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 Set 1.1: A 38 ASN : amide:sc= -3.86! C(o=-3.9!,f=-5!) USER MOD Set 1.2: A 42 THR OG1 : rot -170:sc= 0 USER MOD Single : A 1 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 1 MET N :NH3+ -151:sc= -0.114 (180deg=-0.801) USER MOD Single : A 2 THR OG1 : rot 180:sc= -0.959 USER MOD Single : A 4 LYS NZ :NH3+ 169:sc= -1.12 (180deg=-1.29) USER MOD Single : A 5 GLN : amide:sc= -4.61! C(o=-4.6!,f=-4.8!) USER MOD Single : A 6 THR OG1 : rot -40:sc= 0.302 USER MOD Single : A 10 THR OG1 : rot 180:sc= 0 USER MOD Single : A 11 ASN : amide:sc= -7.4! C(o=-7.4!,f=-13!) USER MOD Single : A 12 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 15 MET CE :methyl 150:sc= -6.45! (180deg=-10.9!) USER MOD Single : A 16 HIS : no HD1:sc= -4.45! C(o=-4.4!,f=-12!) USER MOD Single : A 21 MET CE :methyl -164:sc= -1.47 (180deg=-2.01) USER MOD Single : A 22 LYS NZ :NH3+ -166:sc= 0 (180deg=-0.0478) USER MOD Single : A 27 MET CE :methyl -110:sc= -2.63 (180deg=-6!) USER MOD Single : A 28 GLN : amide:sc= -0.0433 X(o=-0.043,f=-0.15) USER MOD Single : A 47 ASN :FLIP amide:sc= -1.52 F(o=-2.3!,f=-1.5) 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 -39:sc= 0.206 USER MOD Single : A 59 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 62 GLN : amide:sc=-0.00173 X(o=-0.0017,f=-0.0017) USER MOD Single : A 68 THR OG1 : rot 180:sc= -2.41 USER MOD Single : A 71 GLN : amide:sc= -0.202 X(o=-0.2,f=-0.028) USER MOD Single : A 84 ASN : amide:sc= 0 X(o=0,f=0.046) USER MOD Single : A 85 SER OG : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 47.152 -14.973 17.968 1.00 0.00 N ATOM 2 CA MET A 1 47.603 -14.141 19.119 1.00 0.00 C ATOM 3 C MET A 1 49.128 -14.091 19.140 1.00 0.00 C ATOM 4 O MET A 1 49.794 -15.125 19.199 1.00 0.00 O ATOM 5 CB MET A 1 47.077 -14.751 20.420 1.00 0.00 C ATOM 6 CG MET A 1 45.552 -14.642 20.451 1.00 0.00 C ATOM 7 SD MET A 1 44.898 -15.680 21.782 1.00 0.00 S ATOM 8 CE MET A 1 43.252 -15.944 21.077 1.00 0.00 C ATOM 0 H1 MET A 1 46.221 -14.642 17.644 1.00 0.00 H new ATOM 0 H2 MET A 1 47.838 -14.892 17.191 1.00 0.00 H new ATOM 0 H3 MET A 1 47.081 -15.967 18.265 1.00 0.00 H new ATOM 0 HA MET A 1 47.216 -13.127 19.019 1.00 0.00 H new ATOM 0 HB2 MET A 1 47.380 -15.796 20.493 1.00 0.00 H new ATOM 0 HB3 MET A 1 47.507 -14.233 21.277 1.00 0.00 H new ATOM 0 HG2 MET A 1 45.254 -13.605 20.605 1.00 0.00 H new ATOM 0 HG3 MET A 1 45.135 -14.955 19.494 1.00 0.00 H new ATOM 0 HE1 MET A 1 42.665 -16.572 21.748 1.00 0.00 H new ATOM 0 HE2 MET A 1 42.752 -14.984 20.950 1.00 0.00 H new ATOM 0 HE3 MET A 1 43.346 -16.436 20.109 1.00 0.00 H new ATOM 20 N THR A 2 49.672 -12.880 19.085 1.00 0.00 N ATOM 21 CA THR A 2 51.120 -12.696 19.091 1.00 0.00 C ATOM 22 C THR A 2 51.755 -13.398 17.903 1.00 0.00 C ATOM 23 O THR A 2 51.334 -14.490 17.522 1.00 0.00 O ATOM 24 CB THR A 2 51.737 -13.275 20.369 1.00 0.00 C ATOM 25 OG1 THR A 2 50.703 -13.635 21.275 1.00 0.00 O ATOM 26 CG2 THR A 2 52.652 -12.235 21.016 1.00 0.00 C ATOM 0 H THR A 2 49.135 -12.014 19.036 1.00 0.00 H new ATOM 0 HA THR A 2 51.310 -11.624 19.038 1.00 0.00 H new ATOM 0 HB THR A 2 52.322 -14.160 20.119 1.00 0.00 H new ATOM 0 HG1 THR A 2 51.098 -14.007 22.091 1.00 0.00 H new ATOM 0 HG21 THR A 2 53.089 -12.650 21.924 1.00 0.00 H new ATOM 0 HG22 THR A 2 53.447 -11.967 20.320 1.00 0.00 H new ATOM 0 HG23 THR A 2 52.073 -11.346 21.265 1.00 0.00 H new ATOM 34 N VAL A 3 52.801 -12.798 17.351 1.00 0.00 N ATOM 35 CA VAL A 3 53.505 -13.402 16.263 1.00 0.00 C ATOM 36 C VAL A 3 54.958 -13.100 16.404 1.00 0.00 C ATOM 37 O VAL A 3 55.351 -11.972 16.691 1.00 0.00 O ATOM 38 CB VAL A 3 53.029 -12.885 14.936 1.00 0.00 C ATOM 39 CG1 VAL A 3 51.858 -13.728 14.480 1.00 0.00 C ATOM 40 CG2 VAL A 3 52.609 -11.422 15.076 1.00 0.00 C ATOM 0 H VAL A 3 53.169 -11.895 17.649 1.00 0.00 H new ATOM 0 HA VAL A 3 53.322 -14.476 16.294 1.00 0.00 H new ATOM 0 HB VAL A 3 53.829 -12.946 14.199 1.00 0.00 H new ATOM 0 HG11 VAL A 3 51.501 -13.364 13.517 1.00 0.00 H new ATOM 0 HG12 VAL A 3 52.174 -14.767 14.381 1.00 0.00 H new ATOM 0 HG13 VAL A 3 51.054 -13.661 15.213 1.00 0.00 H new ATOM 0 HG21 VAL A 3 52.264 -11.049 14.112 1.00 0.00 H new ATOM 0 HG22 VAL A 3 51.803 -11.343 15.805 1.00 0.00 H new ATOM 0 HG23 VAL A 3 53.460 -10.829 15.411 1.00 0.00 H new ATOM 50 N LYS A 4 55.741 -14.113 16.202 1.00 0.00 N ATOM 51 CA LYS A 4 57.154 -13.978 16.304 1.00 0.00 C ATOM 52 C LYS A 4 57.837 -14.989 15.428 1.00 0.00 C ATOM 53 O LYS A 4 57.432 -16.149 15.358 1.00 0.00 O ATOM 54 CB LYS A 4 57.584 -14.159 17.740 1.00 0.00 C ATOM 55 CG LYS A 4 57.020 -15.479 18.302 1.00 0.00 C ATOM 56 CD LYS A 4 55.870 -15.207 19.297 1.00 0.00 C ATOM 57 CE LYS A 4 54.514 -15.126 18.568 1.00 0.00 C ATOM 58 NZ LYS A 4 53.532 -16.002 19.268 1.00 0.00 N ATOM 0 H LYS A 4 55.418 -15.051 15.963 1.00 0.00 H new ATOM 0 HA LYS A 4 57.439 -12.980 15.971 1.00 0.00 H new ATOM 0 HB2 LYS A 4 58.672 -14.164 17.804 1.00 0.00 H new ATOM 0 HB3 LYS A 4 57.233 -13.320 18.341 1.00 0.00 H new ATOM 0 HG2 LYS A 4 56.659 -16.102 17.484 1.00 0.00 H new ATOM 0 HG3 LYS A 4 57.814 -16.035 18.800 1.00 0.00 H new ATOM 0 HD2 LYS A 4 55.837 -15.999 20.045 1.00 0.00 H new ATOM 0 HD3 LYS A 4 56.057 -14.274 19.828 1.00 0.00 H new ATOM 0 HE2 LYS A 4 54.156 -14.097 18.553 1.00 0.00 H new ATOM 0 HE3 LYS A 4 54.625 -15.440 17.530 1.00 0.00 H new ATOM 0 HZ1 LYS A 4 52.577 -15.814 18.903 1.00 0.00 H new ATOM 0 HZ2 LYS A 4 53.776 -16.999 19.102 1.00 0.00 H new ATOM 0 HZ3 LYS A 4 53.557 -15.805 20.289 1.00 0.00 H new ATOM 72 N GLN A 5 58.852 -14.536 14.730 1.00 0.00 N ATOM 73 CA GLN A 5 59.555 -15.412 13.821 1.00 0.00 C ATOM 74 C GLN A 5 61.038 -15.095 13.766 1.00 0.00 C ATOM 75 O GLN A 5 61.469 -13.973 14.012 1.00 0.00 O ATOM 76 CB GLN A 5 58.951 -15.247 12.443 1.00 0.00 C ATOM 77 CG GLN A 5 57.431 -15.109 12.573 1.00 0.00 C ATOM 78 CD GLN A 5 56.789 -15.083 11.189 1.00 0.00 C ATOM 79 OE1 GLN A 5 55.709 -14.518 11.016 1.00 0.00 O ATOM 80 NE2 GLN A 5 57.391 -15.665 10.187 1.00 0.00 N ATOM 0 H GLN A 5 59.206 -13.580 14.772 1.00 0.00 H new ATOM 0 HA GLN A 5 59.453 -16.438 14.174 1.00 0.00 H new ATOM 0 HB2 GLN A 5 59.368 -14.367 11.953 1.00 0.00 H new ATOM 0 HB3 GLN A 5 59.198 -16.106 11.819 1.00 0.00 H new ATOM 0 HG2 GLN A 5 57.030 -15.940 13.153 1.00 0.00 H new ATOM 0 HG3 GLN A 5 57.185 -14.195 13.114 1.00 0.00 H new ATOM 0 HE21 GLN A 5 58.286 -16.133 10.332 1.00 0.00 H new ATOM 0 HE22 GLN A 5 56.966 -15.652 9.260 1.00 0.00 H new ATOM 89 N THR A 6 61.808 -16.101 13.435 1.00 0.00 N ATOM 90 CA THR A 6 63.233 -15.959 13.329 1.00 0.00 C ATOM 91 C THR A 6 63.643 -15.914 11.866 1.00 0.00 C ATOM 92 O THR A 6 63.606 -16.931 11.173 1.00 0.00 O ATOM 93 CB THR A 6 63.901 -17.139 14.029 1.00 0.00 C ATOM 94 OG1 THR A 6 63.101 -17.548 15.129 1.00 0.00 O ATOM 95 CG2 THR A 6 65.272 -16.719 14.527 1.00 0.00 C ATOM 0 H THR A 6 61.462 -17.039 13.232 1.00 0.00 H new ATOM 0 HA THR A 6 63.547 -15.029 13.803 1.00 0.00 H new ATOM 0 HB THR A 6 64.007 -17.968 13.329 1.00 0.00 H new ATOM 0 HG1 THR A 6 62.738 -16.758 15.581 1.00 0.00 H new ATOM 0 HG21 THR A 6 65.751 -17.561 15.027 1.00 0.00 H new ATOM 0 HG22 THR A 6 65.885 -16.402 13.683 1.00 0.00 H new ATOM 0 HG23 THR A 6 65.166 -15.892 15.229 1.00 0.00 H new ATOM 103 N VAL A 7 64.032 -14.733 11.392 1.00 0.00 N ATOM 104 CA VAL A 7 64.439 -14.602 9.994 1.00 0.00 C ATOM 105 C VAL A 7 65.958 -14.682 9.868 1.00 0.00 C ATOM 106 O VAL A 7 66.681 -13.835 10.391 1.00 0.00 O ATOM 107 CB VAL A 7 63.957 -13.261 9.405 1.00 0.00 C ATOM 108 CG1 VAL A 7 63.826 -13.367 7.872 1.00 0.00 C ATOM 109 CG2 VAL A 7 62.601 -12.876 10.017 1.00 0.00 C ATOM 0 H VAL A 7 64.074 -13.873 11.938 1.00 0.00 H new ATOM 0 HA VAL A 7 63.983 -15.422 9.440 1.00 0.00 H new ATOM 0 HB VAL A 7 64.690 -12.491 9.644 1.00 0.00 H new ATOM 0 HG11 VAL A 7 63.485 -12.413 7.469 1.00 0.00 H new ATOM 0 HG12 VAL A 7 64.795 -13.617 7.440 1.00 0.00 H new ATOM 0 HG13 VAL A 7 63.105 -14.145 7.621 1.00 0.00 H new ATOM 0 HG21 VAL A 7 62.268 -11.928 9.596 1.00 0.00 H new ATOM 0 HG22 VAL A 7 61.868 -13.650 9.793 1.00 0.00 H new ATOM 0 HG23 VAL A 7 62.705 -12.776 11.097 1.00 0.00 H new ATOM 119 N GLU A 8 66.434 -15.695 9.151 1.00 0.00 N ATOM 120 CA GLU A 8 67.867 -15.857 8.941 1.00 0.00 C ATOM 121 C GLU A 8 68.311 -14.913 7.836 1.00 0.00 C ATOM 122 O GLU A 8 67.973 -15.113 6.669 1.00 0.00 O ATOM 123 CB GLU A 8 68.186 -17.301 8.546 1.00 0.00 C ATOM 124 CG GLU A 8 67.671 -18.255 9.626 1.00 0.00 C ATOM 125 CD GLU A 8 67.684 -19.688 9.104 1.00 0.00 C ATOM 126 OE1 GLU A 8 68.749 -20.284 9.095 1.00 0.00 O ATOM 127 OE2 GLU A 8 66.630 -20.168 8.721 1.00 0.00 O ATOM 0 H GLU A 8 65.855 -16.409 8.710 1.00 0.00 H new ATOM 0 HA GLU A 8 68.397 -15.625 9.865 1.00 0.00 H new ATOM 0 HB2 GLU A 8 67.723 -17.537 7.588 1.00 0.00 H new ATOM 0 HB3 GLU A 8 69.262 -17.425 8.420 1.00 0.00 H new ATOM 0 HG2 GLU A 8 68.293 -18.178 10.518 1.00 0.00 H new ATOM 0 HG3 GLU A 8 66.659 -17.975 9.918 1.00 0.00 H new ATOM 134 N ILE A 9 69.043 -13.867 8.200 1.00 0.00 N ATOM 135 CA ILE A 9 69.479 -12.900 7.205 1.00 0.00 C ATOM 136 C ILE A 9 70.579 -13.452 6.327 1.00 0.00 C ATOM 137 O ILE A 9 71.489 -14.133 6.800 1.00 0.00 O ATOM 138 CB ILE A 9 70.028 -11.620 7.851 1.00 0.00 C ATOM 139 CG1 