USER MOD reduce.3.24.130724 H: found=0, std=0, add=654, rem=0, adj=13 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+ 145:sc= 0.0455 (180deg=0) USER MOD Single : A 2 THR OG1 : rot 163:sc= 0.0087 USER MOD Single : A 4 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 5 GLN : amide:sc= -6.62! K(o=-6.6!,f=-2) USER MOD Single : A 6 THR OG1 : rot 180:sc= 0.0728 USER MOD Single : A 10 THR OG1 : rot 180:sc= 0 USER MOD Single : A 11 ASN : amide:sc= -2.44! C(o=-2.4!,f=-2.9!) USER MOD Single : A 12 LYS NZ :NH3+ 139:sc= -0.134 (180deg=-0.953) USER MOD Single : A 15 MET CE :methyl -150:sc= -0.279 (180deg=-1.6!) USER MOD Single : A 16 HIS : no HD1:sc= -5.45! C(o=-5.4!,f=-9.7!) USER MOD Single : A 21 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 22 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 27 MET CE :methyl -117:sc= -0.0593 (180deg=-0.49) USER MOD Single : A 28 GLN : amide:sc= -0.144 K(o=-0.14,f=-1) USER MOD Single : A 38 ASN : amide:sc= -0.808 K(o=-0.81,f=-5.4!) USER MOD Single : A 42 THR OG1 : rot 180:sc= 0 USER MOD Single : A 47 ASN : amide:sc= -3.62! C(o=-3.6!,f=-2.9!) USER MOD Single : A 48 SER OG : rot 180:sc= 0 USER MOD Single : A 54 MET CE :methyl -114:sc= 0 (180deg=-0.0431) USER MOD Single : A 57 SER OG : rot 180:sc= 0 USER MOD Single : A 59 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 62 GLN : amide:sc= -0.027 K(o=-0.027,f=-1.4!) USER MOD Single : A 68 THR OG1 : rot 165:sc= -4.48! USER MOD Single : A 71 GLN : amide:sc= 0 K(o=0,f=-0.83) USER MOD Single : A 84 ASN : amide:sc= -1.04 K(o=-1,f=-3.1!) USER MOD Single : A 85 SER OG : rot -43:sc= 0.964 USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 47.299 -13.384 17.383 1.00 0.00 N ATOM 2 CA MET A 1 48.609 -14.086 17.491 1.00 0.00 C ATOM 3 C MET A 1 49.715 -13.177 16.966 1.00 0.00 C ATOM 4 O MET A 1 49.475 -12.011 16.652 1.00 0.00 O ATOM 5 CB MET A 1 48.562 -15.377 16.673 1.00 0.00 C ATOM 6 CG MET A 1 48.452 -16.577 17.617 1.00 0.00 C ATOM 7 SD MET A 1 48.343 -18.101 16.647 1.00 0.00 S ATOM 8 CE MET A 1 48.445 -19.259 18.033 1.00 0.00 C ATOM 0 H1 MET A 1 46.554 -14.073 17.155 1.00 0.00 H new ATOM 0 H2 MET A 1 47.078 -12.921 18.287 1.00 0.00 H new ATOM 0 H3 MET A 1 47.350 -12.668 16.631 1.00 0.00 H new ATOM 0 HA MET A 1 48.811 -14.330 18.534 1.00 0.00 H new ATOM 0 HB2 MET A 1 47.711 -15.358 15.992 1.00 0.00 H new ATOM 0 HB3 MET A 1 49.459 -15.464 16.060 1.00 0.00 H new ATOM 0 HG2 MET A 1 49.319 -16.615 18.277 1.00 0.00 H new ATOM 0 HG3 MET A 1 47.572 -16.474 18.252 1.00 0.00 H new ATOM 0 HE1 MET A 1 48.396 -20.281 17.658 1.00 0.00 H new ATOM 0 HE2 MET A 1 49.387 -19.112 18.562 1.00 0.00 H new ATOM 0 HE3 MET A 1 47.614 -19.083 18.716 1.00 0.00 H new ATOM 20 N THR A 2 50.925 -13.718 16.873 1.00 0.00 N ATOM 21 CA THR A 2 52.061 -12.945 16.384 1.00 0.00 C ATOM 22 C THR A 2 52.923 -13.790 15.453 1.00 0.00 C ATOM 23 O THR A 2 52.877 -15.019 15.493 1.00 0.00 O ATOM 24 CB THR A 2 52.907 -12.458 17.563 1.00 0.00 C ATOM 25 OG1 THR A 2 53.401 -13.577 18.285 1.00 0.00 O ATOM 26 CG2 THR A 2 52.049 -11.590 18.486 1.00 0.00 C ATOM 0 H THR A 2 51.144 -14.681 17.128 1.00 0.00 H new ATOM 0 HA THR A 2 51.681 -12.087 15.830 1.00 0.00 H new ATOM 0 HB THR A 2 53.745 -11.869 17.190 1.00 0.00 H new ATOM 0 HG1 THR A 2 54.141 -13.293 18.862 1.00 0.00 H new ATOM 0 HG21 THR A 2 52.653 -11.244 19.325 1.00 0.00 H new ATOM 0 HG22 THR A 2 51.672 -10.731 17.931 1.00 0.00 H new ATOM 0 HG23 THR A 2 51.210 -12.176 18.860 1.00 0.00 H new ATOM 34 N VAL A 3 53.707 -13.122 14.612 1.00 0.00 N ATOM 35 CA VAL A 3 54.576 -13.823 13.673 1.00 0.00 C ATOM 36 C VAL A 3 56.000 -13.284 13.759 1.00 0.00 C ATOM 37 O VAL A 3 56.250 -12.113 13.472 1.00 0.00 O ATOM 38 CB VAL A 3 54.048 -13.652 12.247 1.00 0.00 C ATOM 39 CG1 VAL A 3 54.976 -14.376 11.270 1.00 0.00 C ATOM 40 CG2 VAL A 3 52.642 -14.249 12.151 1.00 0.00 C ATOM 0 H VAL A 3 53.759 -12.105 14.561 1.00 0.00 H new ATOM 0 HA VAL A 3 54.584 -14.882 13.933 1.00 0.00 H new ATOM 0 HB VAL A 3 54.012 -12.592 11.996 1.00 0.00 H new ATOM 0 HG11 VAL A 3 54.601 -14.255 10.254 1.00 0.00 H new ATOM 0 HG12 VAL A 3 55.978 -13.954 11.339 1.00 0.00 H new ATOM 0 HG13 VAL A 3 55.011 -15.436 11.520 1.00 0.00 H new ATOM 0 HG21 VAL A 3 52.264 -14.128 11.136 1.00 0.00 H new ATOM 0 HG22 VAL A 3 52.679 -15.309 12.401 1.00 0.00 H new ATOM 0 HG23 VAL A 3 51.980 -13.735 12.848 1.00 0.00 H new ATOM 50 N LYS A 4 56.930 -14.146 14.155 1.00 0.00 N ATOM 51 CA LYS A 4 58.328 -13.747 14.274 1.00 0.00 C ATOM 52 C LYS A 4 59.225 -14.683 13.472 1.00 0.00 C ATOM 53 O LYS A 4 58.758 -15.673 12.907 1.00 0.00 O ATOM 54 CB LYS A 4 58.752 -13.766 15.744 1.00 0.00 C ATOM 55 CG LYS A 4 58.451 -15.141 16.344 1.00 0.00 C ATOM 56 CD LYS A 4 58.629 -15.086 17.863 1.00 0.00 C ATOM 57 CE LYS A 4 58.331 -16.462 18.462 1.00 0.00 C ATOM 58 NZ LYS A 4 58.558 -16.422 19.934 1.00 0.00 N ATOM 0 H LYS A 4 56.744 -15.119 14.398 1.00 0.00 H new ATOM 0 HA LYS A 4 58.432 -12.737 13.878 1.00 0.00 H new ATOM 0 HB2 LYS A 4 59.816 -13.545 15.830 1.00 0.00 H new ATOM 0 HB3 LYS A 4 58.220 -12.992 16.297 1.00 0.00 H new ATOM 0 HG2 LYS A 4 57.433 -15.442 16.097 1.00 0.00 H new ATOM 0 HG3 LYS A 4 59.117 -15.890 15.916 1.00 0.00 H new ATOM 0 HD2 LYS A 4 59.646 -14.783 18.110 1.00 0.00 H new ATOM 0 HD3 LYS A 4 57.961 -14.339 18.291 1.00 0.00 H new ATOM 0 HE2 LYS A 4 57.301 -16.748 18.250 1.00 0.00 H new ATOM 0 HE3 LYS A 4 58.972 -17.216 18.005 1.00 0.00 H new ATOM 0 HZ1 LYS A 4 58.356 -17.357 20.342 1.00 0.00 H new ATOM 0 HZ2 LYS A 4 59.548 -16.167 20.126 1.00 0.00 H new ATOM 0 HZ3 LYS A 4 57.929 -15.714 20.363 1.00 0.00 H new ATOM 72 N GLN A 5 60.514 -14.363 13.425 1.00 0.00 N ATOM 73 CA GLN A 5 61.467 -15.184 12.687 1.00 0.00 C ATOM 74 C GLN A 5 62.897 -14.760 13.009 1.00 0.00 C ATOM 75 O GLN A 5 63.210 -13.570 13.044 1.00 0.00 O ATOM 76 CB GLN A 5 61.219 -15.050 11.184 1.00 0.00 C ATOM 77 CG GLN A 5 62.427 -15.592 10.416 1.00 0.00 C ATOM 78 CD GLN A 5 62.080 -15.744 8.939 1.00 0.00 C ATOM 79 OE1 GLN A 5 62.867 -16.294 8.169 1.00 0.00 O ATOM 80 NE2 GLN A 5 60.941 -15.285 8.495 1.00 0.00 N ATOM 0 H GLN A 5 60.920 -13.548 13.885 1.00 0.00 H new ATOM 0 HA GLN A 5 61.331 -16.224 12.985 1.00 0.00 H new ATOM 0 HB2 GLN A 5 60.320 -15.599 10.903 1.00 0.00 H new ATOM 0 HB3 GLN A 5 61.049 -14.005 10.925 1.00 0.00 H new ATOM 0 HG2 GLN A 5 63.275 -14.917 10.531 1.00 0.00 H new ATOM 0 HG3 GLN A 5 62.728 -16.555 10.828 1.00 0.00 H new ATOM 0 HE21 GLN A 5 60.290 -14.830 9.135 1.00 0.00 H new ATOM 0 HE22 GLN A 5 60.702 -15.382 7.508 1.00 0.00 H new ATOM 89 N THR A 6 63.762 -15.742 13.244 1.00 0.00 N ATOM 90 CA THR A 6 65.157 -15.458 13.563 1.00 0.00 C ATOM 91 C THR A 6 65.947 -15.155 12.294 1.00 