 1.00 0.00 H new ATOM 0 HA GLU A 72 52.917 -7.895 10.853 1.00 0.00 H new ATOM 0 HB2 GLU A 72 52.658 -9.866 12.238 1.00 0.00 H new ATOM 0 HB3 GLU A 72 51.069 -9.146 12.079 1.00 0.00 H new ATOM 0 HG2 GLU A 72 50.665 -10.725 10.085 1.00 0.00 H new ATOM 0 HG3 GLU A 72 52.161 -11.533 10.512 1.00 0.00 H new ATOM 1110 N GLU A 73 52.800 -10.357 8.653 1.00 0.00 N ATOM 1111 CA GLU A 73 53.621 -11.158 7.753 1.00 0.00 C ATOM 1112 C GLU A 73 54.347 -10.265 6.751 1.00 0.00 C ATOM 1113 O GLU A 73 55.540 -10.435 6.504 1.00 0.00 O ATOM 1114 CB GLU A 73 52.746 -12.164 7.003 1.00 0.00 C ATOM 1115 CG GLU A 73 52.022 -13.060 8.010 1.00 0.00 C ATOM 1116 CD GLU A 73 51.334 -14.211 7.282 1.00 0.00 C ATOM 1117 OE1 GLU A 73 52.036 -15.058 6.756 1.00 0.00 O ATOM 1118 OE2 GLU A 73 50.114 -14.228 7.263 1.00 0.00 O ATOM 0 H GLU A 73 51.795 -10.497 8.549 1.00 0.00 H new ATOM 0 HA GLU A 73 54.361 -11.693 8.348 1.00 0.00 H new ATOM 0 HB2 GLU A 73 52.022 -11.639 6.380 1.00 0.00 H new ATOM 0 HB3 GLU A 73 53.360 -12.770 6.336 1.00 0.00 H new ATOM 0 HG2 GLU A 73 52.733 -13.452 8.738 1.00 0.00 H new ATOM 0 HG3 GLU A 73 51.286 -12.478 8.565 1.00 0.00 H new ATOM 1125 N GLU A 74 53.616 -9.314 6.178 1.00 0.00 N ATOM 1126 CA GLU A 74 54.202 -8.400 5.203 1.00 0.00 C ATOM 1127 C GLU A 74 55.330 -7.591 5.836 1.00 0.00 C ATOM 1128 O GLU A 74 56.424 -7.496 5.280 1.00 0.00 O ATOM 1129 CB GLU A 74 53.128 -7.450 4.668 1.00 0.00 C ATOM 1130 CG GLU A 74 52.079 -8.248 3.894 1.00 0.00 C ATOM 1131 CD GLU A 74 51.115 -7.300 3.191 1.00 0.00 C ATOM 1132 OE1 GLU A 74 51.269 -6.101 3.355 1.00 0.00 O ATOM 1133 OE2 GLU A 74 50.235 -7.786 2.498 1.00 0.00 O ATOM 0 H GLU A 74 52.627 -9.157 6.369 1.00 0.00 H new ATOM 0 HA GLU A 74 54.610 -8.988 4.381 1.00 0.00 H new ATOM 0 HB2 GLU A 74 52.657 -6.915 5.493 1.00 0.00 H new ATOM 0 HB3 GLU A 74 53.581 -6.700 4.019 1.00 0.00 H new ATOM 0 HG2 GLU A 74 52.567 -8.892 3.162 1.00 0.00 H new ATOM 0 HG3 GLU A 74 51.530 -8.899 4.575 1.00 0.00 H new ATOM 1140 N ALA A 75 55.056 -7.012 7.000 1.00 0.00 N ATOM 1141 CA ALA A 75 56.057 -6.215 7.700 1.00 0.00 C ATOM 1142 C ALA A 75 57.347 -7.010 7.877 1.00 0.00 C ATOM 1143 O ALA A 75 58.440 -6.503 