ILE A 9 69.653 -11.526 9.326 1.00 0.00 C ATOM 140 CG2 ILE A 9 69.480 -10.405 7.123 1.00 0.00 C ATOM 141 CD1 ILE A 9 68.145 -11.306 9.483 1.00 0.00 C ATOM 0 H ILE A 9 69.341 -13.670 9.155 1.00 0.00 H new ATOM 0 HA ILE A 9 68.591 -12.678 6.613 1.00 0.00 H new ATOM 0 HB ILE A 9 71.115 -11.651 7.775 1.00 0.00 H new ATOM 0 HG12 ILE A 9 69.949 -12.440 9.841 1.00 0.00 H new ATOM 0 HG13 ILE A 9 70.197 -10.706 9.794 1.00 0.00 H new ATOM 0 HG21 ILE A 9 69.871 -9.498 7.584 1.00 0.00 H new ATOM 0 HG22 ILE A 9 69.783 -10.440 6.077 1.00 0.00 H new ATOM 0 HG23 ILE A 9 68.392 -10.403 7.186 1.00 0.00 H new ATOM 0 HD11 ILE A 9 67.895 -11.241 10.542 1.00 0.00 H new ATOM 0 HD12 ILE A 9 67.859 -10.379 8.985 1.00 0.00 H new ATOM 0 HD13 ILE A 9 67.607 -12.141 9.034 1.00 0.00 H new ATOM 153 N THR A 10 70.539 -13.073 5.060 1.00 0.00 N ATOM 154 CA THR A 10 71.593 -13.456 4.153 1.00 0.00 C ATOM 155 C THR A 10 72.715 -12.466 4.384 1.00 0.00 C ATOM 156 O THR A 10 73.880 -12.743 4.110 1.00 0.00 O ATOM 157 CB THR A 10 71.117 -13.411 2.698 1.00 0.00 C ATOM 158 OG1 THR A 10 72.218 -13.659 1.835 1.00 0.00 O ATOM 159 CG2 THR A 10 70.526 -12.036 2.390 1.00 0.00 C ATOM 0 H THR A 10 69.797 -12.509 4.646 1.00 0.00 H new ATOM 0 HA THR A 10 71.917 -14.481 4.335 1.00 0.00 H new ATOM 0 HB THR A 10 70.352 -14.172 2.544 1.00 0.00 H new ATOM 0 HG1 THR A 10 71.916 -13.632 0.903 1.00 0.00 H new ATOM 0 HG21 THR A 10 70.189 -12.009 1.354 1.00 0.00 H new ATOM 0 HG22 THR A 10 69.681 -11.847 3.052 1.00 0.00 H new ATOM 0 HG23 THR A 10 71.286 -11.270 2.544 1.00 0.00 H new ATOM 167 N ASN A 11 72.319 -11.315 4.952 1.00 0.00 N ATOM 168 CA ASN A 11 73.248 -10.245 5.308 1.00 0.00 C ATOM 169 C ASN A 11 72.585 -8.860 5.213 1.00 0.00 C ATOM 170 O ASN A 11 73.281 -7.844 5.201 1.00 0.00 O ATOM 171 CB ASN A 11 74.494 -10.265 4.405 1.00 0.00 C ATOM 172 CG ASN A 11 75.581 -11.152 5.007 1.00 0.00 C ATOM 173 OD1 ASN A 11 75.913 -11.016 6.184 1.00 0.00 O ATOM 174 ND2 ASN A 11 76.162 -12.053 4.264 1.00 0.00 N ATOM 0 H ASN A 11 71.346 -11.106 5.175 1.00 0.00 H new ATOM 0 HA ASN A 11 73.546 -10.424 6.341 1.00 0.00 H new ATOM 0 HB2 ASN A 11 74.226 -10.632 3.414 1.00 0.00 H new ATOM 0 HB3 ASN A 11 74.874 -9.251 4.278 1.00 0.00 H new ATOM 0 HD21 ASN A 11 76.892 -12.646 4.659 1.00 0.00 H new ATOM 0 HD22 ASN A 11 75.886 -12.165 3.288 1.00 0.00 H new ATOM 181 N LYS A 12 71.251 -8.812 5.137 1.00 0.00 N ATOM 182 CA LYS A 12 70.548 -7.524 5.032 1.00 0.00 C ATOM 183 C LYS A 12 69.629 -7.261 6.235 1.00 0.00 C ATOM 184 O LYS A 12 69.785 -6.256 6.928 1.00 0.00 O ATOM 185 CB LYS A 12 69.727 -7.473 3.736 1.00 0.00 C ATOM 186 CG LYS A 12 69.066 -8.831 3.475 1.00 0.00 C ATOM 187 CD LYS A 12 68.243 -8.762 2.181 1.00 0.00 C ATOM 188 CE LYS A 12 69.140 -9.055 0.971 1.00 0.00 C ATOM 189 NZ LYS A 12 68.675 -8.253 -0.195 1.00 0.00 N ATOM 0 H LYS A 12 70.644 -9.632 5.146 1.00 0.00 H new ATOM 0 HA LYS A 12 71.309 -6.744 5.020 1.00 0.00 H new ATOM 0 HB2 LYS A 12 68.965 -6.697 3.810 1.00 0.00 H new ATOM 0 HB3 LYS A 12 70.372 -7.207 2.898 1.00 0.00 H new ATOM 0 HG2 LYS A 12 69.827 -9.607 3.393 1.00 0.00 H new ATOM 0 HG3 LYS A 12 68.423 -9.101 4.313 1.00 0.00 H new ATOM 0 HD2 LYS A 12 67.426 -9.483 2.221 1.00 0.00 H new ATOM 0 HD3 LYS A 12 67.792 -7.775 2.079 1.00 0.00 H new ATOM 0 HE2 LYS A 12 70.176 -8.810 1.205 1.00 0.00 H new ATOM 0 HE3 LYS A 12 69.110 -10.118 0.731 1.00 0.00 H new ATOM 0 HZ1 LYS A 12 69.282 -8.450 -1.016 1.00 0.00 H new ATOM 0 HZ2 LYS A 12 67.692 -8.507 -0.422 1.00 0.00 H new ATOM 0 HZ3 LYS A 12 68.726 -7.241 0.038 1.00 0.00 H new ATOM 203 N LEU A 13 68.665 -8.150 6.469 1.00 0.00 N ATOM 204 CA LEU A 13 67.724 -7.982 7.578 1.00 0.00 C ATOM 205 C LEU A 13 66.667 -6.966 7.179 1.00 0.00 C ATOM 206 O LEU A 13 65.576 -6.935 7.744 1.00 0.00 O ATOM 207 CB LEU A 13 68.470 -7.496 8.849 1.00 0.00 C ATOM 208 CG LEU A 13 67.912 -8.139 10.154 1.00 0.00 C ATOM 209 CD1 LEU A 13 68.328 -7.321 11.388 1.00 0.00 C ATOM 210 CD2 LEU A 13 66.376 -8.242 10.130 1.00 0.00 C ATOM 0 H LEU A 13 68.514 -8.990 5.910 1.00 0.00 H new ATOM 0 HA LEU A 13 67.252 -8.939 7.800 1.00 0.00 H new ATOM 0 HB2 LEU A 13 69.530 -7.732 8.756 1.00 0.00 H new ATOM 0 HB3 LEU A 13 68.390 -6.411 8.920 1.00 0.00 H new ATOM 0 HG LEU A 13 68.334 -9.142 10.212 1.00 0.00 H new ATOM 0 HD11 LEU A 13 67.927 -7.789 12.287 1.00 0.00 H new ATOM 0 HD12 LEU A 13 69.416 -7.286 11.452 1.00 0.00 H new ATOM 0 HD13 LEU A 13 67.937 -6.307 11.301 1.00 0.00 H new ATOM 0 HD21 LEU A 13 66.027 -8.696 11.058 1.00 0.00 H new ATOM 0 HD22 LEU A 13 65.946 -7.245 10.029 1.00 0.00 H new ATOM 0 HD23 LEU A 13 66.066 -8.858 9.286 1.00 0.00 H new ATOM 222 N GLY A 14 67.006 -6.111 6.219 1.00 0.00 N ATOM 223 CA GLY A 14 66.075 -5.072 5.800 1.00 0.00 C ATOM 224 C GLY A 14 65.898 -4.122 6.970 1.00 0.00 C ATOM 225 O GLY A 14 65.709 -2.917 6.809 1.00 0.00 O ATOM 0 H GLY A 14 67.899 -6.116 5.726 1.00 0.00 H new ATOM 0 HA2 GLY A 14 66.459 -4.541 4.929 1.00 0.00 H new ATOM 0 HA3 GLY A 14 65.118 -5.508 5.511 1.00 0.00 H new ATOM 229 N MET A 15 66.009 -4.705 8.156 1.00 0.00 N ATOM 230 CA MET A 15 65.915 -3.980 9.402 1.00 0.00 C ATOM 231 C MET A 15 66.644 -2.652 9.279 1.00 0.00 C ATOM 232 O MET A 15 66.209 -1.628 9.805 1.00 0.00 O ATOM 233 CB MET A 15 66.555 -4.854 10.485 1.00 0.00 C ATOM 234 CG MET A 15 67.203 -4.011 11.592 1.00 0.00 C ATOM 235 SD MET A 15 66.033 -3.848 12.957 1.00 0.00 S ATOM 236 CE MET A 15 66.289 -5.484 13.675 1.00 0.00 C ATOM 0 H MET A 15 66.168 -5.706 8.274 1.00 0.00 H new ATOM 0 HA MET A 15 64.877 -3.766 9.657 1.00 0.00 H new ATOM 0 HB2 MET A 15 65.797 -5.505 10.921 1.00 0.00 H new ATOM 0 HB3 MET A 15 67.308 -5.500 10.033 1.00 0.00 H new ATOM 0 HG2 MET A 15 68.123 -4.484 11.937 1.00 0.00 H new ATOM 0 HG3 MET A 15 67.475 -3.028 11.208 1.00 0.00 H new ATOM 0 HE1 MET A 15 66.117 -5.440 14.750 1.00 0.00 H new ATOM 0 HE2 MET A 15 65.593 -6.192 13.224 1.00 0.00 H new ATOM 0 HE3 MET A 15 67.312 -5.809 13.484 1.00 0.00 H new ATOM 246 N HIS A 16 67.763 -2.705 8.576 1.00 0.00 N ATOM 247 CA HIS A 16 68.603 -1.541 8.346 1.00 0.00 C ATOM 248 C HIS A 16 67.840 -0.233 8.545 1.00 0.00 C ATOM 249 O HIS A 16 68.170 0.555 9.431 1.00 0.00 O ATOM 250 CB HIS A 16 69.147 -1.625 6.928 1.00 0.00 C ATOM 251 CG HIS A 16 69.882 -0.359 6.582 1.00 0.00 C ATOM 252 ND1 HIS A 16 69.257 0.878 6.562 1.00 0.00 N ATOM 253 CD2 HIS A 16 71.191 -0.122 6.241 1.00 0.00 C ATOM 254 CE1 HIS A 16 70.180 1.795 6.219 1.00 0.00 C ATOM 255 NE2 HIS A 16 71.376 1.238 6.012 1.00 0.00 N ATOM 0 H HIS A 16 68.116 -3.560 8.147 1.00 0.00 H new ATOM 0 HA HIS A 16 69.415 -1.542 9.073 1.00 0.00 H new ATOM 0 HB2 HIS A 16 69.817 -2.480 6.837 1.00 0.00 H new ATOM 0 HB3 HIS A 16 68.329 -1.784 6.225 1.00 0.00 H new ATOM 0 HD2 HIS A 16 71.960 -0.876 6.163 1.00 0.00 H new ATOM 0 HE1 HIS A 16 69.978 2.852 6.123 1.00 0.00 H new ATOM 0 HE2 HIS A 16 72.240 1.709 5.744 1.00 0.00 H new ATOM 263 N ALA A 17 66.824 -0.002 7.722 1.00 0.00 N ATOM 264 CA ALA A 17 66.043 1.226 7.839 1.00 0.00 C ATOM 265 C ALA A 17 64.791 1.191 6.960 1.00 0.00 C ATOM 266 O ALA A 17 63.997 0.254 7.028 1.00 0.00 O ATOM 267 CB ALA A 17 66.908 2.426 7.448 1.00 0.00 C ATOM 0 H ALA A 17 66.525 -0.634 6.980 1.00 0.00 H new ATOM 0 HA ALA A 17 65.721 1.317 8.877 1.00 0.00 H new ATOM 0 HB1 ALA A 17 66.322 3.341 7.536 1.00 0.00 H new ATOM 0 HB2 ALA A 17 67.772 2.483 8.110 1.00 0.00 H new ATOM 0 HB3 ALA A 17 67.247 2.310 6.419 1.00 0.00 H new ATOM 273 N ARG A 18 64.626 2.243 6.153 1.00 0.00 N ATOM 274 CA ARG A 18 63.473 2.392 5.257 1.00 0.00 C ATOM 275 C ARG A 18 62.362 1.368 5.542 1.00 0.00 C ATOM 276 O ARG A 18 61.356 1.719 6.161 1.00 0.00 O ATOM 277 CB ARG A 18 63.920 2.327 3.787 1.00 0.00 C ATOM 278 CG ARG A 18 64.200 3.743 3.273 1.00 0.00 C ATOM 279 CD ARG A 18 64.853 3.671 1.886 1.00 0.00 C ATOM 280 NE ARG A 18 64.598 2.374 1.269 1.00 0.00 N ATOM 281 CZ ARG A 18 64.774 2.187 -0.035 1.00 0.00 C ATOM 282 NH1 ARG A 18 64.548 1.015 -0.563 1.00 0.00 N ATOM 283 NH2 ARG A 18 65.173 3.176 -0.788 1.00 0.00 N ATOM 0 H ARG A 18 65.288 3.017 6.102 1.00 0.00 H new ATOM 0 HA ARG A 18 63.044 3.375 5.451 1.00 0.00 H new ATOM 0 HB2 ARG A 18 64.815 1.712 3.695 1.00 0.00 H new ATOM 0 HB3 ARG A 18 63.146 1.856 3.181 1.00 0.00 H new ATOM 0 HG2 ARG A 18 63.271 4.311 3.219 1.00 0.00 H new ATOM 0 HG3 ARG A 18 64.855 4.269 3.967 1.00 0.00 H new ATOM 0 HD2 ARG A 18 64.461 4.466 1.251 1.00 0.00 H new ATOM 0 HD3 ARG A 18 65.927 3.834 1.974 1.00 0.00 H new ATOM 0 HE ARG A 18 64.279 1.597 1.848 1.00 0.00 H new ATOM 0 HH11 ARG A 18 64.236 0.242 0.025 1.00 0.00 H new ATOM 0 HH12 ARG A 18 64.683 0.872 -1.564 1.00 0.00 H new ATOM 0 HH21 ARG A 18 65.350 4.092 -0.376 1.00 0.00 H new ATOM 0 HH22 ARG A 18 65.308 3.033 -1.789 1.00 0.00 H new ATOM 297 N PRO A 19 62.495 0.129 5.114 1.00 0.00 N ATOM 298 CA PRO A 19 61.436 -0.905 5.348 1.00 0.00 C ATOM 299 C PRO A 19 61.168 -1.112 6.840 1.00 0.00 C ATOM 300 O PRO A 19 60.014 -1.110 7.309 1.00 0.00 O ATOM 301 CB PRO A 19 62.017 -2.176 4.710 1.00 0.00 C ATOM 302 CG PRO A 19 63.483 -1.932 4.596 1.00 0.00 C ATOM 303 CD PRO A 19 63.644 -0.433 4.385 1.00 0.00 C ATOM 0 HA PRO A 19 60.475 -0.617 4.922 1.00 0.00 H new ATOM 0 HB2 PRO A 19 61.812 -3.052 5.325 1.00 0.00 H new ATOM 0 HB3 PRO A 19 61.573 -2.362 3.732 1.00 0.00 