0.00 C ATOM 92 O THR A 6 65.884 -15.903 11.319 1.00 0.00 O ATOM 93 CB THR A 6 65.783 -16.657 14.281 1.00 0.00 C ATOM 94 OG1 THR A 6 64.771 -17.610 14.575 1.00 0.00 O ATOM 95 CG2 THR A 6 66.439 -16.188 15.581 1.00 0.00 C ATOM 0 H THR A 6 63.524 -16.734 13.220 1.00 0.00 H new ATOM 0 HA THR A 6 65.190 -14.585 14.215 1.00 0.00 H new ATOM 0 HB THR A 6 66.537 -17.113 13.640 1.00 0.00 H new ATOM 0 HG1 THR A 6 65.169 -18.379 15.033 1.00 0.00 H new ATOM 0 HG21 THR A 6 66.885 -17.041 16.092 1.00 0.00 H new ATOM 0 HG22 THR A 6 67.214 -15.456 15.354 1.00 0.00 H new ATOM 0 HG23 THR A 6 65.686 -15.732 16.224 1.00 0.00 H new ATOM 103 N VAL A 7 66.688 -14.053 12.314 1.00 0.00 N ATOM 104 CA VAL A 7 67.487 -13.659 11.160 1.00 0.00 C ATOM 105 C VAL A 7 68.890 -13.246 11.595 1.00 0.00 C ATOM 106 O VAL A 7 69.054 -12.424 12.497 1.00 0.00 O ATOM 107 CB VAL A 7 66.814 -12.494 10.431 1.00 0.00 C ATOM 108 CG1 VAL A 7 67.731 -11.993 9.315 1.00 0.00 C ATOM 109 CG2 VAL A 7 65.490 -12.969 9.829 1.00 0.00 C ATOM 0 H VAL A 7 66.752 -13.420 13.111 1.00 0.00 H new ATOM 0 HA VAL A 7 67.564 -14.513 10.487 1.00 0.00 H new ATOM 0 HB VAL A 7 66.624 -11.684 11.135 1.00 0.00 H new ATOM 0 HG11 VAL A 7 67.252 -11.163 8.795 1.00 0.00 H new ATOM 0 HG12 VAL A 7 68.675 -11.656 9.743 1.00 0.00 H new ATOM 0 HG13 VAL A 7 67.921 -12.802 8.609 1.00 0.00 H new ATOM 0 HG21 VAL A 7 65.009 -12.141 9.309 1.00 0.00 H new ATOM 0 HG22 VAL A 7 65.680 -13.778 9.124 1.00 0.00 H new ATOM 0 HG23 VAL A 7 64.836 -13.327 10.624 1.00 0.00 H new ATOM 119 N GLU A 8 69.899 -13.822 10.948 1.00 0.00 N ATOM 120 CA GLU A 8 71.284 -13.505 11.278 1.00 0.00 C ATOM 121 C GLU A 8 71.631 -12.089 10.829 1.00 0.00 C ATOM 122 O GLU A 8 71.412 -11.723 9.674 1.00 0.00 O ATOM 123 CB GLU A 8 72.223 -14.503 10.600 1.00 0.00 C ATOM 124 CG GLU A 8 72.013 -15.894 11.202 1.00 0.00 C ATOM 125 CD GLU A 8 72.674 -16.949 10.323 1.00 0.00 C ATOM 126 OE1 GLU A 8 73.068 -16.610 9.219 1.00 0.00 O ATOM 127 OE2 GLU A 8 72.777 -18.081 10.765 1.00 0.00 O ATOM 0 H GLU A 8 69.785 -14.505 10.199 1.00 0.00 H new ATOM 0 HA GLU A 8 71.405 -13.570 12.359 1.00 0.00 H new ATOM 0 HB2 GLU A 8 72.032 -14.527 9.527 1.00 0.00 H new ATOM 0 HB3 GLU A 8 73.259 -14.191 10.732 1.00 0.00 H new ATOM 0 HG2 GLU A 8 72.433 -15.931 12.207 1.00 0.00 H new ATOM 0 HG3 GLU A 8 70.947 -16.102 11.294 1.00 0.00 H new ATOM 134 N ILE A 9 72.172 -11.298 11.750 1.00 0.00 N ATOM 135 CA ILE A 9 72.545 -9.923 11.437 1.00 0.00 C ATOM 136 C ILE A 9 73.883 -9.882 10.707 1.00 0.00 C ATOM 137 O ILE A 9 74.911 -10.278 11.254 1.00 0.00 O ATOM 138 CB ILE A 9 72.637 -9.103 12.724 1.00 0.00 C ATOM 139 CG1 ILE A 9 71.234 -8.669 13.154 1.00 0.00 C ATOM 140 CG2 ILE A 9 73.500 -7.862 12.478 1.00 0.00 C ATOM 141 CD1 ILE A 9 70.720 -7.586 12.205 1.00 0.00 C ATOM 0 H ILE A 9 72.361 -11.582 12.711 1.00 0.00 H new ATOM 0 HA ILE A 9 71.779 -9.497 10.789 1.00 0.00 H new ATOM 0 HB ILE A 9 73.087 -9.710 13.509 1.00 0.00 H new ATOM 0 HG12 ILE A 9 70.559 -9.525 13.146 1.00 0.00 H new ATOM 0 HG13 ILE A 9 71.256 -8.291 14.176 1.00 0.00 H new ATOM 0 HG21 ILE A 9 73.566 -7.277 13.395 1.00 0.00 H new ATOM 0 HG22 ILE A 9 74.500 -8.169 12.171 1.00 0.00 H new ATOM 0 HG23 ILE A 9 73.049 -7.255 11.692 1.00 0.00 H new ATOM 0 HD11 ILE A 9 69.721 -7.278 12.512 1.00 0.00 H new ATOM 0 HD12 ILE A 9 71.390 -6.727 12.236 1.00 0.00 H new ATOM 0 HD13 ILE A 9 70.682 -7.980 11.189 1.00 0.00 H new ATOM 153 N THR A 10 73.861 -9.399 9.468 1.00 0.00 N ATOM 154 CA THR A 10 75.079 -9.310 8.671 1.00 0.00 C ATOM 155 C THR A 10 75.223 -7.916 8.071 1.00 0.00 C ATOM 156 O THR A 10 74.513 -7.560 7.129 1.00 0.00 O ATOM 157 CB THR A 10 75.050 -10.351 7.551 1.00 0.00 C ATOM 158 OG1 THR A 10 75.066 -11.655 8.117 1.00 0.00 O ATOM 159 CG2 THR A 10 76.271 -10.169 6.650 1.00 0.00 C ATOM 0 H THR A 10 73.020 -9.066 8.997 1.00 0.00 H new ATOM 0 HA THR A 10 75.932 -9.504 9.321 1.00 0.00 H new ATOM 0 HB THR A 10 74.143 -10.223 6.960 1.00 0.00 H new ATOM 0 HG1 THR A 10 75.046 -12.323 7.400 1.00 0.00 H new ATOM 0 HG21 THR A 10 76.249 -10.912 5.853 1.00 0.00 H new ATOM 0 HG22 THR A 10 76.257 -9.169 6.216 1.00 0.00 H new ATOM 0 HG23 THR A 10 77.180 -10.296 7.239 1.00 0.00 H new ATOM 167 N ASN A 11 76.142 -7.130 8.621 1.00 0.00 N ATOM 168 CA ASN A 11 76.367 -5.776 8.131 1.00 0.00 C ATOM 169 C ASN A 11 75.402 -4.800 8.797 1.00 0.00 C ATOM 170 O ASN A 11 75.063 -3.761 8.229 1.00 0.00 O ATOM 171 CB ASN A 11 76.176 -5.730 6.614 1.00 0.00 C ATOM 172 CG ASN A 11 76.518 -4.340 6.087 1.00 0.00 C ATOM 173 OD1 ASN A 11 77.451 -3.703 6.574 1.00 0.00 O ATOM 174 ND2 ASN A 11 75.812 -3.830 5.114 1.00 0.00 N ATOM 0 H ASN A 11 76.739 -7.405 9.401 1.00 0.00 H new ATOM 0 HA ASN A 11 77.389 -5.486 8.376 1.00 0.00 H new ATOM 0 HB2 ASN A 11 76.812 -6.476 6.136 1.00 0.00 H new ATOM 0 HB3 ASN A 11 75.146 -5.980 6.361 1.00 0.00 H new ATOM 0 HD21 ASN A 11 76.034 -2.901 4.756 1.00 0.00 H new ATOM 0 HD22 ASN A 11 75.039 -4.361 4.712 1.00 0.00 H new ATOM 181 N LYS A 12 74.962 -5.142 10.003 1.00 0.00 N ATOM 182 CA LYS A 12 74.034 -4.290 10.737 1.00 0.00 C ATOM 183 C LYS A 12 72.596 -4.582 10.320 1.00 0.00 C ATOM 184 O LYS A 12 72.285 -5.680 9.859 1.00 0.00 O ATOM 185 CB LYS A 12 74.356 -2.817 10.474 1.00 0.00 C ATOM 186 CG LYS A 12 75.794 -2.523 10.906 1.00 0.00 C ATOM 187 CD LYS A 12 76.043 -1.015 10.862 1.00 0.00 C ATOM 188 CE LYS A 12 77.522 -0.733 11.136 1.00 0.00 C ATOM 189 NZ LYS A 12 78.356 -1.411 10.106 1.00 0.00 N ATOM 0 H LYS A 12 75.231 -5.997 10.490 1.00 0.00 H new ATOM 0 HA LYS A 12 74.141 -4.499 11.801 1.00 0.00 H new ATOM 0 HB2 LYS A 12 74.230 -2.590 9.416 1.00 0.00 H new ATOM 0 HB3 LYS A 12 73.663 -2.179 11.022 1.00 0.00 H new ATOM 0 HG2 LYS A 12 75.967 -2.901 11.914 1.00 0.00 H new ATOM 0 HG3 LYS A 12 76.495 -3.037 10.248 1.00 0.00 H new ATOM 0 HD2 LYS A 12 75.761 -0.617 9.887 1.00 0.00 H new ATOM 0 HD3 LYS A 12 75.423 -0.512 11.603 1.00 0.00 H new ATOM 0 HE2 LYS A 12 77.707 0.341 11.120 1.00 0.00 H new ATOM 0 HE3 LYS A 12 77.793 -1.088 12.130 1.00 0.00 H new ATOM 0 HZ1 LYS A 12 79.131 -0.781 9.817 1.00 0.00 H new ATOM 0 HZ2 LYS A 12 78.752 -2.287 10.502 1.00 0.00 H new ATOM 0 HZ3 LYS A 12 77.768 -1.639 9.279 1.00 0.00 H new ATOM 203 N LEU A 13 71.724 -3.592 10.484 1.00 0.00 N ATOM 204 CA LEU A 13 70.323 -3.756 10.119 1.00 0.00 C ATOM 205 C LEU A 13 70.197 -4.290 8.696 1.00 0.00 C ATOM 206 O LEU A 13 69.132 -4.751 8.287 1.00 0.00 O ATOM 207 CB LEU A 13 69.593 -2.416 10.229 1.00 0.00 C ATOM 208 CG LEU A 13 68.787 -2.377 11.528 1.00 0.00 C ATOM 209 CD1 LEU A 13 67.683 -3.435 11.475 1.00 0.00 C ATOM 210 CD2 LEU A 13 69.714 -2.667 12.710 1.00 0.00 C ATOM 0 H LEU A 13 71.961 -2.676 10.864 1.00 0.00 H new ATOM 0 HA LEU A 13 69.872 -4.473 