7.622 1.00 0.00 O ATOM 1144 CB ALA A 75 55.523 -5.792 9.069 1.00 0.00 C ATOM 0 H ALA A 75 54.156 -7.079 7.476 1.00 0.00 H new ATOM 0 HA ALA A 75 56.270 -5.328 7.104 1.00 0.00 H new ATOM 0 HB1 ALA A 75 56.276 -5.197 9.585 1.00 0.00 H new ATOM 0 HB2 ALA A 75 54.618 -5.198 8.939 1.00 0.00 H new ATOM 0 HB3 ALA A 75 55.293 -6.679 9.660 1.00 0.00 H new ATOM 1150 N LEU A 76 57.212 -8.256 8.317 1.00 0.00 N ATOM 1151 CA LEU A 76 58.375 -9.112 8.526 1.00 0.00 C ATOM 1152 C LEU A 76 59.047 -9.435 7.196 1.00 0.00 C ATOM 1153 O LEU A 76 60.274 -9.429 7.093 1.00 0.00 O ATOM 1154 CB LEU A 76 57.950 -10.411 9.214 1.00 0.00 C ATOM 1155 CG LEU A 76 58.533 -10.455 10.627 1.00 0.00 C ATOM 1156 CD1 LEU A 76 57.950 -11.649 11.384 1.00 0.00 C ATOM 1157 CD2 LEU A 76 60.055 -10.598 10.544 1.00 0.00 C ATOM 0 H LEU A 76 56.317 -8.694 8.535 1.00 0.00 H new ATOM 0 HA LEU A 76 59.085 -8.581 9.160 1.00 0.00 H new ATOM 0 HB2 LEU A 76 56.863 -10.474 9.256 1.00 0.00 H new ATOM 0 HB3 LEU A 76 58.297 -11.270 8.639 1.00 0.00 H new ATOM 0 HG LEU A 76 58.281 -9.534 11.153 1.00 0.00 H new ATOM 0 HD11 LEU A 76 58.366 -11.680 12.391 1.00 0.00 H new ATOM 0 HD12 LEU A 76 56.866 -11.549 11.442 1.00 0.00 H new ATOM 0 HD13 LEU A 76 58.202 -12.571 10.859 1.00 0.00 H new ATOM 0 HD21 LEU A 76 60.473 -10.630 11.550 1.00 0.00 H new ATOM 0 HD22 LEU A 76 60.306 -11.519 10.018 1.00 0.00 H new ATOM 0 HD23 LEU A 76 60.472 -9.747 10.005 1.00 0.00 H new ATOM 1169 N ALA A 77 58.238 -9.718 6.181 1.00 0.00 N ATOM 1170 CA ALA A 77 58.766 -10.042 4.861 1.00 0.00 C ATOM 1171 C ALA A 77 59.566 -8.869 4.302 1.00 0.00 C ATOM 1172 O ALA A 77 60.651 -9.052 3.751 1.00 0.00 O ATOM 1173 CB ALA A 77 57.619 -10.381 3.908 1.00 0.00 C ATOM 0 H ALA A 77 57.220 -9.730 6.246 1.00 0.00 H new ATOM 0 HA ALA A 77 59.425 -10.905 4.955 1.00 0.00 H new ATOM 0 HB1 ALA A 77 58.022 -10.622 2.924 1.00 0.00 H new ATOM 0 HB2 ALA A 77 57.067 -11.238 4.294 1.00 0.00 H new ATOM 0 HB3 ALA A 77 56.949 -9.525 3.826 1.00 0.00 H new ATOM 1179 N ALA A 78 59.021 -7.666 4.446 1.00 0.00 N ATOM 1180 CA ALA A 78 59.692 -6.469 3.950 1.00 0.00 C ATOM 1181 C ALA A 78 61.040 -6.287 4.641 1.00 0.00 C ATOM 1182 O ALA A 78 