H new ATOM 0 HG2 PRO A 19 64.004 -2.257 5.497 1.00 0.00 H new ATOM 0 HG3 PRO A 19 63.908 -2.491 3.762 1.00 0.00 H new ATOM 0 HD2 PRO A 19 64.591 -0.069 4.782 1.00 0.00 H new ATOM 0 HD3 PRO A 19 63.619 -0.169 3.328 1.00 0.00 H new ATOM 311 N ALA A 20 62.250 -1.269 7.580 1.00 0.00 N ATOM 312 CA ALA A 20 62.161 -1.459 9.011 1.00 0.00 C ATOM 313 C ALA A 20 61.513 -0.250 9.654 1.00 0.00 C ATOM 314 O ALA A 20 60.915 -0.344 10.723 1.00 0.00 O ATOM 315 CB ALA A 20 63.557 -1.661 9.577 1.00 0.00 C ATOM 0 H ALA A 20 63.201 -1.268 7.211 1.00 0.00 H new ATOM 0 HA ALA A 20 61.552 -2.338 9.223 1.00 0.00 H new ATOM 0 HB1 ALA A 20 63.495 -1.805 10.656 1.00 0.00 H new ATOM 0 HB2 ALA A 20 64.011 -2.540 9.119 1.00 0.00 H new ATOM 0 HB3 ALA A 20 64.167 -0.784 9.362 1.00 0.00 H new ATOM 321 N MET A 21 61.641 0.892 8.995 1.00 0.00 N ATOM 322 CA MET A 21 61.062 2.110 9.512 1.00 0.00 C ATOM 323 C MET A 21 59.577 2.174 9.175 1.00 0.00 C ATOM 324 O MET A 21 58.818 2.885 9.833 1.00 0.00 O ATOM 325 CB MET A 21 61.822 3.319 8.967 1.00 0.00 C ATOM 326 CG MET A 21 63.166 3.429 9.706 1.00 0.00 C ATOM 327 SD MET A 21 63.841 5.099 9.509 1.00 0.00 S ATOM 328 CE MET A 21 63.743 5.185 7.705 1.00 0.00 C ATOM 0 H MET A 21 62.137 0.995 8.110 1.00 0.00 H new ATOM 0 HA MET A 21 61.151 2.122 10.598 1.00 0.00 H new ATOM 0 HB2 MET A 21 61.988 3.210 7.895 1.00 0.00 H new ATOM 0 HB3 MET A 21 61.237 4.228 9.108 1.00 0.00 H new ATOM 0 HG2 MET A 21 63.029 3.205 10.764 1.00 0.00 H new ATOM 0 HG3 MET A 21 63.869 2.694 9.313 1.00 0.00 H new ATOM 0 HE1 MET A 21 64.363 6.006 7.346 1.00 0.00 H new ATOM 0 HE2 MET A 21 64.098 4.248 7.276 1.00 0.00 H new ATOM 0 HE3 MET A 21 62.709 5.353 7.404 1.00 0.00 H new ATOM 338 N LYS A 22 59.150 1.394 8.179 1.00 0.00 N ATOM 339 CA LYS A 22 57.731 1.362 7.836 1.00 0.00 C ATOM 340 C LYS A 22 56.978 0.732 8.989 1.00 0.00 C ATOM 341 O LYS A 22 55.942 1.235 9.404 1.00 0.00 O ATOM 342 CB LYS A 22 57.456 0.559 6.558 1.00 0.00 C ATOM 343 CG LYS A 22 58.553 0.814 5.534 1.00 0.00 C ATOM 344 CD LYS A 22 58.405 2.217 4.927 1.00 0.00 C ATOM 345 CE LYS A 22 57.464 2.164 3.719 1.00 0.00 C ATOM 346 NZ LYS A 22 58.202 1.633 2.537 1.00 0.00 N ATOM 0 H LYS A 22 59.748 0.793 7.612 1.00 0.00 H new ATOM 0 HA LYS A 22 57.402 2.385 7.654 1.00 0.00 H new ATOM 0 HB2 LYS A 22 57.406 -0.505 6.791 1.00 0.00 H new ATOM 0 HB3 LYS A 22 56.488 0.841 6.143 1.00 0.00 H new ATOM 0 HG2 LYS A 22 59.530 0.717 6.007 1.00 0.00 H new ATOM 0 HG3 LYS A 22 58.505 0.063 4.745 1.00 0.00 H new ATOM 0 HD2 LYS A 22 58.013 2.907 5.674 1.00 0.00 H new ATOM 0 HD3 LYS A 22 59.381 2.596 4.623 1.00 0.00 H new ATOM 0 HE2 LYS A 22 56.606 1.529 3.941 1.00 0.00 H new ATOM 0 HE3 LYS A 22 57.077 3.160 3.502 1.00 0.00 H new ATOM 0 HZ1 LYS A 22 57.652 1.815 1.674 1.00 0.00 H new ATOM 0 HZ2 LYS A 22 59.126 2.104 2.464 1.00 0.00 H new ATOM 0 HZ3 LYS A 22 58.344 0.609 2.648 1.00 0.00 H new ATOM 360 N LEU A 23 57.544 -0.348 9.534 1.00 0.00 N ATOM 361 CA LEU A 23 56.950 -1.025 10.677 1.00 0.00 C ATOM 362 C LEU A 23 56.298 0.011 11.571 1.00 0.00 C ATOM 363 O LEU A 23 55.202 -0.177 12.091 1.00 0.00 O ATOM 364 CB LEU A 23 58.074 -1.700 11.468 1.00 0.00 C ATOM 365 CG LEU A 23 58.245 -3.175 11.075 1.00 0.00 C ATOM 366 CD1 LEU A 23 59.093 -3.304 9.796 1.00 0.00 C ATOM 367 CD2 LEU A 23 58.957 -3.892 12.223 1.00 0.00 C ATOM 0 H LEU A 23 58.411 -0.768 9.199 1.00 0.00 H new ATOM 0 HA LEU A 23 56.214 -1.757 10.345 1.00 0.00 H new ATOM 0 HB2 LEU A 23 59.009 -1.168 11.296 1.00 0.00 H new ATOM 0 HB3 LEU A 23 57.860 -1.631 12.534 1.00 0.00 H new ATOM 0 HG LEU A 23 57.266 -3.616 10.885 1.00 0.00 H new ATOM 0 HD11 LEU A 23 59.201 -4.357 9.536 1.00 0.00 H new ATOM 0 HD12 LEU A 23 58.601 -2.777 8.978 1.00 0.00 H new ATOM 0 HD13 LEU A 23 60.078 -2.869 9.967 1.00 0.00 H new ATOM 0 HD21 LEU A 23 59.091 -4.943 11.968 1.00 0.00 H new ATOM 0 HD22 LEU A 23 59.931 -3.432 12.391 1.00 0.00 H new ATOM 0 HD23 LEU A 23 58.357 -3.812 13.130 1.00 0.00 H new ATOM 379 N PHE A 24 57.024 1.097 11.745 1.00 0.00 N ATOM 380 CA PHE A 24 56.589 2.196 12.585 1.00 0.00 C ATOM 381 C PHE A 24 55.545 3.055 11.870 1.00 0.00 C ATOM 382 O PHE A 24 54.398 3.151 12.309 1.00 0.00 O ATOM 383 CB PHE A 24 57.821 3.021 12.949 1.00 0.00 C ATOM 384 CG PHE A 24 59.025 2.106 13.094 1.00 0.00 C ATOM 385 CD1 PHE A 24 58.864 0.743 13.407 1.00 0.00 C ATOM 386 CD2 PHE A 24 60.311 2.617 12.881 1.00 0.00 C ATOM 387 CE1 PHE A 24 59.978 -0.089 13.501 1.00 0.00 C ATOM 388 CE2 PHE A 24 61.425 1.778 12.986 1.00 0.00 C ATOM 389 CZ PHE A 24 61.255 0.426 13.292 1.00 0.00 C ATOM 0 H PHE A 24 57.934 1.243 11.307 1.00 0.00 H new ATOM 0 HA PHE A 24 56.115 1.812 13.488 1.00 0.00 H new ATOM 0 HB2 PHE A 24 58.011 3.768 12.179 1.00 0.00 H new ATOM 0 HB3 PHE A 24 57.647 3.560 13.880 1.00 0.00 H new ATOM 0 HD1 PHE A 24 57.876 0.341 13.575 1.00 0.00 H new ATOM 0 HD2 PHE A 24 60.443 3.660 12.635 1.00 0.00 H new ATOM 0 HE1 PHE A 24 59.851 -1.135 13.736 1.00 0.00 H new ATOM 0 HE2 PHE A 24 62.417 2.176 12.830 1.00 0.00 H new ATOM 0 HZ PHE A 24 62.116 -0.222 13.367 1.00 0.00 H new ATOM 399 N GLU A 25 55.917 3.648 10.748 1.00 0.00 N ATOM 400 CA GLU A 25 54.948 4.442 10.005 1.00 0.00 C ATOM 401 C GLU A 25 53.757 3.550 9.723 1.00 0.00 C ATOM 402 O GLU A 25 52.634 4.011 9.520 1.00 0.00 O ATOM 403 CB GLU A 25 55.551 4.967 8.698 1.00 0.00 C ATOM 404 CG GLU A 25 56.356 6.239 8.978 1.00 0.00 C ATOM 405 CD GLU A 25 57.468 5.944 9.980 1.00 0.00 C ATOM 406 OE1 GLU A 25 57.152 5.728 11.138 1.00 0.00 O ATOM 407 OE2 GLU A 25 58.618 5.938 9.573 1.00 0.00 O ATOM 0 H GLU A 25 56.851 3.600 10.340 1.00 0.00 H new ATOM 0 HA GLU A 25 54.648 5.313 10.587 1.00 0.00 H new ATOM 0 HB2 GLU A 25 56.194 4.208 8.252 1.00 0.00 H new ATOM 0 HB3 GLU A 25 54.759 5.177 7.979 1.00 0.00 H new ATOM 0 HG2 GLU A 25 56.783 6.620 8.050 1.00 0.00 H new ATOM 0 HG3 GLU A 25 55.699 7.016 9.370 1.00 0.00 H new ATOM 414 N LEU A 26 54.031 2.255 9.762 1.00 0.00 N ATOM 415 CA LEU A 26 53.017 1.246 9.564 1.00 0.00 C ATOM 416 C LEU A 26 52.318 1.009 10.895 1.00 0.00 C ATOM 417 O LEU A 26 51.137 0.682 10.939 1.00 0.00 O ATOM 418 CB LEU A 26 53.677 -0.030 9.021 1.00 0.00 C ATOM 419 CG LEU A 26 52.738 -1.219 9.140 1.00 0.00 C ATOM 420 CD1 LEU A 26 52.629 -1.614 10.616 1.00 0.00 C ATOM 421 CD2 LEU A 26 51.356 -0.864 8.555 1.00 0.00 C ATOM 0 H LEU A 26 54.964 1.880 9.932 1.00 0.00 H new ATOM 0 HA LEU A 26 52.272 1.565 8.835 1.00 0.00 H new ATOM 0 HB2 LEU A 26 53.955 0.116 7.977 1.00 0.00 H new ATOM 0 HB3 LEU A 26 54.596 -0.231 9.571 1.00 0.00 H new ATOM 0 HG LEU A 26 53.129 -2.064 8.574 1.00 0.00 H new ATOM 0 HD11 LEU A 26 51.958 -2.467 10.716 1.00 0.00 H new ATOM 0 HD12 LEU A 26 53.615 -1.882 10.995 1.00 0.00 H new ATOM 0 HD13 LEU A 26 52.237 -0.774 11.189 1.00 0.00 H new ATOM 0 HD21 LEU A 26 50.691 -1.723 8.645 1.00 0.00 H new ATOM 0 HD22 LEU A 26 50.935 -0.020 9.102 1.00 0.00 H new ATOM 0 HD23 LEU A 26 51.464 -0.598 7.504 1.00 0.00 H new ATOM 433 N MET A 27 53.049 1.220 11.992 1.00 0.00 N ATOM 434 CA MET A 27 52.454 1.066 13.314 1.00 0.00 C ATOM 435 C MET A 27 51.163 1.859 13.306 1.00 0.00 C ATOM 436 O MET A 27 50.175 1.486 13.937 1.00 0.00 O ATOM 437 CB MET A 27 53.381 1.598 14.422 1.00 0.00 C ATOM 438 CG MET A 27 54.189 0.449 15.030 1.00 0.00 C ATOM 439 SD MET A 27 53.063 -0.685 15.883 1.00 0.00 S ATOM 440 CE MET A 27 53.067 -2.044 14.678 1.00 0.00 C ATOM 0 H MET A 27 54.032 1.492 11.990 1.00 0.00 H new ATOM 0 HA MET A 27 52.283 0.010 13.522 1.00 0.00 H new ATOM 0 HB2 MET A 27 54.055 2.350 14.012 1.00 0.00 H new ATOM 0 HB3 MET A 27 52.791 2.087 15.197 1.00 0.00 H new ATOM 0 HG2 MET A 27 54.735 -0.081 14.249 1.00 0.00 H new ATOM 0 HG3 MET A 27 54.930 0.839 15.728 1.00 0.00 H new ATOM 0 HE1 MET A 27 52.096 -2.096 14.185 1.00 0.00 H new ATOM 0 HE2 MET A 27 53.844 -1.868 13.934 1.00 0.00 H new ATOM 0 HE3 MET A 27 53.263 -2.985 15.192 1.00 0.00 H new ATOM 450 N GLN A 28 51.183 2.950 12.539 1.00 0.00 N ATOM 451 CA GLN A 28 50.002 3.786 12.402 1.00 0.00 C ATOM 452 C GLN A 28 48.977 3.043 11.554 1.00 0.00 C ATOM 453 O GLN A 28 47.791 3.374 11.550 1.00 0.00 O ATOM 454 CB GLN A 28 50.363 5.119 11.738 1.00 0.00 C ATOM 455 CG GLN A 28 51.342 5.900 12.631 1.00 0.00 C ATOM 456 CD GLN A 28 50.928 7.368 12.712 1.00 0.00 C ATOM 457 OE1 GLN A 28 49.780 7.672 13.035 1.00 0.00 O ATOM 458 NE2 GLN A 28 51.800 8.299 12.437 1.00 0.00 N ATOM 0 H GLN A 28 51.996 3.268 12.011 1.00 0.00 H new ATOM 0 HA GLN A 28 49.589 3.998 13.388 1.00 0.00 H new ATOM 0 HB2 GLN A 28 50.812 4.939 10.761 1.00 0.00 H new ATOM 0 HB3 GLN A 28 49.461 5.708 11.570 1.00 0.00 H new ATOM 0 HG2 GLN A 28 51.361 5.464 13.630 1.00 0.00 H new ATOM 0 HG3 GLN A 28 52.353 5.821 12.230 1.00 0.00 H new ATOM 0 HE21 GLN A 28 52.751 8.044 12.170 1.00 0.00 H new ATOM 0 HE22 GLN A 28 51.531 9.281 12.490 1.00 0.00 H new ATOM 467 N GLY A 29 49.458 2.018 10.851 1.00 0.00 N ATOM 468 CA GLY A 29 48.592 1.194 10.006 1.00 0.00 C ATOM 469 C GLY A 29 48.107 -0.022 10.789 1.00 0.00 C ATOM 470 O GLY A 29 46.906 -0.269 10.892 1.00 0.00 O ATOM 0 H GLY A 29 50.439 1.738 10.849 1.00 0.00 H new ATOM 0 HA2 GLY A 29 47.739 1.780 9.663 1.00 0.00 H new ATOM 0 HA3 GLY A 29 49.136 0.872 9.118 1.00 0.00 H new ATOM 474 N PHE A 30 49.053 -0.753 11.373 1.00 0.00 N ATOM 475 CA PHE A 30 48.719 -1.918 12.190 1.00 0.00 C ATOM 476 C PHE A 30 48.941 -1.572 13.654 1.00 0.00 C ATOM 477 O PHE A 30 49.854 -0.817 13.986 1.00 0.00 O ATOM 478 CB PHE A 30 49.599 -3.128 11.868 1.00 0.00 C ATOM 479 CG PHE A 30 49.611 -3.459 10.390 1.00 0.00 C ATOM 480 CD1 PHE A 30 48.437 -3.496 9.632 1.00 0.00 C ATOM 481 CD2 PHE A 30 50.825 -3.770 9.792 1.00 0.00 C ATOM 482 CE1 PHE A 30 48.501 -3.842 8.273 1.00 0.00 C ATOM 483 CE2 PHE A 30 50.898 -4.111 8.448 1.00 0.00 C ATOM 484 CZ PHE A 30 49.737 -4.150 7.680 1.00 0.00 C ATOM 0 H PHE A 30 50.052 -0.561 11.297 1.00 0.00 H new ATOM 0 HA PHE A 30 47.681 -2.174 11.979 1.00 0.00 H new ATOM 0 HB2 PHE A 30 50.618 -2.931 12.201 1.00 0.00 H new ATOM 0 HB3 PHE A 30 49.242 -3.992 12.428 1.00 0.00 H new ATOM 0 HD1 PHE A 30 47.487 -3.260 10.089 1.00 0.00 H new ATOM 0 HD2 PHE A 30 51.729 -3.746 10.383 1.00 0.00 H new ATOM 0 HE1 PHE A 30 47.598 -3.872 7.682 1.00 0.00 H new ATOM 0 HE2 PHE A 30 51.852 -4.345 8.000 1.00 0.00 H new ATOM 0 HZ PHE A 30 49.786 -4.416 6.634 1.00 0.00 H new ATOM 494 N ASP A 31 48.141 -2.157 14.532 1.00 0.00 N ATOM 495 CA ASP A 31 48.301 -1.933 15.952 1.00 0.00 C ATOM 496 C ASP A 31 48.982 -3.156 16.507 1.00 0.00 C ATOM 497 O ASP A 31 48.377 -4.222 16.608 1.00 0.00 O ATOM 498 CB ASP A 31 46.948 -1.720 16.626 1.00 0.00 C ATOM 499 CG ASP A 31 47.147 -1.398 18.104 1.00 0.00 C ATOM 500 OD1 ASP A 31 48.097 -0.698 18.414 1.00 0.00 O ATOM 501 OD2 ASP A 31 46.347 -1.855 18.903 1.00 0.00 O ATOM 0 H ASP A 31 47.379 -2.787 14.283 1.00 0.00 H new ATOM 0 HA ASP A 31 48.892 -1.036 16.138 1.00 0.00 H new ATOM 0 HB2 ASP A 31 46.413 -0.906 16.137 1.00 0.00 H new ATOM 0 HB3 ASP A 31 46.334 -2.615 16.519 1.00 0.00 H new ATOM 506 N ALA A 32 50.259 -3.028 16.808 1.00 0.00 N ATOM 507 CA ALA A 32 50.996 -4.151 17.277 1.00 0.00 C ATOM 508 C ALA A 32 52.360 -3.712 17.728 1.00 0.00 C ATOM 509 O ALA A 32 52.865 -2.676 17.315 1.00 0.00 O ATOM 510 CB ALA A 32 51.106 -5.162 16.152 1.00 0.00 C ATOM 0 H ALA A 32 50.791 -2.161 16.732 1.00 0.00 H new ATOM 0 HA ALA A 32 50.487 -4.608 18.126 1.00 0.00 H new ATOM 0 HB1 ALA A 32 51.669 -6.030 16.496 1.00 0.00 H new ATOM 0 HB2 ALA A 32 50.108 -5.475 15.845 1.00 0.00 H new ATOM 0 HB3 ALA A 32 51.620 -4.709 15.305 1.00 0.00 H new ATOM 516 N GLU A 33 52.940 -4.496 18.592 1.00 0.00 N ATOM 517 CA GLU A 33 54.234 -4.190 19.120 1.00 0.00 C ATOM 518 C GLU A 33 55.256 -5.134 18.542 1.00 0.00 C ATOM 519 O GLU A 33 55.524 -6.206 19.081 1.00 0.00 O ATOM 520 CB GLU A 33 54.153 -4.320 20.615 1.00 0.00 C ATOM 521 CG GLU A 33 54.820 -3.115 21.256 1.00 0.00 C ATOM 522 CD GLU A 33 54.964 -3.326 22.759 1.00 0.00 C ATOM 523 OE1 GLU A 33 54.151 -2.790 23.493 1.00 0.00 O ATOM 524 OE2 GLU A 33 55.886 -4.021 23.153 1.00 0.00 O ATOM 0 H GLU A 33 52.530 -5.360 18.947 1.00 0.00 H new ATOM 0 HA GLU A 33 54.540 -3.178 18.856 1.00 0.00 H new ATOM 0 HB2 GLU A 33 53.112 -4.386 20.931 1.00 0.00 H new ATOM 0 HB3 GLU A 33 54.643 -5.238 20.940 1.00 0.00 H new ATOM 0 HG2 GLU A 33 55.801 -2.954 20.809 1.00 0.00 H new ATOM 0 HG3 GLU A 33 54.230 -2.219 21.063 1.00 0.00 H new ATOM 531 N VAL A 34 55.806 -4.718 17.426 1.00 0.00 N ATOM 532 CA VAL A 34 56.795 -5.532 16.733 1.00 0.00 C ATOM 533 C VAL A 34 58.144 -5.426 17.416 1.00 0.00 C ATOM 534 O VAL A 34 58.727 -4.343 17.482 1.00 0.00 O ATOM 535 CB VAL A 34 56.980 -5.081 15.274 1.00 0.00 C ATOM 536 CG1 VAL A 34 57.278 -6.296 14.377 1.00 0.00 C ATOM 537 CG2 VAL A 34 55.728 -4.353 14.777 1.00 0.00 C ATOM 0 H VAL A 34 55.592 -3.828 16.975 1.00 0.00 H new ATOM 0 HA VAL A 34 56.427 -6.558 16.757 1.00 0.00 H new ATOM 0 HB VAL A 34 57.824 -4.393 15.227 1.00 0.00 H new ATOM 0 HG11 VAL A 34 57.407 -5.965 13.347 1.00 0.00 H new ATOM 0 HG12 VAL A 34 58.191 -6.785 14.718 1.00 0.00 H new ATOM 0 HG13 VAL A 34 56.448 -7.000 14.430 1.00 0.00 H new ATOM 0 HG21 VAL A 34 55.875 -4.040 13.743 1.00 0.00 H new ATOM 0 HG22 VAL A 34 54.870 -5.023 14.835 1.00 0.00 H new ATOM 0 HG23 VAL A 34 55.546 -3.476 15.399 1.00 0.00 H new ATOM 547 N LEU A 35 58.654 -6.550 17.904 1.00 0.00 N ATOM 548 CA LEU A 35 59.953 -6.541 18.550 1.00 0.00 C ATOM 549 C LEU A 35 60.967 -7.263 17.666 1.00 0.00 C ATOM 550 O LEU A 35 60.804 -8.436 17.331 1.00 0.00 O ATOM 551 CB LEU A 35 59.848 -7.205 19.929 1.00 0.00 C ATOM 552 CG LEU A 35 61.234 -7.477 20.551 1.00 0.00 C ATOM 553 CD1 LEU A 35 61.912 -8.685 19.882 1.00 0.00 C ATOM 554 CD2 LEU A 35 62.125 -6.239 20.414 1.00 0.00 C ATOM 0 H LEU A 35 58.196 -7.461 17.865 1.00 0.00 H new ATOM 0 HA LEU A 35 60.290 -5.514 18.691 1.00 0.00 H new ATOM 0 HB2 LEU A 35 59.271 -6.564 20.596 1.00 0.00 H new ATOM 0 HB3 LEU A 35 59.302 -8.144 19.838 1.00 0.00 H new ATOM 0 HG LEU A 35 61.092 -7.704 21.608 1.00 0.00 H new ATOM 0 HD11 LEU A 35 62.887 -8.854 20.339 1.00 0.00 H new ATOM 0 HD12 LEU A 35 61.290 -9.571 20.014 1.00 0.00 H new ATOM 0 HD13 LEU A 35 62.040 -8.487 18.818 1.00 0.00 H new ATOM 0 HD21 LEU A 35 63.100 -6.442 20.856 1.00 0.00 H new ATOM 0 HD22 LEU A 35 62.249 -5.995 19.359 1.00 0.00 H new ATOM 0 HD23 LEU A 35 61.661 -5.398 20.929 1.00 0.00 H new ATOM 566 N LEU A 36 62.003 -6.533 17.285 1.00 0.00 N ATOM 567 CA LEU A 36 63.064 -7.054 16.428 1.00 0.00 C ATOM 568 C LEU A 36 64.324 -7.335 17.241 1.00 0.00 C ATOM 569 O LEU A 36 64.820 -6.460 17.943 1.00 0.00 O ATOM 570 CB LEU A 36 63.378 -6.012 15.375 1.00 0.00 C ATOM 571 CG LEU A 36 62.354 -6.096 14.243 1.00 0.00 C ATOM 572 CD1 LEU A 36 60.938 -5.939 14.806 1.00 0.00 C ATOM 573 CD2 LEU A 36 62.625 -4.977 13.247 1.00 0.00 C ATOM 0 H LEU A 36 62.135 -5.560 17.560 1.00 0.00 H new ATOM 0 HA LEU A 36 62.732 -7.985 15.969 1.00 0.00 H new ATOM 0 HB2 LEU A 36 63.362 -5.017 15.819 1.00 0.00 H new ATOM 0 HB3 LEU A 36 64.382 -6.170 14.982 1.00 0.00 H new ATOM 0 HG LEU A 36 62.437 -7.065 13.750 1.00 0.00 H new ATOM 0 HD11 LEU A 36 60.214 -6.000 13.993 1.00 0.00 H new ATOM 0 HD12 LEU A 36 60.743 -6.734 15.526 1.00 0.00 H new ATOM 0 HD13 LEU A 36 60.848 -4.972 15.300 1.00 0.00 H new ATOM 0 HD21 LEU A 36 61.899 -5.029 12.435 1.00 0.00 H new ATOM 0 HD22 LEU A 36 62.539 -4.014 13.750 1.00 0.00 H new ATOM 0 HD23 LEU A 36 63.631 -5.086 12.842 1.00 0.00 H new ATOM 585 N ARG A 37 64.835 -8.559 17.152 1.00 0.00 N ATOM 586 CA ARG A 37 66.020 -8.931 17.886 1.00 0.00 C ATOM 587 C ARG A 37 66.848 -9.961 17.154 1.00 0.00 C ATOM 588 O ARG A 37 66.365 -10.665 16.277 1.00 0.00 O ATOM 589 CB ARG A 37 65.644 -9.507 19.237 1.00 0.00 C ATOM 590 CG ARG A 37 64.888 -10.831 19.062 1.00 0.00 C ATOM 591 CD ARG A 37 65.522 -11.922 19.942 1.00 0.00 C ATOM 592 NE ARG A 37 64.566 -13.003 20.209 1.00 0.00 N ATOM 593 CZ ARG A 37 63.352 -12.782 20.708 1.00 0.00 C ATOM 594 NH1 ARG A 37 62.514 -13.773 20.837 1.00 0.00 N ATOM 595 NH2 ARG A 37 63.010 -11.588 21.108 1.00 0.00 N ATOM 0 H ARG A 37 64.441 -9.303 16.577 1.00 0.00 H new ATOM 0 HA ARG A 37 66.610 -8.022 18.002 1.00 0.00 H new ATOM 0 HB2 ARG A 37 66.542 -9.670 19.833 1.00 0.00 H new ATOM 0 HB3 ARG A 37 65.024 -8.796 19.783 1.00 0.00 H new ATOM 0 HG2 ARG A 37 63.840 -10.699 19.332 1.00 0.00 H new ATOM 0 HG3 ARG A 37 64.912 -11.137 18.016 1.00 0.00 H new ATOM 0 HD2 ARG A 37 66.405 -12.326 19.447 1.00 0.00 H new ATOM 0 HD3 ARG A 37 65.856 -11.486 20.884 1.00 0.00 H new ATOM 0 HE ARG A 37 64.843 -13.963 20.004 1.00 0.00 H new ATOM 0 HH11 ARG A 37 62.790 -14.714 20.556 1.00 0.00 H new ATOM 0 HH12 ARG A 37 61.583 -13.607 21.219 1.00 0.00 H new ATOM 0 HH21 ARG A 37 63.675 -10.817 21.039 1.00 0.00 H new ATOM 0 HH22 ARG A 37 62.078 -11.425 21.489 1.00 0.00 H new ATOM 609 N ASN A 38 68.085 -10.079 17.587 1.00 0.00 N ATOM 610 CA ASN A 38 68.994 -11.071 17.036 1.00 0.00 C ATOM 611 C ASN A 38 69.113 -12.215 18.015 1.00 0.00 C ATOM 612 O ASN A 38 69.292 -11.986 19.218 1.00 0.00 O ATOM 613 CB ASN A 38 70.408 -10.535 16.862 1.00 0.00 C ATOM 614 CG ASN A 38 70.526 -9.558 15.721 1.00 0.00 C ATOM 615 OD1 ASN A 38 69.743 -9.588 14.774 1.00 0.00 O ATOM 616 ND2 ASN A 38 71.488 -8.685 15.765 1.00 0.00 N ATOM 0 H ASN A 38 68.489 -9.499 18.322 1.00 0.00 H new ATOM 0 HA ASN A 38 68.588 -11.365 16.068 1.00 0.00 H new ATOM 0 HB2 ASN A 38 70.723 -10.048 17.785 1.00 0.00 H new ATOM 0 HB3 ASN A 38 71.089 -11.369 16.692 1.00 0.00 H new ATOM 0 HD21 ASN A 38 71.601 -8.012 15.007 1.00 0.00 H new ATOM 0 HD22 ASN A 38 72.130 -8.673 16.558 1.00 0.00 H new ATOM 623 N ASP A 39 69.079 -13.433 17.507 1.00 0.00 N ATOM 624 CA ASP A 39 69.242 -14.588 18.385 1.00 0.00 C ATOM 625 C ASP A 39 70.566 -14.451 19.123 1.00 0.00 C ATOM 626 O ASP A 39 70.903 -15.253 19.994 1.00 0.00 O ATOM 627 CB ASP A 39 69.225 -15.892 17.591 1.00 0.00 C ATOM 628 CG ASP A 39 69.429 -17.076 18.531 1.00 0.00 C ATOM 629 OD1 ASP A 39 70.413 -17.778 18.362 1.00 0.00 O ATOM 630 OD2 ASP A 39 68.600 -17.263 19.405 1.00 0.00 O ATOM 0 H ASP A 39 68.944 -13.651 16.520 1.00 0.00 H new ATOM 0 HA ASP A 39 68.413 -14.618 19.092 1.00 0.00 H new ATOM 0 HB2 ASP A 39 68.276 -15.994 17.064 1.00 0.00 H new ATOM 0 HB3 ASP A 39 70.010 -15.878 16.835 1.00 0.00 H new ATOM 635 N GLU A 40 71.303 -13.406 18.759 1.00 0.00 N ATOM 636 CA GLU A 40 72.592 -13.113 19.366 1.00 0.00 C ATOM 637 C GLU A 40 72.387 -12.543 20.759 1.00 0.00 C ATOM 638 O GLU A 40 73.294 -12.547 21.591 1.00 0.00 O ATOM 639 CB GLU A 40 73.309 -12.053 18.525 1.00 0.00 C ATOM 640 