10.805 1.00 0.00 H new ATOM 0 HB2 LEU A 13 70.311 -1.596 10.210 1.00 0.00 H new ATOM 0 HB3 LEU A 13 68.931 -2.280 9.374 1.00 0.00 H new ATOM 0 HG LEU A 13 68.339 -1.391 11.649 1.00 0.00 H new ATOM 0 HD11 LEU A 13 67.108 -3.408 12.401 1.00 0.00 H new ATOM 0 HD12 LEU A 13 67.023 -3.230 10.632 1.00 0.00 H new ATOM 0 HD13 LEU A 13 68.130 -4.422 11.355 1.00 0.00 H new ATOM 0 HD21 LEU A 13 69.141 -2.640 13.637 1.00 0.00 H new ATOM 0 HD22 LEU A 13 70.161 -3.654 12.589 1.00 0.00 H new ATOM 0 HD23 LEU A 13 70.502 -1.914 12.748 1.00 0.00 H new ATOM 222 N GLY A 14 71.293 -4.227 7.948 1.00 0.00 N ATOM 223 CA GLY A 14 71.296 -4.708 6.570 1.00 0.00 C ATOM 224 C GLY A 14 72.223 -3.867 5.701 1.00 0.00 C ATOM 225 O GLY A 14 73.446 -3.970 5.799 1.00 0.00 O ATOM 0 H GLY A 14 72.185 -3.851 8.269 1.00 0.00 H new ATOM 0 HA2 GLY A 14 71.615 -5.750 6.545 1.00 0.00 H new ATOM 0 HA3 GLY A 14 70.284 -4.674 6.167 1.00 0.00 H new ATOM 229 N MET A 15 71.634 -3.032 4.850 1.00 0.00 N ATOM 230 CA MET A 15 72.418 -2.176 3.968 1.00 0.00 C ATOM 231 C MET A 15 73.232 -1.173 4.779 1.00 0.00 C ATOM 232 O MET A 15 74.356 -0.830 4.413 1.00 0.00 O ATOM 233 CB MET A 15 71.492 -1.427 3.007 1.00 0.00 C ATOM 234 CG MET A 15 72.328 -0.585 2.043 1.00 0.00 C ATOM 235 SD MET A 15 71.231 0.293 0.903 1.00 0.00 S ATOM 236 CE MET A 15 70.554 -1.164 0.071 1.00 0.00 C ATOM 0 H MET A 15 70.624 -2.931 4.753 1.00 0.00 H new ATOM 0 HA MET A 15 73.102 -2.804 3.397 1.00 0.00 H new ATOM 0 HB2 MET A 15 70.879 -2.136 2.450 1.00 0.00 H new ATOM 0 HB3 MET A 15 70.810 -0.787 3.567 1.00 0.00 H new ATOM 0 HG2 MET A 15 72.937 0.127 2.600 1.00 0.00 H new ATOM 0 HG3 MET A 15 73.013 -1.224 1.486 1.00 0.00 H new ATOM 0 HE1 MET A 15 70.295 -0.909 -0.956 1.00 0.00 H new ATOM 0 HE2 MET A 15 71.298 -1.961 0.070 1.00 0.00 H new ATOM 0 HE3 MET A 15 69.661 -1.502 0.597 1.00 0.00 H new ATOM 246 N HIS A 16 72.656 -0.706 5.881 1.00 0.00 N ATOM 247 CA HIS A 16 73.337 0.259 6.737 1.00 0.00 C ATOM 248 C HIS A 16 72.425 0.700 7.878 1.00 0.00 C ATOM 249 O HIS A 16 72.572 0.247 9.013 1.00 0.00 O ATOM 250 CB HIS A 16 73.759 1.479 5.918 1.00 0.00 C ATOM 251 CG HIS A 16 74.150 2.597 6.845 1.00 0.00 C ATOM 252 ND1 HIS A 16 73.230 3.518 7.321 1.00 0.00 N ATOM 253 CD2 HIS A 16 75.357 2.953 7.395 1.00 0.00 C ATOM 254 CE1 HIS A 16 73.892 4.377 8.118 1.00 0.00 C ATOM 255 NE2 HIS A 16 75.191 4.077 8.199 1.00 0.00 N ATOM 0 H HIS A 16 71.726 -0.977 6.201 1.00 0.00 H new ATOM 0 HA HIS A 16 74.222 -0.219 7.158 1.00 0.00 H new ATOM 0 HB2 HIS A 16 74.596 1.222 5.268 1.00 0.00 H new ATOM 0 HB3 HIS A 16 72.940 1.797 5.273 1.00 0.00 H new ATOM 0 HD2 HIS A 16 76.292 2.439 7.229 1.00 0.00 H new ATOM 0 HE1 HIS A 16 73.429 5.208 8.630 1.00 0.00 H new ATOM 0 HE2 HIS A 16 75.908 4.567 8.735 1.00 0.00 H new ATOM 263 N ALA A 17 71.484 1.586 7.567 1.00 0.00 N ATOM 264 CA ALA A 17 70.554 2.082 8.575 1.00 0.00 C ATOM 265 C ALA A 17 69.194 2.377 7.949 1.00 0.00 C ATOM 266 O ALA A 17 68.218 2.631 8.654 1.00 0.00 O ATOM 267 CB ALA A 17 71.110 3.353 9.219 1.00 0.00 C ATOM 0 H ALA A 17 71.346 1.972 6.633 1.00 0.00 H new ATOM 0 HA ALA A 17 70.431 1.314 9.339 1.00 0.00 H new ATOM 0 HB1 ALA A 17 70.409 3.717 9.970 1.00 0.00 H new ATOM 0 HB2 ALA A 17 72.067 3.133 9.692 1.00 0.00 H new ATOM 0 HB3 ALA A 17 71.251 4.117 8.454 1.00 0.00 H new ATOM 273 N ARG A 18 69.140 2.343 6.622 1.00 0.00 N ATOM 274 CA ARG A 18 67.895 2.610 5.911 1.00 0.00 C ATOM 275 C ARG A 18 66.808 1.633 6.350 1.00 0.00 C ATOM 276 O ARG A 18 65.687 2.034 6.665 1.00 0.00 O ATOM 277 CB ARG A 18 68.115 2.485 4.402 1.00 0.00 C ATOM 278 CG ARG A 18 67.967 3.862 3.750 1.00 0.00 C ATOM 279 CD ARG A 18 68.442 3.792 2.298 1.00 0.00 C ATOM 280 NE ARG A 18 69.869 3.497 2.248 1.00 0.00 N ATOM 281 CZ ARG A 18 70.499 3.352 1.087 1.00 0.00 C ATOM 282 NH1 ARG A 18 71.778 3.088 1.067 1.00 0.00 N ATOM 283 NH2 ARG A 18 69.841 3.473 -0.034 1.00 0.00 N ATOM 0 H ARG A 18 69.937 2.135 6.021 1.00 0.00 H new ATOM 0 HA ARG A 18 67.575 3.625 6.148 1.00 0.00 H new ATOM 0 HB2 ARG A 18 69.107 2.080 4.200 1.00 0.00 H new ATOM 0 HB3 ARG A 18 67.393 1.789 3.975 1.00 0.00 H new ATOM 0 HG2 ARG A 18 66.926 4.184 3.788 1.00 0.00 H new ATOM 0 HG3 ARG A 18 68.550 4.601 4.299 1.00 0.00 H new ATOM 0 HD2 ARG A 18 67.885 3.023 1.762 1.00 0.00 H new ATOM 0 HD3 ARG A 18 68.241 4.739 1.796 1.00 0.00 H new ATOM 0 HE ARG A 18 70.392 3.400 3.118 1.00 0.00 H new ATOM 0 HH11 ARG A 18 72.293 2.993 1.942 1.00 0.00 H new ATOM 0 HH12 ARG A 18 72.262 2.977 0.176 1.00 0.00 H new ATOM 0 HH21 ARG A 18 68.842 3.679 -0.019 1.00 0.00 H new ATOM 0 HH22 ARG A 18 70.326 3.361 -0.924 1.00 0.00 H new ATOM 297 N PRO A 19 67.124 0.367 6.376 1.00 0.00 N ATOM 298 CA PRO A 19 66.164 -0.698 6.784 1.00 0.00 C ATOM 299 C PRO A 19 65.433 -0.345 8.076 1.00 0.00 C ATOM 300 O PRO A 19 64.202 -0.343 8.124 1.00 0.00 O ATOM 301 CB PRO A 19 67.049 -1.930 6.975 1.00 0.00 C ATOM 302 CG PRO A 19 68.243 -1.701 6.108 1.00 0.00 C ATOM 303 CD PRO A 19 68.438 -0.187 6.014 1.00 0.00 C ATOM 0 HA PRO A 19 65.377 -0.846 6.045 1.00 0.00 H new ATOM 0 HB2 PRO A 19 67.339 -2.047 8.019 1.00 0.00 H new ATOM 0 HB3 PRO A 19 66.523 -2.840 6.686 1.00 0.00 H new ATOM 0 HG2 PRO A 19 69.126 -2.179 6.532 1.00 0.00 H new ATOM 0 HG3 PRO A 19 68.091 -2.133 5.119 1.00 0.00 H new ATOM 0 HD2 PRO A 19 69.217 0.158 6.694 1.00 0.00 H new ATOM 0 HD3 PRO A 19 68.735 0.115 5.010 1.00 0.00 H new ATOM 311 N ALA A 20 66.198 -0.047 9.121 1.00 0.00 N ATOM 312 CA ALA A 20 65.611 0.306 10.409 1.00 0.00 C ATOM 313 C ALA A 20 64.751 1.559 10.278 1.00 0.00 C ATOM 314 O ALA A 20 63.621 1.601 10.767 1.00 0.00 O ATOM 315 CB ALA A 20 66.718 0.548 11.438 1.00 0.00 C ATOM 0 H ALA A 20 67.218 -0.043 9.103 1.00 0.00 H new ATOM 0 HA ALA A 20 64.982 -0.520 10.741 1.00 0.00 H new ATOM 0 HB1 ALA A 20 66.272 0.811 12.397 1.00 0.00 H new ATOM 0 HB2 ALA A 20 67.314 -0.358 11.551 1.00 0.00 H new ATOM 0 HB3 ALA A 20 67.358 1.363 11.099 1.00 0.00 H new ATOM 321 N MET A 21 65.294 2.576 9.617 1.00 0.00 N ATOM 322 CA MET A 21 64.566 3.826 9.428 1.00 0.00 C ATOM 323 C MET A 21 63.319 3.596 8.581 1.00 0.00 C ATOM 324 O MET A 21 62.258 4.159 8.853 1.00 0.00 O ATOM 325 CB MET A 21 65.467 4.856 8.742 1.00 0.00 C ATOM 326 CG MET A 21 66.501 5.376 9.742 1.00 0.00 C ATOM 327 SD MET A 21 67.484 6.682 8.967 1.00 0.00 S ATOM 328 CE MET A 21 68.478 7.110 10.418 1.00 0.00 C ATOM 0 H MET A 21 66.228 2.561 9.206 1.00 0.00 H new ATOM 0 HA MET A 21 64.264 4.201 10.406 1.00 0.00 H new ATOM 0 HB2 MET A 21 65.968 4.404 7.886 1.00 0.00 H new ATOM 0 HB3 MET A 21 64.867 5.682 8.360 1.00 0.00 H new ATOM 0 HG2 MET A 21 66.002 5.761 10.631 1.00 0.00 H new ATOM 0 HG3 MET A 21 67.149 4.562 10.068 1.00 0.00 H new ATOM 0 HE1 MET A 21 