62.043 -5.983 3.995 1.00 0.00 O ATOM 1183 CB ALA A 78 58.818 -5.239 4.199 1.00 0.00 C ATOM 0 H ALA A 78 58.123 -7.494 4.899 1.00 0.00 H new ATOM 0 HA ALA A 78 59.858 -6.585 2.879 1.00 0.00 H new ATOM 0 HB1 ALA A 78 59.326 -4.350 3.826 1.00 0.00 H new ATOM 0 HB2 ALA A 78 57.867 -5.358 3.680 1.00 0.00 H new ATOM 0 HB3 ALA A 78 58.637 -5.132 5.269 1.00 0.00 H new ATOM 1189 N VAL A 79 61.055 -6.473 5.957 1.00 0.00 N ATOM 1190 CA VAL A 79 62.286 -6.326 6.725 1.00 0.00 C ATOM 1191 C VAL A 79 63.264 -7.447 6.391 1.00 0.00 C ATOM 1192 O VAL A 79 64.463 -7.215 6.241 1.00 0.00 O ATOM 1193 CB VAL A 79 61.973 -6.348 8.222 1.00 0.00 C ATOM 1194 CG1 VAL A 79 63.276 -6.256 9.017 1.00 0.00 C ATOM 1195 CG2 VAL A 79 61.077 -5.158 8.572 1.00 0.00 C ATOM 0 H VAL A 79 60.236 -6.724 6.510 1.00 0.00 H new ATOM 0 HA VAL A 79 62.743 -5.372 6.463 1.00 0.00 H new ATOM 0 HB VAL A 79 61.460 -7.276 8.473 1.00 0.00 H new ATOM 0 HG11 VAL A 79 63.053 -6.272 10.084 1.00 0.00 H new ATOM 0 HG12 VAL A 79 63.915 -7.103 8.767 1.00 0.00 H new ATOM 0 HG13 VAL A 79 63.790 -5.328 8.767 1.00 0.00 H new ATOM 0 HG21 VAL A 79 60.853 -5.172 9.639 1.00 0.00 H new ATOM 0 HG22 VAL A 79 61.591 -4.230 8.322 1.00 0.00 H new ATOM 0 HG23 VAL A 79 60.148 -5.223 8.005 1.00 0.00 H new ATOM 1205 N ILE A 80 62.742 -8.664 6.274 1.00 0.00 N ATOM 1206 CA ILE A 80 63.579 -9.816 5.957 1.00 0.00 C ATOM 1207 C ILE A 80 64.179 -9.675 4.561 1.00 0.00 C ATOM 1208 O ILE A 80 65.356 -9.962 4.349 1.00 0.00 O ATOM 1209 CB ILE A 80 62.752 -11.100 6.032 1.00 0.00 C ATOM 1210 CG1 ILE A 80 62.529 -11.477 7.498 1.00 0.00 C ATOM 1211 CG2 ILE A 80 63.499 -12.232 5.323 1.00 0.00 C ATOM 1212 CD1 ILE A 80 61.502 -12.607 7.584 1.00 0.00 C ATOM 0 H ILE A 80 61.752 -8.877 6.393 1.00 0.00 H new ATOM 0 HA ILE A 80 64.389 -9.864 6.685 1.00 0.00 H new ATOM 0 HB ILE A 80 61.789 -10.940 5.546 1.00 0.00 H new ATOM 0 HG12 ILE A 80 63.469 -11.791 7.951 1.00 0.00 H new ATOM 0 HG13 ILE A 80 62.179 -10.610 8.058 1.00 0.00 H new ATOM 0 HG21 ILE A 80 62.909 -13.147 5.377 1.00 0.00 H new ATOM 0 HG22 ILE A 80 63.659 -11.964 4.279 1.00 0.00 H new ATOM 0 HG23 ILE A 80 64.462 -12.392 5.808 1.00 0.00 H new ATOM 0 HD11 ILE