CG GLU A 40 73.868 -12.667 17.235 1.00 0.00 C ATOM 641 CD GLU A 40 72.966 -13.796 16.741 1.00 0.00 C ATOM 642 OE1 GLU A 40 73.307 -14.944 16.971 1.00 0.00 O ATOM 643 OE2 GLU A 40 71.949 -13.494 16.139 1.00 0.00 O ATOM 0 H GLU A 40 71.023 -12.742 18.037 1.00 0.00 H new ATOM 0 HA GLU A 40 73.178 -14.031 19.418 1.00 0.00 H new ATOM 0 HB2 GLU A 40 72.617 -11.248 18.279 1.00 0.00 H new ATOM 0 HB3 GLU A 40 74.120 -11.611 19.104 1.00 0.00 H new ATOM 0 HG2 GLU A 40 73.951 -11.898 16.467 1.00 0.00 H new ATOM 0 HG3 GLU A 40 74.873 -13.049 17.414 1.00 0.00 H new ATOM 650 N GLY A 41 71.192 -12.021 20.983 1.00 0.00 N ATOM 651 CA GLY A 41 70.856 -11.402 22.252 1.00 0.00 C ATOM 652 C GLY A 41 70.582 -9.927 22.019 1.00 0.00 C ATOM 653 O GLY A 41 70.299 -9.176 22.953 1.00 0.00 O ATOM 0 H GLY A 41 70.436 -12.015 20.298 1.00 0.00 H new ATOM 0 HA2 GLY A 41 69.981 -11.884 22.687 1.00 0.00 H new ATOM 0 HA3 GLY A 41 71.674 -11.527 22.961 1.00 0.00 H new ATOM 657 N THR A 42 70.658 -9.523 20.750 1.00 0.00 N ATOM 658 CA THR A 42 70.402 -8.127 20.389 1.00 0.00 C ATOM 659 C THR A 42 68.905 -7.917 20.240 1.00 0.00 C ATOM 660 O THR A 42 68.247 -8.671 19.532 1.00 0.00 O ATOM 661 CB THR A 42 71.108 -7.768 19.077 1.00 0.00 C ATOM 662 OG1 THR A 42 72.398 -8.361 19.053 1.00 0.00 O ATOM 663 CG2 THR A 42 71.239 -6.252 18.972 1.00 0.00 C ATOM 0 H THR A 42 70.891 -10.132 19.965 1.00 0.00 H new ATOM 0 HA THR A 42 70.791 -7.481 21.176 1.00 0.00 H new ATOM 0 HB THR A 42 70.525 -8.142 18.235 1.00 0.00 H new ATOM 0 HG1 THR A 42 72.907 -8.006 18.294 1.00 0.00 H new ATOM 0 HG21 THR A 42 71.741 -5.994 18.040 1.00 0.00 H new ATOM 0 HG22 THR A 42 70.248 -5.799 18.988 1.00 0.00 H new ATOM 0 HG23 THR A 42 71.822 -5.878 19.814 1.00 0.00 H new ATOM 671 N GLU A 43 68.362 -6.907 20.921 1.00 0.00 N ATOM 672 CA GLU A 43 66.920 -6.654 20.855 1.00 0.00 C ATOM 673 C GLU A 43 66.598 -5.228 20.433 1.00 0.00 C ATOM 674 O GLU A 43 67.144 -4.267 20.976 1.00 0.00 O ATOM 675 CB GLU A 43 66.288 -6.926 22.221 1.00 0.00 C ATOM 676 CG GLU A 43 66.556 -8.376 22.631 1.00 0.00 C ATOM 677 CD GLU A 43 66.080 -8.610 24.061 1.00 0.00 C ATOM 678 OE1 GLU A 43 66.925 -8.737 24.931 1.00 0.00 O ATOM 679 OE2 GLU A 43 64.878 -8.658 24.264 1.00 0.00 O ATOM 0 H GLU A 43 68.885 -6.262 21.513 1.00 0.00 H new ATOM 0 HA GLU A 43 66.510 -7.324 20.100 1.00 0.00 H new ATOM 0 HB2 GLU A 43 66.700 -6.245 22.966 1.00 0.00 H new ATOM 0 HB3 GLU A 43 65.215 -6.742 22.180 1.00 0.00 H new ATOM 0 HG2 GLU A 43 66.041 -9.056 21.952 1.00 0.00 H new ATOM 0 HG3 GLU A 43 67.621 -8.594 22.553 1.00 0.00 H new ATOM 686 N ALA A 44 65.698 -5.102 19.454 1.00 0.00 N ATOM 687 CA ALA A 44 65.295 -3.798 18.956 1.00 0.00 C ATOM 688 C ALA A 44 63.780 -3.636 18.936 1.00 0.00 C ATOM 689 O ALA A 44 63.074 -4.371 18.247 1.00 0.00 O ATOM 690 CB ALA A 44 65.824 -3.615 17.539 1.00 0.00 C ATOM 0 H ALA A 44 65.239 -5.889 18.996 1.00 0.00 H new ATOM 0 HA ALA A 44 65.709 -3.047 19.628 1.00 0.00 H new ATOM 0 HB1 ALA A 44 65.524 -2.637 17.162 1.00 0.00 H new ATOM 0 HB2 ALA A 44 66.912 -3.683 17.545 1.00 0.00 H new ATOM 0 HB3 ALA A 44 65.416 -4.394 16.895 1.00 0.00 H new ATOM 696 N GLU A 45 63.294 -2.634 19.660 1.00 0.00 N ATOM 697 CA GLU A 45 61.868 -2.348 19.684 1.00 0.00 C ATOM 698 C GLU A 45 61.523 -1.488 18.478 1.00 0.00 C ATOM 699 O GLU A 45 61.951 -0.339 18.391 1.00 0.00 O ATOM 700 CB GLU A 45 61.499 -1.609 20.974 1.00 0.00 C ATOM 701 CG GLU A 45 60.085 -2.003 21.413 1.00 0.00 C ATOM 702 CD GLU A 45 59.721 -1.280 22.705 1.00 0.00 C ATOM 703 OE1 GLU A 45 59.860 -1.882 23.757 1.00 0.00 O ATOM 704 OE2 GLU A 45 59.308 -0.135 22.624 1.00 0.00 O ATOM 0 H GLU A 45 63.863 -2.011 20.233 1.00 0.00 H new ATOM 0 HA GLU A 45 61.306 -3.281 19.648 1.00 0.00 H new ATOM 0 HB2 GLU A 45 62.214 -1.852 21.760 1.00 0.00 H new ATOM 0 HB3 GLU A 45 61.553 -0.532 20.815 1.00 0.00 H new ATOM 0 HG2 GLU A 45 59.369 -1.751 20.631 1.00 0.00 H new ATOM 0 HG3 GLU A 45 60.028 -3.081 21.561 1.00 0.00 H new ATOM 711 N ALA A 46 60.770 -2.057 17.543 1.00 0.00 N ATOM 712 CA ALA A 46 60.389 -1.348 16.327 1.00 0.00 C ATOM 713 C ALA A 46 60.617 0.167 16.432 1.00 0.00 C ATOM 714 O ALA A 46 61.478 0.726 15.755 1.00 0.00 O ATOM 715 CB ALA A 46 58.911 -1.618 16.024 1.00 0.00 C ATOM 0 H ALA A 46 60.411 -3.010 17.604 1.00 0.00 H new ATOM 0 HA ALA A 46 61.023 -1.719 15.522 1.00 0.00 H new ATOM 0 HB1 ALA A 46 58.623 -1.089 15.115 1.00 0.00 H new ATOM 0 HB2 ALA A 46 58.758 -2.688 15.885 1.00 0.00 H new ATOM 0 HB3 ALA A 46 58.299 -1.269 16.856 1.00 0.00 H new ATOM 721 N ASN A 47 59.809 0.820 17.255 1.00 0.00 N ATOM 722 CA ASN A 47 59.879 2.274 17.417 1.00 0.00 C ATOM 723 C ASN A 47 61.245 2.789 17.889 1.00 0.00 C ATOM 724 O ASN A 47 61.360 3.966 18.232 1.00 0.00 O ATOM 725 CB ASN A 47 58.809 2.723 18.413 1.00 0.00 C ATOM 726 CG ASN A 47 58.641 4.237 18.350 1.00 0.00 C ATOM 727 OD1 ASN A 47 59.332 4.995 19.157 1.00 0.00 O flip ATOM 728 ND2 ASN A 47 57.860 4.743 17.544 1.00 0.00 N flip ATOM 0 H ASN A 47 59.094 0.368 17.825 1.00 0.00 H new ATOM 0 HA ASN A 47 59.712 2.698 16.427 1.00 0.00 H new ATOM 0 HB2 ASN A 47 57.862 2.234 18.187 1.00 0.00 H new ATOM 0 HB3 ASN A 47 59.090 2.422 19.422 1.00 0.00 H new ATOM 0 HD21 ASN A 47 57.321 4.149 16.914 1.00 0.00 H new ATOM 0 HD22 ASN A 47 57.752 5.757 17.506 1.00 0.00 H new ATOM 735 N SER A 48 62.279 1.944 17.920 1.00 0.00 N ATOM 736 CA SER A 48 63.588 2.401 18.367 1.00 0.00 C ATOM 737 C SER A 48 64.630 2.261 17.259 1.00 0.00 C ATOM 738 O SER A 48 65.503 1.398 17.327 1.00 0.00 O ATOM 739 CB SER A 48 64.013 1.583 19.577 1.00 0.00 C ATOM 740 OG SER A 48 63.193 1.922 20.688 1.00 0.00 O ATOM 0 H SER A 48 62.234 0.962 17.647 1.00 0.00 H new ATOM 0 HA SER A 48 63.518 3.456 18.632 1.00 0.00 H new ATOM 0 HB2 SER A 48 63.927 0.519 19.359 1.00 0.00 H new ATOM 0 HB3 SER A 48 65.060 1.777 19.811 1.00 0.00 H new ATOM 0 HG SER A 48 63.465 1.394 21.468 1.00 0.00 H new ATOM 746 N VAL A 49 64.538 3.120 16.242 1.00 0.00 N ATOM 747 CA VAL A 49 65.488 3.080 15.130 1.00 0.00 C ATOM 748 C VAL A 49 66.909 2.922 15.647 1.00 0.00 C ATOM 749 O VAL A 49 67.758 2.324 14.986 1.00 0.00 O ATOM 750 CB VAL A 49 65.392 4.357 14.297 1.00 0.00 C ATOM 751 CG1 VAL A 49 65.754 4.052 12.841 1.00 0.00 C ATOM 752 CG2 VAL A 49 63.962 4.900 14.362 1.00 0.00 C ATOM 0 H VAL A 49 63.824 3.844 16.166 1.00 0.00 H new ATOM 0 HA VAL A 49 65.237 2.224 14.504 1.00 0.00 H new ATOM 0 HB VAL A 49 66.085 5.099 14.693 1.00 0.00 H new ATOM 0 HG11 VAL A 49 65.684 4.965 12.250 1.00 0.00 H new ATOM 0 HG12 VAL A 49 66.772 3.665 12.793 1.00 0.00 H new ATOM 0 HG13 VAL A 49 65.064 3.308 12.443 1.00 0.00 H new ATOM 0 HG21 VAL A 49 63.892 5.811 13.768 1.00 0.00 H new ATOM 0 HG22 VAL A 49 63.272 4.155 13.967 1.00 0.00 H new ATOM 0 HG23 VAL A 49 63.703 5.121 15.398 1.00 0.00 H new ATOM 762 N ILE A 50 67.159 3.447 16.839 1.00 0.00 N ATOM 763 CA ILE A 50 68.459 3.348 17.441 1.00 0.00 C ATOM 764 C ILE A 50 68.778 1.881 17.625 1.00 0.00 C ATOM 765 O ILE A 50 69.902 1.428 17.405 1.00 0.00 O ATOM 766 CB ILE A 50 68.395 4.088 18.780 1.00 0.00 C ATOM 767 CG1 ILE A 50 69.463 5.183 18.827 1.00 0.00 C ATOM 768 CG2 ILE A 50 68.574 3.127 19.946 1.00 0.00 C ATOM 769 CD1 ILE A 50 70.854 4.579 18.600 1.00 0.00 C ATOM 0 H ILE A 50 66.469 3.945 17.401 1.00 0.00 H new ATOM 0 HA ILE A 50 69.242 3.792 16.827 1.00 0.00 H new ATOM 0 HB ILE A 50 67.410 4.547 18.869 1.00 0.00 H new ATOM 0 HG12 ILE A 50 69.257 5.935 18.065 1.00 0.00 H new ATOM 0 HG13 ILE A 50 69.432 5.690 19.792 1.00 0.00 H new ATOM 0 HG21 ILE A 50 68.524 3.680 20.884 1.00 0.00 H new ATOM 0 HG22 ILE A 50 67.783 2.377 19.924 1.00 0.00 H new ATOM 0 HG23 ILE A 50 69.543 2.635 19.866 1.00 0.00 H new ATOM 0 HD11 ILE A 50 71.604 5.369 18.636 1.00 0.00 H new ATOM 0 HD12 ILE A 50 71.063 3.844 19.378 1.00 0.00 H new ATOM 0 HD13 ILE A 50 70.885 4.093 17.625 1.00 0.00 H new ATOM 781 N ALA A 51 67.750 1.146 18.004 1.00 0.00 N ATOM 782 CA ALA A 51 67.874 -0.269 18.194 1.00 0.00 C ATOM 783 C ALA A 51 68.177 -0.915 16.857 1.00 0.00 C ATOM 784 O ALA A 51 69.212 -1.550 16.686 1.00 0.00 O ATOM 785 CB ALA A 51 66.567 -0.810 18.766 1.00 0.00 C ATOM 0 H ALA A 51 66.817 1.518 18.185 1.00 0.00 H new ATOM 0 HA ALA A 51 68.682 -0.494 18.890 1.00 0.00 H new ATOM 0 HB1 ALA A 51 66.653 -1.887 18.914 1.00 0.00 H new ATOM 0 HB2 ALA A 51 66.361 -0.328 19.722 1.00 0.00 H new ATOM 0 HB3 ALA A 51 65.753 -0.603 18.072 1.00 0.00 H new ATOM 791 N LEU A 52 67.275 -0.720 15.904 1.00 0.00 N ATOM 792 CA LEU A 52 67.454 -1.268 14.576 1.00 0.00 C ATOM 793 C LEU A 52 68.889 -1.066 14.115 1.00 0.00 C ATOM 794 O LEU A 52 69.490 -1.963 13.524 1.00 0.00 O ATOM 795 CB LEU A 52 66.475 -0.595 13.608 1.00 0.00 C ATOM 796 CG LEU A 52 65.042 -1.119 13.858 1.00 0.00 C ATOM 797 CD1 LEU A 52 64.265 -0.122 14.718 1.00 0.00 C ATOM 798 CD2 LEU A 52 64.314 -1.307 12.520 1.00 0.00 C ATOM 0 H LEU A 52 66.415 -0.187 16.031 1.00 0.00 H new ATOM 0 HA LEU A 52 67.250 -2.339 14.596 1.00 0.00 H new ATOM 0 HB2 LEU A 52 66.504 0.486 13.741 1.00 0.00 H new ATOM 0 HB3 LEU A 52 66.771 -0.798 12.579 1.00 0.00 H new ATOM 0 HG LEU A 52 65.103 -2.076 14.377 1.00 0.00 H new ATOM 0 HD11 LEU A 52 63.256 -0.498 14.890 1.00 0.00 H new ATOM 0 HD12 LEU A 52 64.772 0.006 15.674 1.00 0.00 H new ATOM 0 HD13 LEU A 52 