69.169 7.913 10.162 1.00 0.00 H new ATOM 0 HE2 MET A 21 67.822 7.439 11.224 1.00 0.00 H new ATOM 0 HE3 MET A 21 69.042 6.236 10.743 1.00 0.00 H new ATOM 338 N LYS A 22 63.452 2.764 7.552 1.00 0.00 N ATOM 339 CA LYS A 22 62.330 2.466 6.672 1.00 0.00 C ATOM 340 C LYS A 22 61.216 1.764 7.442 1.00 0.00 C ATOM 341 O LYS A 22 60.033 2.004 7.200 1.00 0.00 O ATOM 342 CB LYS A 22 62.793 1.577 5.516 1.00 0.00 C ATOM 343 CG LYS A 22 63.514 2.431 4.472 1.00 0.00 C ATOM 344 CD LYS A 22 63.800 1.586 3.229 1.00 0.00 C ATOM 345 CE LYS A 22 64.604 2.411 2.223 1.00 0.00 C ATOM 346 NZ LYS A 22 64.968 1.558 1.057 1.00 0.00 N ATOM 0 H LYS A 22 64.321 2.288 7.309 1.00 0.00 H new ATOM 0 HA LYS A 22 61.945 3.406 6.275 1.00 0.00 H new ATOM 0 HB2 LYS A 22 63.459 0.798 5.887 1.00 0.00 H new ATOM 0 HB3 LYS A 22 61.937 1.076 5.063 1.00 0.00 H new ATOM 0 HG2 LYS A 22 62.902 3.292 4.206 1.00 0.00 H new ATOM 0 HG3 LYS A 22 64.446 2.818 4.884 1.00 0.00 H new ATOM 0 HD2 LYS A 22 64.355 0.690 3.506 1.00 0.00 H new ATOM 0 HD3 LYS A 22 62.864 1.255 2.778 1.00 0.00 H new ATOM 0 HE2 LYS A 22 64.019 3.269 1.891 1.00 0.00 H new ATOM 0 HE3 LYS A 22 65.505 2.803 2.696 1.00 0.00 H new ATOM 0 HZ1 LYS A 22 65.515 2.120 0.373 1.00 0.00 H new ATOM 0 HZ2 LYS A 22 65.541 0.753 1.381 1.00 0.00 H new ATOM 0 HZ3 LYS A 22 64.102 1.205 0.601 1.00 0.00 H new ATOM 360 N LEU A 23 61.602 0.895 8.371 1.00 0.00 N ATOM 361 CA LEU A 23 60.626 0.164 9.170 1.00 0.00 C ATOM 362 C LEU A 23 59.573 1.115 9.730 1.00 0.00 C ATOM 363 O LEU A 23 58.380 0.807 9.724 1.00 0.00 O ATOM 364 CB LEU A 23 61.329 -0.558 10.322 1.00 0.00 C ATOM 365 CG LEU A 23 61.281 -2.069 10.082 1.00 0.00 C ATOM 366 CD1 LEU A 23 62.172 -2.776 11.104 1.00 0.00 C ATOM 367 CD2 LEU A 23 59.841 -2.562 10.234 1.00 0.00 C ATOM 0 H LEU A 23 62.576 0.681 8.588 1.00 0.00 H new ATOM 0 HA LEU A 23 60.135 -0.568 8.529 1.00 0.00 H new ATOM 0 HB2 LEU A 23 62.364 -0.224 10.397 1.00 0.00 H new ATOM 0 HB3 LEU A 23 60.845 -0.314 11.268 1.00 0.00 H new ATOM 0 HG LEU A 23 61.637 -2.289 9.076 1.00 0.00 H new ATOM 0 HD11 LEU A 23 62.138 -3.852 10.934 1.00 0.00 H new ATOM 0 HD12 LEU A 23 63.198 -2.424 10.997 1.00 0.00 H new ATOM 0 HD13 LEU A 23 61.816 -2.557 12.111 1.00 0.00 H new ATOM 0 HD21 LEU A 23 59.805 -3.638 10.063 1.00 0.00 H new ATOM 0 HD22 LEU A 23 59.485 -2.342 11.241 1.00 0.00 H new ATOM 0 HD23 LEU A 23 59.205 -2.058 9.506 1.00 0.00 H new ATOM 379 N PHE A 24 60.021 2.269 10.212 1.00 0.00 N ATOM 380 CA PHE A 24 59.106 3.258 10.773 1.00 0.00 C ATOM 381 C PHE A 24 58.070 3.675 9.735 1.00 0.00 C ATOM 382 O PHE A 24 56.887 3.817 10.047 1.00 0.00 O ATOM 383 CB PHE A 24 59.887 4.487 11.240 1.00 0.00 C ATOM 384 CG PHE A 24 60.366 4.270 12.655 1.00 0.00 C ATOM 385 CD1 PHE A 24 61.570 3.596 12.893 1.00 0.00 C ATOM 386 CD2 PHE A 24 59.606 4.746 13.732 1.00 0.00 C ATOM 387 CE1 PHE A 24 62.014 3.396 14.204 1.00 0.00 C ATOM 388 CE2 PHE A 24 60.051 4.546 15.044 1.00 0.00 C ATOM 389 CZ PHE A 24 61.255 3.871 15.281 1.00 0.00 C ATOM 0 H PHE A 24 61.004 2.542 10.226 1.00 0.00 H new ATOM 0 HA PHE A 24 58.593 2.810 11.624 1.00 0.00 H new ATOM 0 HB2 PHE A 24 60.736 4.664 10.580 1.00 0.00 H new ATOM 0 HB3 PHE A 24 59.255 5.374 11.190 1.00 0.00 H new ATOM 0 HD1 PHE A 24 62.156 3.230 12.063 1.00 0.00 H new ATOM 0 HD2 PHE A 24 58.678 5.267 13.550 1.00 0.00 H new ATOM 0 HE1 PHE A 24 62.942 2.875 14.386 1.00 0.00 H new ATOM 0 HE2 PHE A 24 59.465 4.913 15.874 1.00 0.00 H new ATOM 0 HZ PHE A 24 61.598 3.717 16.293 1.00 0.00 H new ATOM 399 N GLU A 25 58.521 3.869 8.500 1.00 0.00 N ATOM 400 CA GLU A 25 57.623 4.269 7.423 1.00 0.00 C ATOM 401 C GLU A 25 56.681 3.125 7.059 1.00 0.00 C ATOM 402 O GLU A 25 55.511 3.347 6.751 1.00 0.00 O ATOM 403 CB GLU A 25 58.434 4.677 6.191 1.00 0.00 C ATOM 404 CG GLU A 25 59.141 6.007 6.463 1.00 0.00 C ATOM 405 CD GLU A 25 59.989 6.400 5.259 1.00 0.00 C ATOM 406 OE1 GLU A 25 60.398 5.512 4.530 1.00 0.00 O ATOM 407 OE2 GLU A 25 60.216 7.586 5.081 1.00 0.00 O ATOM 0 H GLU A 25 59.496 3.757 8.221 1.00 0.00 H new ATOM 0 HA GLU A 25 57.031 5.118 7.765 1.00 0.00 H new ATOM 0 HB2 GLU A 25 59.166 3.906 5.953 1.00 0.00 H new ATOM 0 HB3 GLU A 25 57.778 4.772 5.326 1.00 0.00 H new ATOM 0 HG2 GLU A 25 58.405 6.784 6.670 1.00 0.00 H new ATOM 0 HG3 GLU A 25 59.770 5.920 7.349 1.00 0.00 H new ATOM 414 N LEU A 26 57.202 1.903 7.098 1.00 0.00 N ATOM 415 CA LEU A 26 56.398 0.731 6.770 1.00 0.00 C ATOM 416 C LEU A 26 55.302 0.526 7.812 1.00 0.00 C ATOM 417 O LEU A 26 54.173 0.170 7.476 1.00 0.00 O ATOM 418 CB LEU A 26 57.287 -0.513 6.711 1.00 0.00 C ATOM 419 CG LEU A 26 57.830 -0.685 5.291 1.00 0.00 C ATOM 420 CD1 LEU A 26 56.662 -0.800 4.309 1.00 0.00 C ATOM 421 CD2 LEU A 26 58.687 0.527 4.922 1.00 0.00 C ATOM 0 H LEU A 26 58.169 1.699 7.351 1.00 0.00 H new ATOM 0 HA LEU A 26 55.934 0.892 5.797 1.00 0.00 H new ATOM 0 HB2 LEU A 26 58.111 -0.418 7.418 1.00 0.00 H new ATOM 0 HB3 LEU A 26 56.717 -1.395 7.003 1.00 0.00 H new ATOM 0 HG LEU A 26 58.438 -1.589 5.242 1.00 0.00 H new ATOM 0 HD11 LEU A 26 57.048 -0.923 3.297 1.00 0.00 H new ATOM 0 HD12 LEU A 26 56.050 -1.663 4.571 1.00 0.00 H new ATOM 0 HD13 LEU A 26 56.055 0.104 4.359 1.00 0.00 H new ATOM 0 HD21 LEU A 26 59.074 0.405 3.910 1.00 0.00 H new ATOM 0 HD22 LEU A 26 58.080 1.431 4.971 1.00 0.00 H new ATOM 0 HD23 LEU A 26 59.519 0.611 5.621 1.00 0.00 H new ATOM 433 N MET A 27 55.644 0.753 9.075 1.00 0.00 N ATOM 434 CA MET A 27 54.681 0.590 10.158 1.00 0.00 C ATOM 435 C MET A 27 53.400 1.362 9.856 1.00 0.00 C ATOM 436 O MET A 27 52.307 0.939 10.229 1.00 0.00 O ATOM 437 CB MET A 27 55.284 1.090 11.473 1.00 0.00 C ATOM 438 CG MET A 27 55.369 -0.068 12.468 1.00 0.00 C ATOM 439 SD MET A 27 53.755 -0.311 13.251 1.00 0.00 S ATOM 440 CE MET A 27 53.853 1.076 14.409 1.00 0.00 C ATOM 0 H MET A 27 56.574 1.048 9.373 1.00 0.00 H new ATOM 0 HA MET A 27 54.440 -0.469 10.249 1.00 0.00 H new ATOM 0 HB2 MET A 27 56.276 1.505 11.296 1.00 0.00 H new ATOM 0 HB3 MET A 27 54.672 1.893 11.884 1.00 0.00 H new ATOM 0 HG2 MET A 27 55.678 -0.979 11.956 1.00 0.00 H new ATOM 0 HG3 MET A 27 56.124 0.144 13.225 1.00 0.00 H new ATOM 0 HE1 MET A 27 53.836 0.698 15.431 1.00 0.00 H new ATOM 0 HE2 MET A 27 54.779 1.626 14.241 1.00 0.00 H new ATOM 0 HE3 MET A 27 53.003 1.741 14.253 1.00 0.00 H new ATOM 450 N GLN A 28 53.545 2.497 9.178 1.00 0.00 N ATOM 451 CA GLN A 28 52.394 3.320 8.831 1.00 0.00 C ATOM 452 C GLN A 28 51.684 2.758 7.604 1.00 0.00 C ATOM 453 O GLN A 28 50.455 2.724 7.548 1.00 0.00 O ATOM 454 CB GLN A 28 52.843 4.756 8.551 1.00 0.00 C ATOM 455 CG GLN A 28 53.591 5.304 9.768 1.00 0.00 C ATOM 456 CD GLN A 28 52.676 5.306 10.986 1.00 0.00 C ATOM 457 OE1 GLN A 28 51.470 5.523 10.858 1.00 0.00 O ATOM 458 