A 80 61.343 -12.876 8.628 1.00 0.00 H new ATOM 0 HD12 ILE A 80 60.560 -12.276 7.147 1.00 0.00 H new ATOM 0 HD13 ILE A 80 61.870 -13.476 7.038 1.00 0.00 H new ATOM 1224 N ALA A 81 63.359 -9.230 3.614 1.00 0.00 N ATOM 1225 CA ALA A 81 63.819 -9.054 2.242 1.00 0.00 C ATOM 1226 C ALA A 81 64.941 -8.021 2.180 1.00 0.00 C ATOM 1227 O ALA A 81 65.862 -8.137 1.373 1.00 0.00 O ATOM 1228 CB ALA A 81 62.658 -8.601 1.355 1.00 0.00 C ATOM 0 H ALA A 81 62.381 -8.987 3.770 1.00 0.00 H new ATOM 0 HA ALA A 81 64.200 -10.010 1.882 1.00 0.00 H new ATOM 0 HB1 ALA A 81 63.011 -8.472 0.332 1.00 0.00 H new ATOM 0 HB2 ALA A 81 61.870 -9.354 1.375 1.00 0.00 H new ATOM 0 HB3 ALA A 81 62.265 -7.654 1.725 1.00 0.00 H new ATOM 1234 N LEU A 82 64.855 -7.011 3.040 1.00 0.00 N ATOM 1235 CA LEU A 82 65.868 -5.963 3.075 1.00 0.00 C ATOM 1236 C LEU A 82 67.144 -6.473 3.736 1.00 0.00 C ATOM 1237 O LEU A 82 68.250 -6.130 3.318 1.00 0.00 O ATOM 1238 CB LEU A 82 65.340 -4.752 3.850 1.00 0.00 C ATOM 1239 CG LEU A 82 64.981 -3.636 2.868 1.00 0.00 C ATOM 1240 CD1 LEU A 82 64.169 -2.561 3.592 1.00 0.00 C ATOM 1241 CD2 LEU A 82 66.264 -3.016 2.311 1.00 0.00 C ATOM 0 H LEU A 82 64.101 -6.896 3.717 1.00 0.00 H new ATOM 0 HA LEU A 82 66.095 -5.669 2.050 1.00 0.00 H new ATOM 0 HB2 LEU A 82 64.463 -5.034 4.433 1.00 0.00 H new ATOM 0 HB3 LEU A 82 66.093 -4.402 4.556 1.00 0.00 H new ATOM 0 HG LEU A 82 64.390 -4.048 2.050 1.00 0.00 H new ATOM 0 HD11 LEU A 82 63.913 -1.765 2.892 1.00 0.00 H new ATOM 0 HD12 LEU A 82 63.255 -3.002 3.990 1.00 0.00 H new ATOM 0 HD13 LEU A 82 64.759 -2.148 4.410 1.00 0.00 H new ATOM 0 HD21 LEU A 82 66.009 -2.220 1.611 1.00 0.00 H new ATOM 0 HD22 LEU A 82 66.854 -2.604 3.130 1.00 0.00 H new ATOM 0 HD23 LEU A 82 66.844 -3.781 1.795 1.00 0.00 H new ATOM 1253 N PHE A 83 66.984 -7.294 4.768 1.00 0.00 N ATOM 1254 CA PHE A 83 68.132 -7.846 5.478 1.00 0.00 C ATOM 1255 C PHE A 83 68.871 -8.853 4.603 1.00 0.00 C ATOM 1256 O PHE A 83 70.094 -8.972 4.674 1.00 0.00 O ATOM 1257 CB PHE A 83 67.669 -8.531 6.766 1.00 0.00 C ATOM 1258 CG PHE A 83 67.473 -7.493 7.846 1.00 0.00 C ATOM 1259 CD1 PHE A 83 66.879 -6.264 7.535 1.00 0.00 C ATOM 1260 CD2 PHE A 83 