64.212 0.838 14.204 1.00 0.00 H new ATOM 0 HD21 LEU A 52 63.305 -1.676 12.704 1.00 0.00 H new ATOM 0 HD22 LEU A 52 64.261 -0.352 11.997 1.00 0.00 H new ATOM 0 HD23 LEU A 52 64.858 -2.026 11.908 1.00 0.00 H new ATOM 810 N LEU A 53 69.448 0.102 14.408 1.00 0.00 N ATOM 811 CA LEU A 53 70.828 0.372 14.032 1.00 0.00 C ATOM 812 C LEU A 53 71.747 -0.669 14.678 1.00 0.00 C ATOM 813 O LEU A 53 72.778 -1.043 14.120 1.00 0.00 O ATOM 814 CB LEU A 53 71.217 1.778 14.505 1.00 0.00 C ATOM 815 CG LEU A 53 72.204 2.427 13.523 1.00 0.00 C ATOM 816 CD1 LEU A 53 73.417 1.513 13.328 1.00 0.00 C ATOM 817 CD2 LEU A 53 71.518 2.673 12.169 1.00 0.00 C ATOM 0 H LEU A 53 68.977 0.864 14.896 1.00 0.00 H new ATOM 0 HA LEU A 53 70.931 0.315 12.948 1.00 0.00 H new ATOM 0 HB2 LEU A 53 70.324 2.397 14.594 1.00 0.00 H new ATOM 0 HB3 LEU A 53 71.666 1.722 15.497 1.00 0.00 H new ATOM 0 HG LEU A 53 72.533 3.382 13.933 1.00 0.00 H new ATOM 0 HD11 LEU A 53 74.114 1.978 12.631 1.00 0.00 H new ATOM 0 HD12 LEU A 53 73.912 1.356 14.286 1.00 0.00 H new ATOM 0 HD13 LEU A 53 73.089 0.554 12.928 1.00 0.00 H new ATOM 0 HD21 LEU A 53 72.227 3.133 11.480 1.00 0.00 H new ATOM 0 HD22 LEU A 53 71.176 1.724 11.757 1.00 0.00 H new ATOM 0 HD23 LEU A 53 70.665 3.337 12.309 1.00 0.00 H new ATOM 829 N MET A 54 71.356 -1.114 15.869 1.00 0.00 N ATOM 830 CA MET A 54 72.133 -2.100 16.628 1.00 0.00 C ATOM 831 C MET A 54 72.315 -3.419 15.871 1.00 0.00 C ATOM 832 O MET A 54 73.437 -3.883 15.670 1.00 0.00 O ATOM 833 CB MET A 54 71.416 -2.410 17.949 1.00 0.00 C ATOM 834 CG MET A 54 72.384 -3.117 18.900 1.00 0.00 C ATOM 835 SD MET A 54 73.561 -1.915 19.569 1.00 0.00 S ATOM 836 CE MET A 54 74.347 -3.014 20.772 1.00 0.00 C ATOM 0 H MET A 54 70.502 -0.808 16.335 1.00 0.00 H new ATOM 0 HA MET A 54 73.117 -1.662 16.797 1.00 0.00 H new ATOM 0 HB2 MET A 54 71.052 -1.488 18.403 1.00 0.00 H new ATOM 0 HB3 MET A 54 70.546 -3.040 17.764 1.00 0.00 H new ATOM 0 HG2 MET A 54 71.832 -3.591 19.711 1.00 0.00 H new ATOM 0 HG3 MET A 54 72.917 -3.908 18.372 1.00 0.00 H new ATOM 0 HE1 MET A 54 75.122 -2.469 21.311 1.00 0.00 H new ATOM 0 HE2 MET A 54 73.599 -3.374 21.478 1.00 0.00 H new ATOM 0 HE3 MET A 54 74.794 -3.862 20.253 1.00 0.00 H new ATOM 846 N LEU A 55 71.200 -4.032 15.501 1.00 0.00 N ATOM 847 CA LEU A 55 71.216 -5.327 14.815 1.00 0.00 C ATOM 848 C LEU A 55 71.394 -5.173 13.308 1.00 0.00 C ATOM 849 O LEU A 55 71.621 -6.149 12.603 1.00 0.00 O ATOM 850 CB LEU A 55 69.917 -6.082 15.115 1.00 0.00 C ATOM 851 CG LEU A 55 69.183 -5.408 16.269 1.00 0.00 C ATOM 852 CD1 LEU A 55 68.497 -4.144 15.764 1.00 0.00 C ATOM 853 CD2 LEU A 55 68.145 -6.370 16.850 1.00 0.00 C ATOM 0 H LEU A 55 70.266 -3.656 15.663 1.00 0.00 H new ATOM 0 HA LEU A 55 72.070 -5.893 15.188 1.00 0.00 H new ATOM 0 HB2 LEU A 55 69.283 -6.099 14.229 1.00 0.00 H new ATOM 0 HB3 LEU A 55 70.138 -7.119 15.369 1.00 0.00 H new ATOM 0 HG LEU A 55 69.896 -5.142 17.049 1.00 0.00 H new ATOM 0 HD11 LEU A 55 67.972 -3.661 16.588 1.00 0.00 H new ATOM 0 HD12 LEU A 55 69.244 -3.461 15.360 1.00 0.00 H new ATOM 0 HD13 LEU A 55 67.784 -4.405 14.982 1.00 0.00 H new ATOM 0 HD21 LEU A 55 67.622 -5.886 17.675 1.00 0.00 H new ATOM 0 HD22 LEU A 55 67.428 -6.643 16.076 1.00 0.00 H new ATOM 0 HD23 LEU A 55 68.645 -7.268 17.214 1.00 0.00 H new ATOM 865 N ASP A 56 71.298 -3.950 12.822 1.00 0.00 N ATOM 866 CA ASP A 56 71.465 -3.693 11.401 1.00 0.00 C ATOM 867 C ASP A 56 72.716 -4.407 10.929 1.00 0.00 C ATOM 868 O ASP A 56 72.871 -4.718 9.748 1.00 0.00 O ATOM 869 CB ASP A 56 71.591 -2.190 11.144 1.00 0.00 C ATOM 870 CG ASP A 56 71.935 -1.938 9.680 1.00 0.00 C ATOM 871 OD1 ASP A 56 71.557 -2.753 8.855 1.00 0.00 O ATOM 872 OD2 ASP A 56 72.572 -0.935 9.406 1.00 0.00 O ATOM 0 H ASP A 56 71.106 -3.122 13.385 1.00 0.00 H new ATOM 0 HA ASP A 56 70.596 -4.060 10.855 1.00 0.00 H new ATOM 0 HB2 ASP A 56 70.656 -1.690 11.398 1.00 0.00 H new ATOM 0 HB3 ASP A 56 72.364 -1.767 11.786 1.00 0.00 H new ATOM 877 N SER A 57 73.594 -4.681 11.885 1.00 0.00 N ATOM 878 CA SER A 57 74.829 -5.383 11.599 1.00 0.00 C ATOM 879 C SER A 57 74.552 -6.876 11.521 1.00 0.00 C ATOM 880 O SER A 57 75.440 -7.661 11.189 1.00 0.00 O ATOM 881 CB SER A 57 75.859 -5.103 12.694 1.00 0.00 C ATOM 882 OG SER A 57 77.143 -5.520 12.249 1.00 0.00 O ATOM 0 H SER A 57 73.470 -4.426 12.865 1.00 0.00 H new ATOM 0 HA SER A 57 75.228 -5.035 10.646 1.00 0.00 H new ATOM 0 HB2 SER A 57 75.872 -4.040 12.934 1.00 0.00 H new ATOM 0 HB3 SER A 57 75.588 -5.632 13.608 1.00 0.00 H new ATOM 0 HG SER A 57 77.060 -6.359 11.749 1.00 0.00 H new ATOM 888 N ALA A 58 73.306 -7.264 11.828 1.00 0.00 N ATOM 889 CA ALA A 58 72.927 -8.687 11.778 1.00 0.00 C ATOM 890 C ALA A 58 73.699 -9.391 10.667 1.00 0.00 C ATOM 891 O ALA A 58 74.052 -10.560 10.784 1.00 0.00 O ATOM 892 CB ALA A 58 71.425 -8.844 11.520 1.00 0.00 C ATOM 0 H ALA A 58 72.557 -6.630 12.108 1.00 0.00 H new ATOM 0 HA ALA A 58 73.169 -9.135 12.741 1.00 0.00 H new ATOM 0 HB1 ALA A 58 71.170 -9.903 11.487 1.00 0.00 H new ATOM 0 HB2 ALA A 58 70.866 -8.361 12.321 1.00 0.00 H new ATOM 0 HB3 ALA A 58 71.169 -8.380 10.568 1.00 0.00 H new ATOM 898 N LYS A 59 73.957 -8.647 9.595 1.00 0.00 N ATOM 899 CA LYS A 59 74.697 -9.155 8.441 1.00 0.00 C ATOM 900 C LYS A 59 75.073 -10.634 8.580 1.00 0.00 C ATOM 901 O LYS A 59 76.230 -10.956 8.848 1.00 0.00 O ATOM 902 CB LYS A 59 75.980 -8.341 8.257 1.00 0.00 C ATOM 903 CG LYS A 59 75.634 -6.932 7.774 1.00 0.00 C ATOM 904 CD LYS A 59 76.926 -6.173 7.464 1.00 0.00 C ATOM 905 CE LYS A 59 76.588 -4.798 6.887 1.00 0.00 C ATOM 906 NZ LYS A 59 77.806 -4.210 6.260 1.00 0.00 N ATOM 0 H LYS A 59 73.660 -7.676 9.501 1.00 0.00 H new ATOM 0 HA LYS A 59 74.040 -9.057 7.577 1.00 0.00 H new ATOM 0 HB2 LYS A 59 76.527 -8.289 9.199 1.00 0.00 H new ATOM 0 HB3 LYS A 59 76.633 -8.832 7.536 1.00 0.00 H new ATOM 0 HG2 LYS A 59 75.007 -6.984 6.884 1.00 0.00 H new ATOM 0 HG3 LYS A 59 75.062 -6.404 8.537 1.00 0.00 H new ATOM 0 HD2 LYS A 59 77.521 -6.062 8.371 1.00 0.00 H new ATOM 0 HD3 LYS A 59 77.530 -6.738 6.754 1.00 0.00 H new ATOM 0 HE2 LYS A 59 75.792 -4.888 6.147 1.00 0.00 H new ATOM 0 HE3 LYS A 59 76.218 -4.142 7.675 1.00 0.00 H new ATOM 0 HZ1 LYS A 59 77.577 -3.275 5.867 1.00 0.00 H new ATOM 0 HZ2 LYS A 59 78.552 -4.111 6.977 1.00 0.00 H new ATOM 0 HZ3 LYS A 59 78.139 -4.834 5.497 1.00 0.00 H new ATOM 920 N GLY A 60 74.106 -11.531 8.376 1.00 0.00 N ATOM 921 CA GLY A 60 74.384 -12.967 8.462 1.00 0.00 C ATOM 922 C GLY A 60 73.691 -13.614 9.656 1.00 0.00 C ATOM 923 O GLY A 60 73.158 -14.718 9.547 1.00 0.00 O ATOM 0 H GLY A 60 73.139 -11.295 8.154 1.00 0.00 H new ATOM 0 HA2 GLY A 60 74.056 -13.455 7.544 1.00 0.00 H new ATOM 0 HA3 GLY A 60 75.460 -13.124 8.539 1.00 0.00 H new ATOM 927 N ARG A 61 73.707 -12.929 10.791 1.00 0.00 N ATOM 928 CA ARG A 61 73.078 -13.453 11.996 1.00 0.00 C ATOM 929 C ARG A 61 71.638 -13.847 11.701 1.00 0.00 C ATOM 930 O ARG A 61 71.255 -14.010 10.544 1.00 0.00 O ATOM 931 CB ARG A 61 73.092 -12.389 13.099 1.00 0.00 C ATOM 932 CG ARG A 61 74.508 -11.811 13.257 1.00 0.00 C ATOM 933 CD ARG A 61 75.341 -12.679 14.207 1.00 0.00 C ATOM 934 NE ARG A 61 76.147 -11.844 15.100 1.00 0.00 N ATOM 935 CZ ARG A 61 76.799 -10.766 14.664 1.00 0.00 C ATOM 936 NH1 ARG A 61 77.464 -10.026 15.508 1.00 0.00 N ATOM 937 NH2 ARG A 61 76.795 -10.458 13.395 1.00 0.00 N ATOM 0 H ARG A 61 74.146 -12.015 10.903 1.00 0.00 H new ATOM 0 HA ARG A 61 73.635 -14.329 12.328 1.00 0.00 H new ATOM 0 HB2 ARG A 61 72.390 -11.591 12.855 1.00 0.00 H new ATOM 0 HB3 ARG A 61 72.762 -12.826 14.041 1.00 0.00 H new ATOM 0 HG2 ARG A 61 74.995 -11.757 12.284 1.00 0.00 H new ATOM 0 HG3 ARG A 61 74.450 -10.793 13.642 1.00 0.00 H new ATOM 0 HD2 ARG A 61 74.682 -13.318 14.795 1.00 0.00 H new ATOM 0 HD3 ARG A 61 75.992 -13.336 13.630 1.00 0.00 H new ATOM 0 HE ARG A 61 76.212 -12.095 16.087 1.00 0.00 H new ATOM 0 HH11 ARG A 61 77.484 -10.273 16.497 1.00 0.00 H new ATOM 0 HH12 ARG A 61 77.964 -9.200 15.178 1.00 0.00 H new ATOM 0 HH21 ARG A 61 76.291 -11.044 12.730 1.00 0.00 H new ATOM 0 HH22 ARG A 61 77.296 -9.632 13.069 1.00 0.00 H new ATOM 951 N GLN A 62 70.837 -13.979 12.749 1.00 0.00 N ATOM 952 CA GLN A 62 69.438 -14.325 12.589 1.00 0.00 C ATOM 953 C GLN A 62 68.621 -13.458 13.528 1.00 0.00 C ATOM 954 O GLN A 62 68.993 -13.258 14.684 1.00 0.00 O ATOM 955 CB GLN A 62 69.215 -15.803 12.901 1.00 0.00 C ATOM 956 CG GLN A 62 69.619 -16.079 14.347 1.00 0.00 C ATOM 957 CD GLN A 62 70.233 -17.471 14.472 1.00 0.00 C ATOM 958 OE1 GLN A 62 71.448 -17.626 14.354 1.00 0.00 O ATOM 959 NE2 GLN A 62 69.462 -18.497 14.706 1.00 0.00 N ATOM 0 H GLN A 62 71.134 -13.851 13.716 1.00 0.00 H new ATOM 0 HA GLN A 62 69.129 -14.151 11.558 1.00 0.00 H new ATOM 0 HB2 GLN A 62 68.168 -16.065 12.747 1.00 0.00 H new ATOM 0 HB3 GLN A 62 69.802 -16.422 12.223 1.00 0.00 H new ATOM 0 HG2 GLN A 62 70.335 -15.328 14.681 1.00 0.00 H new ATOM 0 HG3 GLN A 62 68.747 -16.000 14.996 1.00 0.00 H new ATOM 0 HE21 GLN A 62 68.455 -18.367 14.804 1.00 0.00 H new ATOM 0 HE22 GLN A 62 69.866 -19.430 14.791 1.00 0.00 H new ATOM 968 N ILE A 63 67.526 -12.925 13.023 1.00 0.00 N ATOM 969 CA ILE A 63 66.680 -12.058 13.809 1.00 0.00 C ATOM 970 C ILE A 63 65.445 -12.789 14.257 1.00 0.00 C ATOM 971 O ILE A 63 64.944 -13.673 13.569 1.00 0.00 O ATOM 972 CB ILE A 63 66.273 -10.868 12.959 1.00 0.00 C ATOM 973 CG1 ILE A 63 65.585 -9.814 13.823 1.00 0.00 C ATOM 974 CG2 ILE A 63 65.311 -11.341 11.873 1.00 0.00 C ATOM 975 CD1 ILE A 63 66.631 -8.857 14.384 1.00 0.00 C ATOM 0 H ILE A 63 67.203 -13.080 12.068 1.00 0.00 H new ATOM 0 HA ILE A 63 67.230 -11.727 14.690 1.00 0.00 H new ATOM 0 HB ILE A 63 67.161 -10.427 12.506 1.00 0.00 H new ATOM 0 HG12 ILE A 63 64.853 -9.264 13.231 1.00 0.00 H new ATOM 0 HG13 ILE A 63 65.041 -10.294 14.637 1.00 0.00 H new ATOM 0 HG21 ILE A 63 65.013 -10.493 11.257 1.00 0.00 H new ATOM 0 HG22 ILE A 63 65.804 -12.087 11.250 1.00 0.00 H new ATOM 0 HG23 ILE A 63 64.428 -11.782 12.336 1.00 0.00 H new ATOM 0 HD11 ILE A 63 66.141 -8.104 15.001 1.00 0.00 H new ATOM 0 HD12 ILE A 63 67.346 -9.414 14.990 1.00 0.00 H new ATOM 0 HD13 ILE A 63 67.155 -8.368 13.562 1.00 0.00 H new ATOM 987 N GLU A 64 64.948 -12.378 15.401 1.00 0.00 N ATOM 988 CA GLU A 64 63.744 -12.948 15.959 1.00 0.00 C ATOM 989 C GLU A 64 62.691 -11.860 15.985 1.00 0.00 C ATOM 990 O GLU A 64 62.756 -10.942 16.807 1.00 0.00 O ATOM 991 CB GLU A 64 64.018 -13.482 17.372 1.00 0.00 C ATOM 992 CG GLU A 64 63.490 -14.911 17.509 1.00 0.00 C ATOM 993 CD GLU A 64 61.969 -14.920 17.402 1.00 0.00 C ATOM 994 OE1 GLU A 64 61.359 -13.956 17.835 1.00 0.00 O ATOM 995 OE2 GLU A 64 61.437 -15.890 16.888 1.00 0.00 O ATOM 0 H GLU A 64 65.366 -11.641 15.969 1.00 0.00 H new ATOM 0 HA GLU A 64 63.397 -13.786 15.355 1.00 0.00 H new ATOM 0 HB2 GLU A 64 65.089 -13.461 17.575 1.00 0.00 H new ATOM 0 HB3 GLU A 64 63.541 -12.838 18.111 1.00 0.00 H new ATOM 0 HG2 GLU A 64 63.921 -15.542 16.732 1.00 0.00 H new ATOM 0 HG3 GLU A 64 63.797 -15.330 18.467 1.00 0.00 H new ATOM 1002 N VAL A 65 61.739 -11.942 15.065 1.00 0.00 N ATOM 1003 CA VAL A 65 60.708 -10.939 14.992 1.00 0.00 C ATOM 1004 C VAL A 65 59.570 -11.306 15.908 1.00 0.00 C ATOM 1005 O VAL A 65 59.175 -12.464 15.963 1.00 0.00 O ATOM 1006 CB VAL A 65 60.183 -10.845 13.563 1.00 0.00 C ATOM 1007 CG1 VAL A 65 59.344 -12.081 13.238 1.00 0.00 C ATOM 1008 CG2 VAL A 65 59.321 -9.594 13.437 1.00 0.00 C ATOM 0 H VAL A 65 61.667 -12.686 14.371 1.00 0.00 H new ATOM 0 HA VAL A 65 61.127 -9.980 15.296 1.00 0.00 H new ATOM 0 HB VAL A 65 61.019 -10.791 12.866 1.00 0.00 H new ATOM 0 HG11 VAL A 65 58.971 -12.009 12.216 1.00 0.00 H new ATOM 0 HG12 VAL A 65 59.959 -12.975 13.338 1.00 0.00 H new ATOM 0 HG13 VAL A 65 58.502 -12.141 13.928 1.00 0.00 H new ATOM 0 HG21 VAL A 65 58.940 -9.516 12.419 1.00 0.00 H new ATOM 0 HG22 VAL A 65 58.485 -9.656 14.134 1.00 0.00 H new ATOM 0 HG23 VAL A 65 59.921 -8.714 13.668 1.00 0.00 H new ATOM 1018 N GLU A 66 59.028 -10.326 16.608 1.00 0.00 N ATOM 1019 CA GLU A 66 57.901 -10.601 17.475 1.00 0.00 C ATOM 1020 C GLU A 66 56.948 -9.411 17.526 1.00 0.00 C ATOM 1021 O GLU A 66 57.311 -8.352 18.031 1.00 0.00 O ATOM 1022 CB GLU A 66 58.358 -10.942 18.891 1.00 0.00 C ATOM 1023 CG GLU A 66 57.134 -10.967 19.814 1.00 0.00 C ATOM 1024 CD GLU A 66 57.467 -11.700 21.109 1.00 0.00 C ATOM 1025 OE1 GLU A 66 58.589 -12.164 21.232 1.00 0.00 O ATOM 1026 OE2 GLU A 66 56.596 -11.787 21.959 1.00 0.00 O ATOM 0 H GLU A 66 59.341 -9.355 16.594 1.00 0.00 H new ATOM 0 HA GLU A 66 57.379 -11.462 17.057 1.00 0.00 H new ATOM 0 HB2 GLU A 66 58.859 -11.910 18.903 1.00 0.00 H new ATOM 0 HB3 GLU A 66 59.080 -10.205 19.242 1.00 0.00 H new ATOM 0 HG2 GLU A 66 56.815 -9.948 20.036 1.00 0.00 H new ATOM 0 HG3 GLU A 66 56.301 -11.460 19.312 1.00 0.00 H new ATOM 1033 N ALA A 67 55.719 -9.588 17.042 1.00 0.00 N ATOM 1034 CA ALA A 67 54.744 -8.505 17.093 1.00 0.00 C ATOM 1035 C ALA A 67 53.583 -8.908 17.981 1.00 0.00 C ATOM 1036 O ALA A 67 53.322 -10.096 18.164 1.00 0.00 O ATOM 1037 CB ALA A 67 54.260 -8.149 15.690 1.00 0.00 C ATOM 0 H ALA A 67 55.382 -10.453 16.619 1.00 0.00 H new ATOM 0 HA ALA A 67 55.218 -7.618 17.514 1.00 0.00 H new ATOM 0 HB1 ALA A 67 53.533 -7.339 15.750 1.00 0.00 H new ATOM 0 HB2 ALA A 67 55.107 -7.832 15.082 1.00 0.00 H new ATOM 0 HB3 ALA A 67 53.793 -9.022 15.234 1.00 0.00 H new ATOM 1043 N THR A 68 52.908 -7.925 18.567 1.00 0.00 N ATOM 1044 CA THR A 68 51.806 -8.230 19.463 1.00 0.00 C ATOM 1045 C THR A 68 50.769 -7.107 19.509 1.00 0.00 C ATOM 1046 O THR A 68 50.969 -6.086 20.165 1.00 0.00 O ATOM 1047 CB THR A 68 52.357 -8.453 20.869 1.00 0.00 C ATOM 1048 OG1 THR A 68 53.241 -9.564 20.860 1.00 0.00 O ATOM 1049 CG2 THR A 68 51.203 -8.718 21.829 1.00 0.00 C ATOM 0 H THR A 68 53.101 -6.931 18.440 1.00 0.00 H new ATOM 0 HA THR A 68 51.311 -9.126 19.088 1.00 0.00 H new ATOM 0 HB THR A 68 52.900 -7.566 21.195 1.00 0.00 H new ATOM 0 HG1 THR A 68 53.596 -9.707 21.762 1.00 0.00 H new ATOM 0 HG21 THR A 68 51.595 -8.878 22.834 1.00 0.00 H new ATOM 0 HG22 THR A 68 50.530 -7.861 21.834 1.00 0.00 H new ATOM 0 HG23 THR A 68 50.658 -9.605 21.507 1.00 0.00 H new ATOM 1057 N GLY A 69 49.654 -7.325 18.827 1.00 0.00 N ATOM 1058 CA GLY A 69 48.562 -6.356 18.802 1.00 0.00 C ATOM 1059 C GLY A 69 47.506 -6.756 17.777 1.00 0.00 C ATOM 1060 O GLY A 69 47.647 -7.751 17.077 1.00 0.00 O ATOM 0 H GLY A 69 49.479 -8.168 18.280 1.00 0.00 H new ATOM 0 HA2 GLY A 69 48.108 -6.287 19.791 1.00 0.00 H new ATOM 0 HA3 GLY A 69 48.953 -5.367 18.561 1.00 0.00 H new ATOM 1064 N PRO A 70 46.454 -6.004 17.677 1.00 0.00 N ATOM 1065 CA PRO A 70 45.355 -6.286 16.714 1.00 0.00 C ATOM 1066 C PRO A 70 45.848 -6.766 15.353 1.00 0.00 C ATOM 1067 O PRO A 70 45.369 -7.773 14.832 1.00 0.00 O ATOM 1068 CB PRO A 70 44.670 -4.933 16.592 1.00 0.00 C ATOM 1069 CG PRO A 70 44.813 -4.329 17.948 1.00 0.00 C ATOM 1070 CD PRO A 70 46.175 -4.796 18.475 1.00 0.00 C ATOM 0 HA PRO A 70 44.709 -7.093 17.058 1.00 0.00 H new ATOM 0 HB2 PRO A 70 45.142 -4.315 15.828 1.00 0.00 H new ATOM 0 HB3 PRO A 70 43.622 -5.041 16.312 1.00 0.00 H new ATOM 0 HG2 PRO A 70 44.766 -3.241 17.898 1.00 0.00 H new ATOM 0 HG3 PRO A 70 44.007 -4.653 18.607 1.00 0.00 H new ATOM 0 HD2 PRO A 70 46.943 -4.035 18.334 1.00 0.00 H new ATOM 0 HD3 PRO A 70 46.138 -5.018 19.541 1.00 0.00 H new ATOM 1078 N GLN A 71 46.780 -6.022 14.767 1.00 0.00 N ATOM 1079 CA GLN A 71 47.296 -6.374 13.435 1.00 0.00 C ATOM 1080 C GLN A 71 48.812 -6.619 13.432 1.00 0.00 C ATOM 1081 O GLN A 71 49.516 -6.186 12.520 1.00 0.00 O ATOM 1082 CB GLN A 71 46.950 -5.253 12.450 1.00 0.00 C ATOM 1083 CG GLN A 71 45.475 -5.357 12.045 1.00 0.00 C ATOM 1084 CD GLN A 71 44.968 -3.996 11.578 1.00 0.00 C ATOM 1085 OE1 GLN A 71 44.440 -3.874 10.473 1.00 0.00 O ATOM 1086 NE2 GLN A 71 45.098 -2.960 12.361 1.00 0.00 N ATOM 0 H GLN A 71 47.192 -5.185 15.179 1.00 0.00 H new ATOM 0 HA GLN A 71 46.823 -7.309 13.135 1.00 0.00 H new ATOM 0 HB2 GLN A 71 47.144 -4.282 12.906 1.00 0.00 H new ATOM 0 HB3 GLN A 71 47.585 -5.323 11.567 1.00 0.00 H new ATOM 0 HG2 GLN A 71 45.359 -6.091 11.248 1.00 0.00 H new ATOM 0 HG3 GLN A 71 44.881 -5.706 12.889 1.00 0.00 H new ATOM 0 HE21 GLN A 71 45.536 -3.064 13.276 1.00 0.00 H new ATOM 0 HE22 GLN A 71 44.762 -2.046 12.058 1.00 0.00 H new ATOM 1095 N GLU A 72 49.303 -7.331 14.437 1.00 0.00 N ATOM 1096 CA GLU A 72 50.730 -7.645 14.528 1.00 0.00 C ATOM 1097 C GLU A 72 51.185 -8.483 13.351 1.00 0.00 C ATOM 1098 O GLU A 72 52.293 -8.311 12.849 1.00 0.00 O ATOM 1099 CB GLU A 72 51.001 -8.410 15.832 1.00 0.00 C ATOM 1100 CG GLU A 72 49.757 -9.202 16.221 1.00 0.00 C ATOM 1101 CD GLU A 72 50.126 -10.364 17.131 1.00 0.00 C ATOM 1102 OE1 GLU A 72 51.307 -10.603 17.296 1.00 0.00 O ATOM 1103 OE2 GLU A 72 49.221 -10.997 17.649 1.00 0.00 O ATOM 0 H GLU A 72 48.739 -7.703 15.201 1.00 0.00 H new ATOM 0 HA GLU A 72 51.287 -6.708 14.517 1.00 0.00 H new ATOM 0 HB2 GLU A 72 51.849 -9.083 15.703 1.00 0.00 H new ATOM 0 HB3 GLU A 72 51.266 -7.713 16.627 1.00 0.00 H new ATOM 0 HG2 GLU A 72 49.046 -8.548 16.727 1.00 0.00 H new ATOM 0 HG3 GLU A 72 49.263 -9.577 15.325 1.00 0.00 H new ATOM 1110 N GLU A 73 50.336 -9.388 12.921 1.00 0.00 N ATOM 1111 CA GLU A 73 50.684 -10.249 11.808 1.00 0.00 C ATOM 1112 C GLU A 73 50.994 -9.412 10.578 1.00 0.00 C ATOM 1113 O GLU A 73 52.114 -9.419 10.086 1.00 0.00 O ATOM 1114 CB GLU A 73 49.535 -11.218 11.509 1.00 0.00 C ATOM 1115 CG GLU A 73 49.341 -12.172 12.702 1.00 0.00 C ATOM 1116 CD GLU A 73 49.257 -13.621 12.222 1.00 0.00 C ATOM 1117 OE1 GLU A 73 48.824 -13.831 11.101 1.00 0.00 O ATOM 1118 OE2 GLU A 73 49.623 -14.499 12.986 1.00 0.00 O ATOM 0 H GLU A 73 49.410 -9.548 13.317 1.00 0.00 H new ATOM 0 HA GLU A 73 51.569 -10.826 12.075 1.00 0.00 H new ATOM 0 HB2 GLU A 73 48.616 -10.662 11.322 1.00 0.00 H new ATOM 0 HB3 GLU A 73 49.752 -11.788 10.606 1.00 0.00 H new ATOM 0 HG2 GLU A 73 50.170 -12.062 13.401 1.00 0.00 H new ATOM 0 HG3 GLU A 73 48.431 -11.908 13.242 1.00 0.00 H new ATOM 1125 N GLU A 74 50.007 -8.670 10.103 1.00 0.00 N ATOM 1126 CA GLU A 74 50.206 -7.822 8.933 1.00 0.00 C ATOM 1127 C GLU A 74 51.495 -7.020 9.076 1.00 0.00 C ATOM 1128 O GLU A 74 52.230 -6.814 8.113 1.00 0.00 O ATOM 1129 CB GLU A 74 49.022 -6.863 8.789 1.00 0.00 C ATOM 1130 CG GLU A 74 47.744 -7.548 9.272 1.00 0.00 C ATOM 1131 CD GLU A 74 46.522 -6.784 8.774 1.00 0.00 C ATOM 1132 OE1 GLU A 74 45.752 -7.362 8.025 1.00 0.00 O ATOM 1133 OE2 GLU A 74 46.375 -5.633 9.149 1.00 0.00 O ATOM 0 H GLU A 74 49.069 -8.635 10.502 