NE2 GLN A 28 53.177 5.077 12.169 1.00 0.00 N ATOM 0 H GLN A 28 54.442 2.865 8.861 1.00 0.00 H new ATOM 0 HA GLN A 28 51.701 3.315 9.672 1.00 0.00 H new ATOM 0 HB2 GLN A 28 53.488 4.782 7.673 1.00 0.00 H new ATOM 0 HB3 GLN A 28 51.978 5.382 8.330 1.00 0.00 H new ATOM 0 HG2 GLN A 28 54.473 4.696 9.967 1.00 0.00 H new ATOM 0 HG3 GLN A 28 53.941 6.316 9.564 1.00 0.00 H new ATOM 0 HE21 GLN A 28 54.176 4.897 12.274 1.00 0.00 H new ATOM 0 HE22 GLN A 28 52.570 5.078 12.989 1.00 0.00 H new ATOM 467 N GLY A 29 52.467 2.319 6.625 1.00 0.00 N ATOM 468 CA GLY A 29 51.901 1.759 5.401 1.00 0.00 C ATOM 469 C GLY A 29 51.201 0.434 5.682 1.00 0.00 C ATOM 470 O GLY A 29 50.144 0.148 5.120 1.00 0.00 O ATOM 0 H GLY A 29 53.486 2.339 6.653 1.00 0.00 H new ATOM 0 HA2 GLY A 29 51.192 2.465 4.967 1.00 0.00 H new ATOM 0 HA3 GLY A 29 52.691 1.609 4.666 1.00 0.00 H new ATOM 474 N PHE A 30 51.796 -0.370 6.558 1.00 0.00 N ATOM 475 CA PHE A 30 51.219 -1.663 6.907 1.00 0.00 C ATOM 476 C PHE A 30 50.492 -1.582 8.246 1.00 0.00 C ATOM 477 O PHE A 30 50.804 -0.733 9.082 1.00 0.00 O ATOM 478 CB PHE A 30 52.320 -2.722 6.986 1.00 0.00 C ATOM 479 CG PHE A 30 53.106 -2.729 5.698 1.00 0.00 C ATOM 480 CD1 PHE A 30 54.369 -3.334 5.651 1.00 0.00 C ATOM 481 CD2 PHE A 30 52.573 -2.132 4.549 1.00 0.00 C ATOM 482 CE1 PHE A 30 55.097 -3.342 4.455 1.00 0.00 C ATOM 483 CE2 PHE A 30 53.302 -2.139 3.353 1.00 0.00 C ATOM 484 CZ PHE A 30 54.564 -2.745 3.307 1.00 0.00 C ATOM 0 H PHE A 30 52.670 -0.151 7.036 1.00 0.00 H new ATOM 0 HA PHE A 30 50.503 -1.940 6.134 1.00 0.00 H new ATOM 0 HB2 PHE A 30 52.981 -2.512 7.827 1.00 0.00 H new ATOM 0 HB3 PHE A 30 51.882 -3.704 7.162 1.00 0.00 H new ATOM 0 HD1 PHE A 30 54.781 -3.794 6.537 1.00 0.00 H new ATOM 0 HD2 PHE A 30 51.599 -1.666 4.585 1.00 0.00 H new ATOM 0 HE1 PHE A 30 56.070 -3.809 4.418 1.00 0.00 H new ATOM 0 HE2 PHE A 30 52.891 -1.678 2.467 1.00 0.00 H new ATOM 0 HZ PHE A 30 55.126 -2.752 2.385 1.00 0.00 H new ATOM 494 N ASP A 31 49.523 -2.469 8.441 1.00 0.00 N ATOM 495 CA ASP A 31 48.758 -2.489 9.683 1.00 0.00 C ATOM 496 C ASP A 31 49.255 -3.602 10.600 1.00 0.00 C ATOM 497 O ASP A 31 48.798 -4.742 10.510 1.00 0.00 O ATOM 498 CB ASP A 31 47.274 -2.698 9.380 1.00 0.00 C ATOM 499 CG ASP A 31 46.666 -1.410 8.834 1.00 0.00 C ATOM 500 OD1 ASP A 31 47.349 -0.399 8.862 1.00 0.00 O ATOM 501 OD2 ASP A 31 45.529 -1.454 8.395 1.00 0.00 O ATOM 0 H ASP A 31 49.250 -3.179 7.761 1.00 0.00 H new ATOM 0 HA ASP A 31 48.893 -1.532 10.186 1.00 0.00 H new ATOM 0 HB2 ASP A 31 47.152 -3.503 8.655 1.00 0.00 H new ATOM 0 HB3 ASP A 31 46.749 -3.002 10.285 1.00 0.00 H new ATOM 506 N ALA A 32 50.191 -3.264 11.481 1.00 0.00 N ATOM 507 CA ALA A 32 50.742 -4.244 12.409 1.00 0.00 C ATOM 508 C ALA A 32 51.911 -3.648 13.187 1.00 0.00 C ATOM 509 O ALA A 32 52.562 -2.710 12.726 1.00 0.00 O ATOM 510 CB ALA A 32 51.216 -5.481 11.643 1.00 0.00 C ATOM 0 H ALA A 32 50.581 -2.326 11.572 1.00 0.00 H new ATOM 0 HA ALA A 32 49.959 -4.529 13.112 1.00 0.00 H new ATOM 0 HB1 ALA A 32 51.626 -6.208 12.344 1.00 0.00 H new ATOM 0 HB2 ALA A 32 50.374 -5.925 11.111 1.00 0.00 H new ATOM 0 HB3 ALA A 32 51.986 -5.193 10.927 1.00 0.00 H new ATOM 516 N GLU A 33 52.170 -4.196 14.369 1.00 0.00 N ATOM 517 CA GLU A 33 53.263 -3.709 15.203 1.00 0.00 C ATOM 518 C GLU A 33 54.487 -4.609 15.062 1.00 0.00 C ATOM 519 O GLU A 33 54.378 -5.833 15.108 1.00 0.00 O ATOM 520 CB GLU A 33 52.824 -3.668 16.667 1.00 0.00 C ATOM 521 CG GLU A 33 53.893 -2.958 17.502 1.00 0.00 C ATOM 522 CD GLU A 33 53.394 -2.760 18.928 1.00 0.00 C ATOM 523 OE1 GLU A 33 52.233 -3.040 19.174 1.00 0.00 O ATOM 524 OE2 GLU A 33 54.182 -2.332 19.756 1.00 0.00 O ATOM 0 H GLU A 33 51.643 -4.972 14.769 1.00 0.00 H new ATOM 0 HA GLU A 33 53.526 -2.704 14.874 1.00 0.00 H new ATOM 0 HB2 GLU A 33 51.871 -3.146 16.757 1.00 0.00 H new ATOM 0 HB3 GLU A 33 52.670 -4.681 17.040 1.00 0.00 H new ATOM 0 HG2 GLU A 33 54.811 -3.545 17.508 1.00 0.00 H new ATOM 0 HG3 GLU A 33 54.134 -1.994 17.055 1.00 0.00 H new ATOM 531 N VAL A 34 55.651 -3.992 14.890 1.00 0.00 N ATOM 532 CA VAL A 34 56.890 -4.747 14.743 1.00 0.00 C ATOM 533 C VAL A 34 57.791 -4.540 15.956 1.00 0.00 C ATOM 534 O VAL A 34 57.825 -3.455 16.538 1.00 0.00 O ATOM 535 CB VAL A 34 57.626 -4.301 13.478 1.00 0.00 C ATOM 536 CG1 VAL A 34 56.777 -4.631 12.250 1.00 0.00 C ATOM 537 CG2 VAL A 34 57.873 -2.792 13.537 1.00 0.00 C ATOM 0 H VAL A 34 55.763 -2.979 14.849 1.00 0.00 H new ATOM 0 HA VAL A 34 56.641 -5.805 14.665 1.00 0.00 H new ATOM 0 HB VAL A 34 58.580 -4.823 13.410 1.00 0.00 H new ATOM 0 HG11 VAL A 34 57.302 -4.313 11.349 1.00 0.00 H new ATOM 0 HG12 VAL A 34 56.601 -5.706 12.207 1.00 0.00 H new ATOM 0 HG13 VAL A 34 55.822 -4.110 12.317 1.00 0.00 H new ATOM 0 HG21 VAL A 34 58.397 -2.474 12.636 1.00 0.00 H new ATOM 0 HG22 VAL A 34 56.919 -2.270 13.605 1.00 0.00 H new ATOM 0 HG23 VAL A 34 58.479 -2.556 14.412 1.00 0.00 H new ATOM 547 N LEU A 35 58.518 -5.586 16.333 1.00 0.00 N ATOM 548 CA LEU A 35 59.416 -5.508 17.481 1.00 0.00 C ATOM 549 C LEU A 35 60.672 -6.337 17.236 1.00 0.00 C ATOM 550 O LEU A 35 60.602 -7.447 16.709 1.00 0.00 O ATOM 551 CB LEU A 35 58.703 -6.015 18.736 1.00 0.00 C ATOM 552 CG LEU A 35 59.731 -6.270 19.839 1.00 0.00 C ATOM 553 CD1 LEU A 35 59.166 -5.806 21.182 1.00 0.00 C ATOM 554 CD2 LEU A 35 60.042 -7.767 19.908 1.00 0.00 C ATOM 0 H LEU A 35 58.504 -6.492 15.865 1.00 0.00 H new ATOM 0 HA LEU A 35 59.705 -4.467 17.623 1.00 0.00 H new ATOM 0 HB2 LEU A 35 57.969 -5.282 19.071 1.00 0.00 H new ATOM 0 HB3 LEU A 35 58.159 -6.933 18.512 1.00 0.00 H new ATOM 0 HG LEU A 35 60.644 -5.717 19.619 1.00 0.00 H new ATOM 0 HD11 LEU A 35 59.899 -5.988 21.968 1.00 0.00 H new ATOM 0 HD12 LEU A 35 58.943 -4.740 21.134 1.00 0.00 H new ATOM 0 HD13 LEU A 35 58.253 -6.359 21.403 1.00 0.00 H new ATOM 0 HD21 LEU A 35 60.775 -7.951 20.694 1.00 0.00 H new ATOM 0 HD22 LEU A 35 59.128 -8.319 20.128 1.00 0.00 H new ATOM 0 HD23 LEU A 35 60.445 -8.099 18.951 1.00 0.00 H new ATOM 566 N LEU A 36 61.821 -5.789 17.621 1.00 0.00 N ATOM 567 CA LEU A 36 63.088 -6.488 17.439 1.00 0.00 C ATOM 568 C LEU A 36 63.643 -6.950 18.782 1.00 0.00 C ATOM 569 O LEU A 36 63.456 -6.289 19.803 1.00 0.00 O ATOM 570 CB LEU A 36 64.099 -5.565 16.756 1.00 0.00 C ATOM 571 CG LEU A 36 63.560 -5.137 15.390 1.00 0.00 C ATOM 572 CD1 LEU A 36 64.189 -3.803 14.987 1.00 0.00 C ATOM 573 CD2 LEU A 36 63.914 -6.202 14.349 1.00 0.00 C ATOM 0 H LEU A 36 61.901 -4.871 18.057 1.00 0.00 H new ATOM 0 HA LEU A 36 62.913 -7.362 16.812 1.00 0.00 H new ATOM 0 HB2 LEU A 36 64.284 -4.688 17.377 1.00 0.00 H new ATOM 0 HB3 LEU A 36 65.053 -6.078 16.637 1.00 0.00 H new ATOM 0 HG LEU A 36 62.477 -5.025 15.445 1.00 0.00 H new ATOM 