67.887 -7.761 9.156 1.00 0.00 C ATOM 1261 CE1 PHE A 83 66.697 -5.302 8.536 1.00 0.00 C ATOM 1262 CE2 PHE A 83 67.705 -6.799 10.157 1.00 0.00 C ATOM 1263 CZ PHE A 83 67.110 -5.570 9.848 1.00 0.00 C ATOM 0 H PHE A 83 66.078 -7.590 5.130 1.00 0.00 H new ATOM 0 HA PHE A 83 68.810 -7.029 5.723 1.00 0.00 H new ATOM 0 HB2 PHE A 83 66.737 -9.069 6.590 1.00 0.00 H new ATOM 0 HB3 PHE A 83 68.407 -9.268 7.084 1.00 0.00 H new ATOM 0 HD1 PHE A 83 66.561 -6.058 6.524 1.00 0.00 H new ATOM 0 HD2 PHE A 83 68.346 -8.709 9.394 1.00 0.00 H new ATOM 0 HE1 PHE A 83 66.238 -4.354 8.297 1.00 0.00 H new ATOM 0 HE2 PHE A 83 68.024 -7.005 11.168 1.00 0.00 H new ATOM 0 HZ PHE A 83 66.969 -4.829 10.621 1.00 0.00 H new ATOM 1273 N ASN A 84 68.121 -9.576 3.778 1.00 0.00 N ATOM 1274 CA ASN A 84 68.715 -10.571 2.893 1.00 0.00 C ATOM 1275 C ASN A 84 69.452 -9.892 1.742 1.00 0.00 C ATOM 1276 O ASN A 84 70.203 -10.535 1.009 1.00 0.00 O ATOM 1277 CB ASN A 84 67.628 -11.490 2.335 1.00 0.00 C ATOM 1278 CG ASN A 84 66.964 -12.262 3.470 1.00 0.00 C ATOM 1279 OD1 ASN A 84 67.573 -12.471 4.519 1.00 0.00 O ATOM 1280 ND2 ASN A 84 65.744 -12.699 3.322 1.00 0.00 N ATOM 0 H ASN A 84 67.107 -9.493 3.704 1.00 0.00 H new ATOM 0 HA ASN A 84 69.428 -11.162 3.468 1.00 0.00 H new ATOM 0 HB2 ASN A 84 66.883 -10.902 1.800 1.00 0.00 H new ATOM 0 HB3 ASN A 84 68.062 -12.185 1.616 1.00 0.00 H new ATOM 0 HD21 ASN A 84 65.292 -13.215 4.077 1.00 0.00 H new ATOM 0 HD22 ASN A 84 65.242 -12.524 2.452 1.00 0.00 H new ATOM 1287 N SER A 85 69.230 -8.591 1.589 1.00 0.00 N ATOM 1288 CA SER A 85 69.879 -7.836 0.524 1.00 0.00 C ATOM 1289 C SER A 85 70.701 -6.690 1.103 1.00 0.00 C ATOM 1290 O SER A 85 70.566 -5.581 0.611 1.00 0.00 O ATOM 1291 CB SER A 85 68.827 -7.278 -0.435 1.00 0.00 C ATOM 1292 OG SER A 85 67.882 -8.296 -0.739 1.00 0.00 O ATOM 1293 OXT SER A 85 71.455 -6.936 2.030 1.00 0.00 O ATOM 0 H SER A 85 68.610 -8.041 2.184 1.00 0.00 H new ATOM 0 HA SER A 85 70.545 -8.507 -0.018 1.00 0.00 H new ATOM 0 HB2 SER A 85 68.325 -6.422 0.016 1.00 0.00 H new ATOM 0 HB3 SER A 85 69.303 -6.923 -1.349 1.00 0.00 H new ATOM 0 HG SER A 85 67.165 -8.287 -0.071 1.00 0.00 H new TER 1299 SER A 85