1.00 0.00 H new ATOM 0 HA GLU A 74 50.278 -8.453 8.047 1.00 0.00 H new ATOM 0 HB2 GLU A 74 49.202 -5.957 9.368 1.00 0.00 H new ATOM 0 HB3 GLU A 74 48.912 -6.559 7.748 1.00 0.00 H new ATOM 0 HG2 GLU A 74 47.713 -8.576 8.910 1.00 0.00 H new ATOM 0 HG3 GLU A 74 47.735 -7.594 10.361 1.00 0.00 H new ATOM 1140 N ALA A 75 51.738 -6.565 10.292 1.00 0.00 N ATOM 1141 CA ALA A 75 52.920 -5.763 10.603 1.00 0.00 C ATOM 1142 C ALA A 75 54.190 -6.589 10.555 1.00 0.00 C ATOM 1143 O ALA A 75 55.091 -6.292 9.785 1.00 0.00 O ATOM 1144 CB ALA A 75 52.758 -5.142 12.004 1.00 0.00 C ATOM 0 H ALA A 75 51.129 -6.737 11.092 1.00 0.00 H new ATOM 0 HA ALA A 75 53.006 -4.980 9.849 1.00 0.00 H new ATOM 0 HB1 ALA A 75 53.637 -4.543 12.240 1.00 0.00 H new ATOM 0 HB2 ALA A 75 51.872 -4.508 12.021 1.00 0.00 H new ATOM 0 HB3 ALA A 75 52.650 -5.936 12.743 1.00 0.00 H new ATOM 1150 N LEU A 76 54.245 -7.617 11.376 1.00 0.00 N ATOM 1151 CA LEU A 76 55.404 -8.495 11.439 1.00 0.00 C ATOM 1152 C LEU A 76 55.487 -9.339 10.176 1.00 0.00 C ATOM 1153 O LEU A 76 56.568 -9.735 9.741 1.00 0.00 O ATOM 1154 CB LEU A 76 55.239 -9.366 12.687 1.00 0.00 C ATOM 1155 CG LEU A 76 55.861 -10.754 12.518 1.00 0.00 C ATOM 1156 CD1 LEU A 76 56.012 -11.374 13.911 1.00 0.00 C ATOM 1157 CD2 LEU A 76 54.952 -11.650 11.653 1.00 0.00 C ATOM 0 H LEU A 76 53.493 -7.870 12.017 1.00 0.00 H new ATOM 0 HA LEU A 76 56.332 -7.927 11.503 1.00 0.00 H new ATOM 0 HB2 LEU A 76 55.700 -8.866 13.539 1.00 0.00 H new ATOM 0 HB3 LEU A 76 54.178 -9.472 12.915 1.00 0.00 H new ATOM 0 HG LEU A 76 56.829 -10.669 12.024 1.00 0.00 H new ATOM 0 HD11 LEU A 76 56.454 -12.366 13.822 1.00 0.00 H new ATOM 0 HD12 LEU A 76 56.657 -10.743 14.522 1.00 0.00 H new ATOM 0 HD13 LEU A 76 55.032 -11.454 14.382 1.00 0.00 H new ATOM 0 HD21 LEU A 76 55.409 -12.633 11.543 1.00 0.00 H new ATOM 0 HD22 LEU A 76 53.979 -11.754 12.134 1.00 0.00 H new ATOM 0 HD23 LEU A 76 54.824 -11.197 10.670 1.00 0.00 H new ATOM 1169 N ALA A 77 54.329 -9.596 9.594 1.00 0.00 N ATOM 1170 CA ALA A 77 54.241 -10.384 8.372 1.00 0.00 C ATOM 1171 C ALA A 77 54.606 -9.532 7.157 1.00 0.00 C ATOM 1172 O ALA A 77 54.995 -10.058 6.114 1.00 0.00 O ATOM 1173 CB ALA A 77 52.811 -10.900 8.208 1.00 0.00 C ATOM 0 H ALA A 77 53.430 -9.269 9.949 1.00 0.00 H new ATOM 0 HA ALA A 77 54.939 -11.219 8.442 1.00 0.00 H new ATOM 0 HB1 ALA A 77 52.740 -11.491 7.295 1.00 0.00 H new ATOM 0 HB2 ALA A 77 52.548 -11.522 9.064 1.00 0.00 H new ATOM 0 HB3 ALA A 77 52.124 -10.056 8.149 1.00 0.00 H new ATOM 1179 N ALA A 78 54.482 -8.215 7.302 1.00 0.00 N ATOM 1180 CA ALA A 78 54.806 -7.306 6.208 1.00 0.00 C ATOM 1181 C ALA A 78 56.313 -7.106 6.151 1.00 0.00 C ATOM 1182 O ALA A 78 56.908 -7.012 5.074 1.00 0.00 O ATOM 1183 CB ALA A 78 54.096 -5.960 6.407 1.00 0.00 C ATOM 0 H ALA A 78 54.163 -7.758 8.156 1.00 0.00 H new ATOM 0 HA ALA A 78 54.464 -7.737 5.267 1.00 0.00 H new ATOM 0 HB1 ALA A 78 54.347 -5.291 5.584 1.00 0.00 H new ATOM 0 HB2 ALA A 78 53.018 -6.118 6.431 1.00 0.00 H new ATOM 0 HB3 ALA A 78 54.419 -5.514 7.348 1.00 0.00 H new ATOM 1189 N VAL A 79 56.927 -7.087 7.326 1.00 0.00 N ATOM 1190 CA VAL A 79 58.367 -6.945 7.417 1.00 0.00 C ATOM 1191 C VAL A 79 58.995 -8.209 6.873 1.00 0.00 C ATOM 1192 O VAL A 79 59.938 -8.170 6.095 1.00 0.00 O ATOM 1193 CB VAL A 79 58.791 -6.755 8.884 1.00 0.00 C ATOM 1194 CG1 VAL A 79 57.570 -6.458 9.736 1.00 0.00 C ATOM 1195 CG2 VAL A 79 59.446 -8.034 9.401 1.00 0.00 C ATOM 0 H VAL A 79 56.450 -7.168 8.224 1.00 0.00 H new ATOM 0 HA VAL A 79 58.692 -6.075 6.847 1.00 0.00 H new ATOM 0 HB VAL A 79 59.496 -5.926 8.942 1.00 0.00 H new ATOM 0 HG11 VAL A 79 57.874 -6.324 10.774 1.00 0.00 H new ATOM 0 HG12 VAL A 79 57.090 -5.547 9.378 1.00 0.00 H new ATOM 0 HG13 VAL A 79 56.868 -7.289 9.668 1.00 0.00 H new ATOM 0 HG21 VAL A 79 59.745 -7.895 10.440 1.00 0.00 H new ATOM 0 HG22 VAL A 79 58.736 -8.859 9.334 1.00 0.00 H new ATOM 0 HG23 VAL A 79 60.325 -8.262 8.798 1.00 0.00 H new ATOM 1205 N ILE A 80 58.448 -9.331 7.316 1.00 0.00 N ATOM 1206 CA ILE A 80 58.927 -10.627 6.906 1.00 0.00 C ATOM 1207 C ILE A 80 59.061 -10.663 5.420 1.00 0.00 C ATOM 1208 O ILE A 80 60.152 -10.843 4.895 1.00 0.00 O ATOM 1209 CB ILE A 80 57.962 -11.677 7.418 1.00 0.00 C ATOM 1210 CG1 ILE A 80 58.259 -11.844 8.912 1.00 0.00 C ATOM 1211 CG2 ILE A 80 58.142 -12.999 6.657 1.00 0.00 C ATOM 1212 CD1 ILE A 80 59.080 -13.102 9.154 1.00 0.00 C ATOM 0 H ILE A 80 57.663 -9.361 7.967 1.00 0.00 H new ATOM 0 HA ILE A 80 59.913 -10.831 7.324 1.00 0.00 H new ATOM 0 HB ILE A 80 56.926 -11.375 7.263 1.00 0.00 H new ATOM 0 HG12 ILE A 80 58.800 -10.973 9.281 1.00 0.00 H new ATOM 0 HG13 ILE A 80 57.325 -11.899 9.471 1.00 0.00 H new ATOM 0 HG21 ILE A 80 57.439 -13.738 7.041 1.00 0.00 H new ATOM 0 HG22 ILE A 80 57.954 -12.836 5.596 1.00 0.00 H new ATOM 0 HG23 ILE A 80 59.161 -13.362 6.794 1.00 0.00 H new ATOM 0 HD11 ILE A 80 59.282 -13.205 10.220 1.00 0.00 H new ATOM 0 HD12 ILE A 80 58.524 -13.972 8.804 1.00 0.00 H new ATOM 0 HD13 ILE A 80 60.023 -13.031 8.611 1.00 0.00 H new ATOM 1224 N ALA A 81 57.972 -10.432 4.733 1.00 0.00 N ATOM 1225 CA ALA A 81 58.049 -10.392 3.297 1.00 0.00 C ATOM 1226 C ALA A 81 59.225 -9.517 2.930 1.00 0.00 C ATOM 1227 O ALA A 81 59.817 -9.657 1.860 1.00 0.00 O ATOM 1228 CB ALA A 81 56.786 -9.797 2.713 1.00 0.00 C ATOM 0 H ALA A 81 57.046 -10.273 5.131 1.00 0.00 H new ATOM 0 HA ALA A 81 58.166 -11.401 2.902 1.00 0.00 H new ATOM 0 HB1 ALA A 81 56.863 -9.775 1.626 1.00 0.00 H new ATOM 0 HB2 ALA A 81 55.929 -10.405 3.004 1.00 0.00 H new ATOM 0 HB3 ALA A 81 56.655 -8.782 3.088 1.00 0.00 H new ATOM 1234 N LEU A 82 59.580 -8.624 3.857 1.00 0.00 N ATOM 1235 CA LEU A 82 60.709 -7.754 3.641 1.00 0.00 C ATOM 1236 C LEU A 82 61.951 -8.402 4.225 1.00 0.00 C ATOM 1237 O LEU A 82 63.026 -8.363 3.625 1.00 0.00 O ATOM 1238 CB LEU A 82 60.449 -6.390 4.279 1.00 0.00 C ATOM 1239 CG LEU A 82 60.917 -5.291 3.325 1.00 0.00 C ATOM 1240 CD1 LEU A 82 62.407 -5.492 3.012 1.00 0.00 C ATOM 1241 CD2 LEU A 82 60.094 -5.350 2.025 1.00 0.00 C ATOM 0 H LEU A 82 59.102 -8.495 4.748 1.00 0.00 H new ATOM 0 HA LEU A 82 60.860 -7.599 2.573 1.00 0.00 H new ATOM 0 HB2 LEU A 82 59.387 -6.273 4.495 1.00 0.00 H new ATOM 0 HB3 LEU A 82 60.978 -6.313 5.229 1.00 0.00 H new ATOM 0 HG LEU A 82 60.775 -4.316 3.791 1.00 0.00 H new ATOM 0 HD11 LEU A 82 62.745 -4.710 2.332 1.00 0.00 H new ATOM 0 HD12 LEU A 82 62.983 -5.443 3.936 1.00 0.00 H new ATOM 0 HD13 LEU A 82 62.553 -6.466 2.546 1.00 0.00 H new ATOM 0 HD21 LEU A 82 60.429 -4.566 1.346 1.00 0.00 H new ATOM 0 HD22 LEU A 82 60.231 -6.322 1.552 1.00 0.00 H new ATOM 0 HD23 LEU A 82 59.039 -5.204 2.255 1.00 0.00 H new ATOM 1253 N PHE A 83 61.789 -9.028 5.387 1.00 0.00 N ATOM 1254 CA PHE A 83 62.900 -9.709 6.011 1.00 0.00 C ATOM 1255 C PHE A 83 63.249 -10.908 5.156 1.00 0.00 C ATOM 1256 O PHE A 83 64.410 -11.293 5.022 1.00 0.00 O ATOM 1257 CB PHE A 83 62.559 -10.142 7.432 1.00 0.00 C ATOM 1258 CG PHE A 83 62.745 -8.995 8.397 1.00 0.00 C ATOM 1259 CD1 PHE A 83 63.058 -9.274 9.730 1.00 0.00 C ATOM 1260 CD2 PHE A 83 62.613 -7.661 7.973 1.00 0.00 C ATOM 1261 CE1 PHE A 83 63.236 -8.235 10.639 1.00 0.00 C ATOM 1262 CE2 PHE A 83 62.795 -6.622 8.889 1.00 0.00 C ATOM 1263 CZ PHE A 83 63.106 -6.914 10.220 1.00 0.00 C ATOM 0 H PHE A 83 60.910 -9.074 5.903 1.00 0.00 H new ATOM 0 HA PHE A 83 63.752 -9.033 6.083 1.00 0.00 H new ATOM 0 HB2 PHE A 83 61.529 -10.495 7.473 1.00 0.00 H new ATOM 0 HB3 PHE A 83 63.194 -10.978 7.725 1.00 0.00 H new ATOM 0 HD1 PHE A 83 63.162 -10.298 10.056 1.00 0.00 H new ATOM 0 HD2 PHE A 83 62.372 -7.440 6.944 1.00 0.00 H new ATOM 0 HE1 PHE A 83 63.475 -8.454 11.669 1.00 0.00 H new ATOM 0 HE2 PHE A 83 62.696 -5.595 8.569 1.00 0.00 H new ATOM 0 HZ PHE A 83 63.246 -6.110 10.927 1.00 0.00 H new ATOM 1273 N ASN A 84 62.212 -11.455 4.540 1.00 0.00 N ATOM 1274 CA ASN A 84 62.354 -12.576 3.641 1.00 0.00 C ATOM 1275 C ASN A 84 62.765 -12.032 2.297 1.00 0.00 C ATOM 1276 O ASN A 84 63.241 -12.744 1.413 1.00 0.00 O ATOM 1277 CB ASN A 84 61.011 -13.297 3.522 1.00 0.00 C ATOM 1278 CG ASN A 84 61.204 -14.810 3.546 1.00 0.00 C ATOM 1279 OD1 ASN A 84 62.029 -15.345 2.805 1.00 0.00 O ATOM 1280 ND2 ASN A 84 60.484 -15.534 4.359 1.00 0.00 N ATOM 0 H ASN A 84 61.252 -11.130 4.653 1.00 0.00 H new ATOM 0 HA ASN A 84 63.100 -13.281 4.009 1.00 0.00 H new ATOM 0 HB2 ASN A 84 60.358 -12.996 4.341 1.00 0.00 H new ATOM 0 HB3 ASN A 84 60.517 -13.004 2.596 1.00 0.00 H new ATOM 0 HD21 ASN A 84 60.604 -16.547 4.382 1.00 0.00 H new ATOM 0 HD22 ASN A 84 59.802 -15.087 4.971 1.00 0.00 H new ATOM 1287 N SER A 85 62.559 -10.741 2.186 1.00 0.00 N ATOM 1288 CA SER A 85 62.886 -10.009 0.968 1.00 0.00 C ATOM 1289 C SER A 85 62.036 -10.503 -0.198 1.00 0.00 C ATOM 1290 O SER A 85 61.267 -9.713 -0.722 1.00 0.00 O ATOM 1291 CB SER A 85 64.367 -10.186 0.633 1.00 0.00 C ATOM 1292 OG SER A 85 64.763 -9.184 -0.294 1.00 0.00 O ATOM 1293 OXT SER A 85 62.164 -11.664 -0.549 1.00 0.00 O ATOM 0 H SER A 85 62.163 -10.164 2.928 1.00 0.00 H new ATOM 0 HA SER A 85 62.676 -8.952 1.134 1.00 0.00 H new ATOM 0 HB2 SER A 85 64.967 -10.116 1.540 1.00 0.00 H new ATOM 0 HB3 SER A 85 64.540 -11.176 0.212 1.00 0.00 H new ATOM 0 HG SER A 85 65.713 -9.294 -0.509 1.00 0.00 H new TER 1299 SER A 85