0 HD11 LEU A 36 63.804 -3.499 14.014 1.00 0.00 H new ATOM 0 HD12 LEU A 36 63.940 -3.044 15.729 1.00 0.00 H new ATOM 0 HD13 LEU A 36 65.272 -3.914 14.931 1.00 0.00 H new ATOM 0 HD21 LEU A 36 63.531 -5.900 13.374 1.00 0.00 H new ATOM 0 HD22 LEU A 36 64.997 -6.312 14.295 1.00 0.00 H new ATOM 0 HD23 LEU A 36 63.466 -7.154 14.635 1.00 0.00 H new ATOM 585 N ARG A 37 64.327 -8.090 18.773 1.00 0.00 N ATOM 586 CA ARG A 37 64.905 -8.632 19.998 1.00 0.00 C ATOM 587 C ARG A 37 66.220 -9.346 19.700 1.00 0.00 C ATOM 588 O ARG A 37 66.314 -10.126 18.752 1.00 0.00 O ATOM 589 CB ARG A 37 63.926 -9.612 20.647 1.00 0.00 C ATOM 590 CG ARG A 37 64.703 -10.637 21.475 1.00 0.00 C ATOM 591 CD ARG A 37 63.770 -11.276 22.505 1.00 0.00 C ATOM 592 NE ARG A 37 62.719 -12.033 21.833 1.00 0.00 N ATOM 593 CZ ARG A 37 61.689 -12.528 22.511 1.00 0.00 C ATOM 594 NH1 ARG A 37 60.762 -13.203 21.888 1.00 0.00 N ATOM 595 NH2 ARG A 37 61.605 -12.341 23.800 1.00 0.00 N ATOM 0 H ARG A 37 64.494 -8.652 17.939 1.00 0.00 H new ATOM 0 HA ARG A 37 65.100 -7.806 20.682 1.00 0.00 H new ATOM 0 HB2 ARG A 37 63.223 -9.073 21.282 1.00 0.00 H new ATOM 0 HB3 ARG A 37 63.339 -10.118 19.880 1.00 0.00 H new ATOM 0 HG2 ARG A 37 65.122 -11.404 20.823 1.00 0.00 H new ATOM 0 HG3 ARG A 37 65.541 -10.154 21.978 1.00 0.00 H new ATOM 0 HD2 ARG A 37 64.338 -11.934 23.162 1.00 0.00 H new ATOM 0 HD3 ARG A 37 63.327 -10.503 23.133 1.00 0.00 H new ATOM 0 HE ARG A 37 62.776 -12.185 20.826 1.00 0.00 H new ATOM 0 HH11 ARG A 37 60.828 -13.350 20.881 1.00 0.00 H new ATOM 0 HH12 ARG A 37 59.971 -13.583 22.408 1.00 0.00 H new ATOM 0 HH21 ARG A 37 62.330 -11.815 24.287 1.00 0.00 H new ATOM 0 HH22 ARG A 37 60.814 -12.721 24.320 1.00 0.00 H new ATOM 609 N ASN A 38 67.233 -9.072 20.516 1.00 0.00 N ATOM 610 CA ASN A 38 68.539 -9.693 20.330 1.00 0.00 C ATOM 611 C ASN A 38 68.595 -11.044 21.037 1.00 0.00 C ATOM 612 O ASN A 38 67.882 -11.274 22.014 1.00 0.00 O ATOM 613 CB ASN A 38 69.635 -8.780 20.882 1.00 0.00 C ATOM 614 CG ASN A 38 70.932 -8.996 20.110 1.00 0.00 C ATOM 615 OD1 ASN A 38 71.036 -9.933 19.317 1.00 0.00 O ATOM 616 ND2 ASN A 38 71.935 -8.182 20.294 1.00 0.00 N ATOM 0 H ASN A 38 67.176 -8.429 21.306 1.00 0.00 H new ATOM 0 HA ASN A 38 68.699 -9.847 19.263 1.00 0.00 H new ATOM 0 HB2 ASN A 38 69.325 -7.738 20.804 1.00 0.00 H new ATOM 0 HB3 ASN A 38 69.793 -8.987 21.940 1.00 0.00 H new ATOM 0 HD21 ASN A 38 72.806 -8.321 19.781 1.00 0.00 H new ATOM 0 HD22 ASN A 38 71.848 -7.406 20.951 1.00 0.00 H new ATOM 623 N ASP A 39 69.448 -11.933 20.538 1.00 0.00 N ATOM 624 CA ASP A 39 69.589 -13.258 21.131 1.00 0.00 C ATOM 625 C ASP A 39 69.871 -13.149 22.627 1.00 0.00 C ATOM 626 O ASP A 39 69.473 -14.014 23.407 1.00 0.00 O ATOM 627 CB ASP A 39 70.729 -14.017 20.449 1.00 0.00 C ATOM 628 CG ASP A 39 70.753 -15.464 20.930 1.00 0.00 C ATOM 629 OD1 ASP A 39 70.009 -15.776 21.845 1.00 0.00 O ATOM 630 OD2 ASP A 39 71.516 -16.238 20.377 1.00 0.00 O ATOM 0 H ASP A 39 70.048 -11.762 19.731 1.00 0.00 H new ATOM 0 HA ASP A 39 68.655 -13.801 20.988 1.00 0.00 H new ATOM 0 HB2 ASP A 39 70.601 -13.987 19.367 1.00 0.00 H new ATOM 0 HB3 ASP A 39 71.681 -13.535 20.671 1.00 0.00 H new ATOM 635 N GLU A 40 70.557 -12.082 23.018 1.00 0.00 N ATOM 636 CA GLU A 40 70.887 -11.870 24.423 1.00 0.00 C ATOM 637 C GLU A 40 69.625 -11.587 25.232 1.00 0.00 C ATOM 638 O GLU A 40 69.674 -11.472 26.457 1.00 0.00 O ATOM 639 CB GLU A 40 71.858 -10.697 24.562 1.00 0.00 C ATOM 640 CG GLU A 40 73.120 -10.979 23.744 1.00 0.00 C ATOM 641 CD GLU A 40 73.971 -12.034 24.444 1.00 0.00 C ATOM 642 OE1 GLU A 40 73.724 -12.284 25.613 1.00 0.00 O ATOM 643 OE2 GLU A 40 74.857 -12.574 23.802 1.00 0.00 O ATOM 0 H GLU A 40 70.894 -11.354 22.388 1.00 0.00 H new ATOM 0 HA GLU A 40 71.357 -12.776 24.807 1.00 0.00 H new ATOM 0 HB2 GLU A 40 71.386 -9.777 24.216 1.00 0.00 H new ATOM 0 HB3 GLU A 40 72.117 -10.548 25.610 1.00 0.00 H new ATOM 0 HG2 GLU A 40 72.847 -11.323 22.746 1.00 0.00 H new ATOM 0 HG3 GLU A 40 73.695 -10.061 23.618 1.00 0.00 H new ATOM 650 N GLY A 41 68.496 -11.475 24.539 1.00 0.00 N ATOM 651 CA GLY A 41 67.227 -11.205 25.204 1.00 0.00 C ATOM 652 C GLY A 41 66.999 -9.705 25.354 1.00 0.00 C ATOM 653 O GLY A 41 66.211 -9.268 26.193 1.00 0.00 O ATOM 0 H GLY A 41 68.434 -11.566 23.525 1.00 0.00 H new ATOM 0 HA2 GLY A 41 66.411 -11.645 24.631 1.00 0.00 H new ATOM 0 HA3 GLY A 41 67.219 -11.678 26.186 1.00 0.00 H new ATOM 657 N THR A 42 67.693 -8.922 24.536 1.00 0.00 N ATOM 658 CA THR A 42 67.558 -7.470 24.587 1.00 0.00 C ATOM 659 C THR A 42 66.427 -7.005 23.675 1.00 0.00 C ATOM 660 O THR A 42 66.518 -7.114 22.452 1.00 0.00 O ATOM 661 CB THR A 42 68.869 -6.808 24.156 1.00 0.00 C ATOM 662 OG1 THR A 42 69.860 -7.036 25.148 1.00 0.00 O ATOM 663 CG2 THR A 42 68.650 -5.304 23.985 1.00 0.00 C ATOM 0 H THR A 42 68.350 -9.264 23.835 1.00 0.00 H new ATOM 0 HA THR A 42 67.325 -7.181 25.612 1.00 0.00 H new ATOM 0 HB THR A 42 69.199 -7.234 23.208 1.00 0.00 H new ATOM 0 HG1 THR A 42 70.701 -6.614 24.873 1.00 0.00 H new ATOM 0 HG21 THR A 42 69.584 -4.833 23.678 1.00 0.00 H new ATOM 0 HG22 THR A 42 67.889 -5.131 23.224 1.00 0.00 H new ATOM 0 HG23 THR A 42 68.321 -4.874 24.931 1.00 0.00 H new ATOM 671 N GLU A 43 65.363 -6.487 24.278 1.00 0.00 N ATOM 672 CA GLU A 43 64.219 -6.008 23.510 1.00 0.00 C ATOM 673 C GLU A 43 64.521 -4.646 22.892 1.00 0.00 C ATOM 674 O GLU A 43 64.531 -3.629 23.586 1.00 0.00 O ATOM 675 CB GLU A 43 62.990 -5.900 24.414 1.00 0.00 C ATOM 676 CG GLU A 43 62.607 -7.290 24.925 1.00 0.00 C ATOM 677 CD GLU A 43 63.496 -7.676 26.102 1.00 0.00 C ATOM 678 OE1 GLU A 43 64.340 -6.875 26.469 1.00 0.00 O ATOM 679 OE2 GLU A 43 63.320 -8.766 26.619 1.00 0.00 O ATOM 0 H GLU A 43 65.268 -6.388 25.289 1.00 0.00 H new ATOM 0 HA GLU A 43 64.018 -6.721 22.710 1.00 0.00 H new ATOM 0 HB2 GLU A 43 63.200 -5.238 25.254 1.00 0.00 H new ATOM 0 HB3 GLU A 43 62.158 -5.462 23.863 1.00 0.00 H new ATOM 0 HG2 GLU A 43 61.561 -7.299 25.231 1.00 0.00 H new ATOM 0 HG3 GLU A 43 62.711 -8.022 24.124 1.00 0.00 H new ATOM 686 N ALA A 44 64.765 -4.635 21.586 1.00 0.00 N ATOM 687 CA ALA A 44 65.065 -3.392 20.886 1.00 0.00 C ATOM 688 C ALA A 44 63.827 -2.873 20.162 1.00 0.00 C ATOM 689 O ALA A 44 63.710 -3.001 18.943 1.00 0.00 O ATOM 690 CB ALA A 44 66.191 -3.620 19.877 1.00 0.00 C ATOM 0 H ALA A 44 64.761 -5.466 20.995 1.00 0.00 H new ATOM 0 HA ALA A 44 65.380 -2.650 21.620 1.00 0.00 H new ATOM 0 HB1 ALA A 44 66.409 -2.687 19.358 1.00 0.00 H new ATOM 0 HB2 ALA A 44 67.084 -3.962 20.400 1.00 0.00 H new ATOM 0 HB3 ALA A 44 65.883 -4.374 19.153 1.00 0.00 H new ATOM 696 N GLU A 45 62.906 -2.286 20.920 1.00 0.00 N ATOM 697 CA GLU A 45 61.681 -1.753 20.339 1.00 0.00 C ATOM 698 C GLU A 45 61.981 -1.021 19.034 1.00 0.00 C ATOM 699 O GLU A 45 62.757 -0.066 19.011 1.00 0.00 O ATOM 700 CB GLU A 45 61.012 -0.792 21.323 1.00 0.00 C ATOM 701 CG GLU A 45 60.436 -1.584 22.497 1.00 0.00 C ATOM 702 CD GLU A 45 59.929 -0.629 23.572 1.00 0.00 C ATOM 703 OE1 GLU A 45 60.245 0.547 23.489 1.00 0.00 O ATOM 704 OE2 GLU A 45 59.233 -1.087 24.463 1.00 0.00 O ATOM 0 H GLU A 45 62.984 -2.168 21.930 1.00 0.00 H new ATOM 0 HA GLU A 45 61.008 -2.585 20.129 1.00 0.00 H new ATOM 0 HB2 GLU A 45 61.736 -0.061 21.684 1.00 0.00 H new ATOM 0 HB3 GLU A 45 60.220 -0.235 20.822 1.00 0.00 H new ATOM 0 HG2 GLU A 45 59.622 -2.221 22.152 1.00 0.00 H new ATOM 0 HG3 GLU A 45 61.200 -2.240 22.913 1.00 0.00 H new ATOM 711 N ALA A 46 61.360 -1.476 17.951 1.00 0.00 N ATOM 712 CA ALA A 46 61.568 -0.857 16.647 1.00 0.00 C ATOM 713 C ALA A 46 60.935 0.530 16.607 1.00 0.00 C ATOM 714 O ALA A 46 60.987 1.217 15.586 1.00 0.00 O ATOM 715 CB ALA A 46 60.957 -1.731 15.550 1.00 0.00 C ATOM 0 H ALA A 46 60.713 -2.265 17.949 1.00 0.00 H new ATOM 0 HA ALA A 46 62.640 -0.760 16.478 1.00 0.00 H new ATOM 0 HB1 ALA A 46 61.117 -1.261 14.579 1.00 0.00 H new ATOM 0 HB2 ALA A 46 61.431 -2.713 15.561 1.00 0.00 H new ATOM 0 HB3 ALA A 46 59.887 -1.843 15.727 1.00 0.00 H new ATOM 721 N ASN A 47 60.338 0.935 17.722 1.00 0.00 N ATOM 722 CA ASN A 47 59.698 2.243 17.802 1.00 0.00 C ATOM 723 C ASN A 47 60.530 3.196 18.655 1.00 0.00 C ATOM 724 O ASN A 47 60.053 4.253 19.067 1.00 0.00 O ATOM 725 CB ASN A 47 58.299 2.104 18.407 1.00 0.00 C ATOM 726 CG ASN A 47 58.328 2.485 19.883 1.00 0.00 C ATOM 727 OD1 ASN A 47 58.490 1.622 20.746 1.00 0.00 O ATOM 728 ND2 ASN A 47 58.181 3.735 20.227 1.00 0.00 N ATOM 0 H ASN A 47 60.284 0.382 18.577 1.00 0.00 H new ATOM 0 HA ASN A 47 59.619 2.650 16.794 1.00 0.00 H new ATOM 0 HB2 ASN A 47 57.597 2.744 17.872 1.00 0.00 H new ATOM 0 HB3 ASN A 47 57.946 1.079 18.295 1.00 0.00 H new ATOM 0 HD21 ASN A 47 58.200 3.998 21.212 1.00 0.00 H new ATOM 0 HD22 ASN A 47 58.047 4.449 19.511 1.00 0.00 H new ATOM 735 N SER A 48 61.776 2.814 18.915 1.00 0.00 N ATOM 736 CA SER A 48 62.666 3.642 19.720 1.00 0.00 C ATOM 737 C SER A 48 64.046 3.729 19.075 1.00 0.00 C ATOM 738 O SER A 48 64.640 2.711 18.717 1.00 0.00 O ATOM 739 CB SER A 48 62.794 3.057 21.127 1.00 0.00 C ATOM 740 OG SER A 48 61.565 3.225 21.818 1.00 0.00 O ATOM 0 H SER A 48 62.190 1.943 18.583 1.00 0.00 H new ATOM 0 HA SER A 48 62.242 4.644 19.781 1.00 0.00 H new ATOM 0 HB2 SER A 48 63.052 1.999 21.072 1.00 0.00 H new ATOM 0 HB3 SER A 48 63.600 3.554 21.668 1.00 0.00 H new ATOM 0 HG SER A 48 61.643 2.850 22.720 1.00 0.00 H new ATOM 746 N VAL A 49 64.550 4.950 18.929 1.00 0.00 N ATOM 747 CA VAL A 49 65.861 5.157 18.326 1.00 0.00 C ATOM 748 C VAL A 49 66.954 4.541 19.193 1.00 0.00 C ATOM 749 O VAL A 49 67.975 4.078 18.685 1.00 0.00 O ATOM 750 CB VAL A 49 66.125 6.654 18.154 1.00 0.00 C ATOM 751 CG1 VAL A 49 65.319 7.183 16.968 1.00 0.00 C ATOM 752 CG2 VAL A 49 65.705 7.394 19.426 1.00 0.00 C ATOM 0 H VAL A 49 64.075 5.805 19.218 1.00 0.00 H new ATOM 0 HA VAL A 49 65.872 4.672 17.350 1.00 0.00 H new ATOM 0 HB VAL A 49 67.187 6.816 17.971 1.00 0.00 H new ATOM 0 HG11 VAL A 49 65.508 8.250 16.846 1.00 0.00 H new ATOM 0 HG12 VAL A 49 65.617 6.656 16.062 1.00 0.00 H new ATOM 0 HG13 VAL A 49 64.256 7.021 17.149 1.00 0.00 H new ATOM 0 HG21 VAL A 49 65.893 8.461 19.305 1.00 0.00 H new ATOM 0 HG22 VAL A 49 64.643 7.231 19.608 1.00 0.00 H new ATOM 0 HG23 VAL A 49 66.280 7.018 20.272 1.00 0.00 H new ATOM 762 N ILE A 50 66.733 4.540 20.504 1.00 0.00 N ATOM 763 CA ILE A 50 67.707 3.979 21.432 1.00 0.00 C ATOM 764 C ILE A 50 67.915 2.493 21.156 1.00 0.00 C ATOM 765 O ILE A 50 69.033 1.985 21.249 1.00 0.00 O ATOM 766 CB ILE A 50 67.227 4.170 22.871 1.00 0.00 C ATOM 767 CG1 ILE A 50 67.241 5.661 23.217 1.00 0.00 C ATOM 768 CG2 ILE A 50 68.157 3.418 23.824 1.00 0.00 C ATOM 769 CD1 ILE A 50 66.443 5.895 24.502 1.00 0.00 C ATOM 0 H ILE A 50 65.894 4.918 20.945 1.00 0.00 H new ATOM 0 HA ILE A 50 68.655 4.499 21.293 1.00 0.00 H new ATOM 0 HB ILE A 50 66.214 3.781 22.971 1.00 0.00 H new ATOM 0 HG12 ILE A 50 68.267 6.006 23.346 1.00 0.00 H new ATOM 0 HG13 ILE A 50 66.811 6.239 22.399 1.00 0.00 H new ATOM 0 HG21 ILE A 50 67.814 3.554 24.850 1.00 0.00 H new ATOM 0 HG22 ILE A 50 68.150 2.356 23.577 1.00 0.00 H new ATOM 0 HG23 ILE A 50 69.171 3.807 23.725 1.00 0.00 H new ATOM 0 HD11 ILE A 50 66.453 6.957 24.748 1.00 0.00 H new ATOM 0 HD12 ILE A 50 65.414 5.566 24.356 1.00 0.00 H new ATOM 0 HD13 ILE A 50 66.893 5.329 25.318 1.00 0.00 H new ATOM 781 N ALA A 51 66.832 1.801 20.818 1.00 0.00 N ATOM 782 CA ALA A 51 66.909 0.373 20.531 1.00 0.00 C ATOM 783 C ALA A 51 67.695 0.126 19.249 1.00 0.00 C ATOM 784 O ALA A 51 68.479 -0.820 19.162 1.00 0.00 O ATOM 785 CB ALA A 51 65.500 -0.208 20.388 1.00 0.00 C ATOM 0 H ALA A 51 65.898 2.202 20.736 1.00 0.00 H new ATOM 0 HA ALA A 51 67.422 -0.117 21.358 1.00 0.00 H new ATOM 0 HB1 ALA A 51 65.566 -1.275 20.174 1.00 0.00 H new ATOM 0 HB2 ALA A 51 64.949 -0.058 21.316 1.00 0.00 H new ATOM 0 HB3 ALA A 51 64.980 0.294 19.572 1.00 0.00 H new ATOM 791 N LEU A 52 67.481 0.981 18.254 1.00 0.00 N ATOM 792 CA LEU A 52 68.176 0.846 16.980 1.00 0.00 C ATOM 793 C LEU A 52 69.686 0.916 17.182 1.00 0.00 C ATOM 794 O LEU A 52 70.441 0.176 16.553 1.00 0.00 O ATOM 795 CB LEU A 52 67.735 1.957 16.024 1.00 0.00 C ATOM 796 CG LEU A 52 66.279 1.732 15.618 1.00 0.00 C ATOM 797 CD1 LEU A 52 65.807 2.894 14.741 1.00 0.00 C ATOM 798 CD2 LEU A 52 66.166 0.424 14.831 1.00 0.00 C ATOM 0 H LEU A 52 66.836 1.770 18.305 1.00 0.00 H new ATOM 0 HA LEU A 52 67.923 -0.124 16.551 1.00 0.00 H new ATOM 0 HB2 LEU A 52 67.844 2.929 16.505 1.00 0.00 H new ATOM 0 HB3 LEU A 52 68.373 1.965 15.140 1.00 0.00 H new ATOM 0 HG LEU A 52 65.658 1.675 16.512 1.00 0.00 H new ATOM 0 HD11 LEU A 52 64.768 2.733 14.452 1.00 0.00 H new ATOM 0 HD12 LEU A 52 65.888 3.827 15.299 1.00 0.00 H new ATOM 0 HD13 LEU A 52 66.428 2.951 13.847 1.00 0.00 H new ATOM 0 HD21 LEU A 52 65.128 0.262 14.541 1.00 0.00 H new ATOM 0 HD22 LEU A 52 66.788 0.482 13.938 1.00 0.00 H new ATOM 0 HD23 LEU A 52 66.502 -0.405 15.453 1.00 0.00 H new ATOM 810 N LEU A 53 70.119 1.809 18.066 1.00 0.00 N ATOM 811 CA LEU A 53 71.542 1.966 18.343 1.00 0.00 C ATOM 812 C LEU A 53 72.078 0.751 19.095 1.00 0.00 C ATOM 813 O LEU A 53 73.226 0.350 18.905 1.00 0.00 O ATOM 814 CB LEU A 53 71.776 3.228 19.177 1.00 0.00 C ATOM 815 CG LEU A 53 72.233 4.365 18.262 1.00 0.00 C ATOM 816 CD1 LEU A 53 72.277 5.672 19.056 1.00 0.00 C ATOM 817 CD2 LEU A 53 73.630 4.052 17.721 1.00 0.00 C ATOM 0 H LEU A 53 69.510 2.430 18.599 1.00 0.00 H new ATOM 0 HA LEU A 53 72.070 2.055 17.394 1.00 0.00 H new ATOM 0 HB2 LEU A 53 70.859 3.510 19.695 1.00 0.00 H new ATOM 0 HB3 LEU A 53 72.529 3.037 19.942 1.00 0.00 H new ATOM 0 HG LEU A 53 71.534 4.467 17.432 1.00 0.00 H new ATOM 0 HD11 LEU A 53 72.603 6.483 18.404 1.00 0.00 H new ATOM 0 HD12 LEU A 53 71.283 5.895 19.444 1.00 0.00 H new ATOM 0 HD13 LEU A 53 72.976 5.570 19.886 1.00 0.00 H new ATOM 0 HD21 LEU A 53 73.957 4.861 17.069 1.00 0.00 H new ATOM 0 HD22 LEU A 53 74.328 3.951 18.552 1.00 0.00 H new ATOM 0 HD23 LEU A 53 73.601 3.120 17.156 1.00 0.00 H new ATOM 829 N MET A 54 71.240 0.171 19.948 1.00 0.00 N ATOM 830 CA MET A 54 71.641 -0.997 20.722 1.00 0.00 C ATOM 831 C MET A 54 71.877 -2.192 19.804 1.00 0.00 C ATOM 832 O MET A 54 72.822 -2.957 19.995 1.00 0.00 O ATOM 833 CB MET A 54 70.557 -1.343 21.745 1.00 0.00 C ATOM 834 CG MET A 54 70.972 -2.590 22.527 1.00 0.00 C ATOM 835 SD MET A 54 70.575 -2.364 24.278 1.00 0.00 S ATOM 836 CE MET A 54 71.984 -1.309 24.696 1.00 0.00 C ATOM 0 H MET A 54 70.286 0.488 20.120 1.00 0.00 H new ATOM 0 HA MET A 54 72.570 -0.764 21.242 1.00 0.00 H new ATOM 0 HB2 MET A 54 70.406 -0.507 22.427 1.00 0.00 H new ATOM 0 HB3 MET A 54 69.607 -1.517 21.239 1.00 0.00 H new ATOM 0 HG2 MET A 54 70.455 -3.466 22.136 1.00 0.00 H new ATOM 0 HG3 MET A 54 72.040 -2.770 22.406 1.00 0.00 H new ATOM 0 HE1 MET A 54 72.640 -1.836 25.388 1.00 0.00 H new ATOM 0 HE2 MET A 54 72.536 -1.063 23.789 1.00 0.00 H new ATOM 0 HE3 MET A 54 71.626 -0.392 25.163 1.00 0.00 H new ATOM 846 N LEU A 55 71.012 -2.347 18.808 1.00 0.00 N ATOM 847 CA LEU A 55 71.136 -3.453 17.866 1.00 0.00 C ATOM 848 C LEU A 55 72.424 -3.328 17.059 1.00 0.00 C ATOM 849 O LEU A 55 72.945 -4.319 16.547 1.00 0.00 O ATOM 850 CB LEU A 55 69.936 -3.466 16.916 1.00 0.00 C ATOM 851 CG LEU A 55 68.666 -3.801 17.701 1.00 0.00 C ATOM 852 CD1 LEU A 55 67.452 -3.695 16.777 1.00 0.00 C ATOM 853 CD2 LEU A 55 68.768 -5.226 18.248 1.00 0.00 C ATOM 0 H LEU A 55 70.222 -1.726 18.633 1.00 0.00 H new ATOM 0 HA LEU A 55 71.163 -4.385 18.430 1.00 0.00 H new ATOM 0 HB2 LEU A 55 69.831 -2.495 16.432 1.00 0.00 H new ATOM 0 HB3 LEU A 55 70.092 -4.201 16.126 1.00 0.00 H new ATOM 0 HG LEU A 55 68.554 -3.100 18.528 1.00 0.00 H new ATOM 0 HD11 LEU A 55 66.547 -3.934 17.336 1.00 0.00 H new ATOM 0 HD12 LEU A 55 67.380 -2.680 16.386 1.00 0.00 H new ATOM 0 HD13 LEU A 55 67.562 -4.396 15.949 1.00 0.00 H new ATOM 0 HD21 LEU A 55 67.864 -5.466 18.808 1.00 0.00 H new ATOM 0 HD22 LEU A 55 68.879 -5.926 17.420 1.00 0.00 H new ATOM 0 HD23 LEU A 55 69.633 -5.302 18.906 1.00 0.00 H new ATOM 865 N ASP A 56 72.933 -2.105 16.951 1.00 0.00 N ATOM 866 CA ASP A 56 74.162 -1.863 16.204 1.00 0.00 C ATOM 867 C ASP A 56 75.291 -2.741 16.730 1.00 0.00 C ATOM 868 O ASP A 56 76.106 -3.250 15.960 1.00 0.00 O ATOM 869 CB ASP A 56 74.560 -0.391 16.318 1.00 0.00 C ATOM 870 CG ASP A 56 75.747 -0.100 15.406 1.00 0.00 C ATOM 871 OD1 ASP A 56 75.601 -0.264 14.206 1.00 0.00 O ATOM 872 OD2 ASP A 56 76.786 0.281 15.921 1.00 0.00 O ATOM 0 H ASP A 56 72.517 -1.272 17.368 1.00 0.00 H new ATOM 0 HA ASP A 56 73.984 -2.111 15.158 1.00 0.00 H new ATOM 0 HB2 ASP A 56 73.717 0.244 16.046 1.00 0.00 H new ATOM 0 HB3 ASP A 56 74.817 -0.154 17.350 1.00 0.00 H new ATOM 877 N SER A 57 75.335 -2.915 18.047 1.00 0.00 N ATOM 878 CA SER A 57 76.371 -3.734 18.666 1.00 0.00 C ATOM 879 C SER A 57 76.120 -5.213 18.392 1.00 0.00 C ATOM 880 O SER A 57 76.957 -6.062 18.701 1.00 0.00 O ATOM 881 CB SER A 57 76.397 -3.490 20.176 1.00 0.00 C ATOM 882 OG SER A 57 76.852 -2.167 20.430 1.00 0.00 O ATOM 0 H SER A 57 74.670 -2.503 18.702 1.00 0.00 H new ATOM 0 HA SER A 57 77.333 -3.455 18.236 1.00 0.00 H new ATOM 0 HB2 SER A 57 75.401 -3.631 20.596 1.00 0.00 H new ATOM 0 HB3 SER A 57 77.053 -4.212 20.662 1.00 0.00 H new ATOM 0 HG SER A 57 76.868 -2.007 21.397 1.00 0.00 H new ATOM 888 N ALA A 58 74.963 -5.515 17.812 1.00 0.00 N ATOM 889 CA ALA A 58 74.612 -6.895 17.501 1.00 0.00 C ATOM 890 C ALA A 58 75.209 -7.311 16.160 1.00 0.00 C ATOM 891 O ALA A 58 74.877 -8.368 15.624 1.00 0.00 O ATOM 892 CB ALA A 58 73.092 -7.050 17.454 1.00 0.00 C ATOM 0 H ALA A 58 74.257 -4.827 17.549 1.00 0.00 H new ATOM 0 HA ALA A 58 75.018 -7.538 18.282 1.00 0.00 H new ATOM 0 HB1 ALA A 58 72.839 -8.084 17.221 1.00 0.00 H new ATOM 0 HB2 ALA A 58 72.669 -6.782 18.422 1.00 0.00 H new ATOM 0 HB3 ALA A 58 72.683 -6.394 16.685 1.00 0.00 H new ATOM 898 N LYS A 59 76.092 -6.474 15.627 1.00 0.00 N ATOM 899 CA LYS A 59 76.731 -6.765 14.349 1.00 0.00 C ATOM 900 C LYS A 59 77.377 -8.147 14.374 1.00 0.00 C ATOM 901 O LYS A 59 78.462 -8.325 14.930 1.00 0.00 O ATOM 902 CB LYS A 59 77.793 -5.707 14.041 1.00 0.00 C ATOM 903 CG LYS A 59 78.845 -5.702 15.152 1.00 0.00 C ATOM 904 CD LYS A 59 79.359 -4.277 15.363 1.00 0.00 C ATOM 905 CE LYS A 59 80.045 -3.787 14.086 1.00 0.00 C ATOM 906 NZ LYS A 59 80.662 -2.453 14.334 1.00 0.00 N ATOM 0 H LYS A 59 76.380 -5.595 16.056 1.00 0.00 H new ATOM 0 HA LYS A 59 75.967 -6.748 13.571 1.00 0.00 H new ATOM 0 HB2 LYS A 59 78.264 -5.918 13.081 1.00 0.00 H new ATOM 0 HB3 LYS A 59 77.329 -4.724 13.960 1.00 0.00 H new ATOM 0 HG2 LYS A 59 78.414 -6.085 16.077 1.00 0.00 H new ATOM 0 HG3 LYS A 59 79.671 -6.362 14.888 1.00 0.00 H new ATOM 0 HD2 LYS A 59 78.532 -3.615 15.621 1.00 0.00 H new ATOM 0 HD3 LYS A 59 80.060 -4.252 16.197 1.00 0.00 H new ATOM 0 HE2 LYS A 59 80.808 -4.500 13.774 1.00 0.00 H new ATOM 0 HE3 LYS A 59 79.321 -3.719 13.274 1.00 0.00 H new ATOM 0 HZ1 LYS A 59 81.128 -2.120 13.466 1.00 0.00 H new ATOM 0 HZ2 LYS A 59 79.924 -1.775 14.613 1.00 0.00 H new ATOM 0 HZ3 LYS A 59 81.365 -2.532 15.096 1.00 0.00 H new ATOM 920 N GLY A 60 76.705 -9.120 13.770 1.00 0.00 N ATOM 921 CA GLY A 60 77.224 -10.483 13.730 1.00 0.00 C ATOM 922 C GLY A 60 76.477 -11.380 14.710 1.00 0.00 C ATOM 923 O GLY A 60 76.784 -12.564 14.841 1.00 0.00 O ATOM 0 H GLY A 60 75.806 -8.993 13.304 1.00 0.00 H new ATOM 0 HA2 GLY A 60 77.129 -10.883 12.720 1.00 0.00 H new ATOM 0 HA3 GLY A 60 78.287 -10.479 13.973 1.00 0.00 H new ATOM 927 N ARG A 61 75.493 -10.807 15.397 1.00 0.00 N ATOM 928 CA ARG A 61 74.707 -11.566 16.362 1.00 0.00 C ATOM 929 C ARG A 61 73.358 -11.956 15.768 1.00 0.00 C ATOM 930 O ARG A 61 73.006 -11.529 14.668 1.00 0.00 O ATOM 931 CB ARG A 61 74.487 -10.731 17.626 1.00 0.00 C ATOM 932 CG ARG A 61 75.841 -10.313 18.204 1.00 0.00 C ATOM 933 CD ARG A 61 75.667 -9.909 19.669 1.00 0.00 C ATOM 934 NE ARG A 61 76.862 -9.226 20.150 1.00 0.00 N ATOM 935 CZ ARG A 61 76.988 -8.874 21.425 1.00 0.00 C ATOM 936 NH1 ARG A 61 78.067 -8.263 21.831 1.00 0.00 N ATOM 937 NH2 ARG A 61 76.031 -9.140 22.272 1.00 0.00 N ATOM 0 H ARG A 61 75.223 -9.828 15.304 1.00 0.00 H new ATOM 0 HA ARG A 61 75.255 -12.474 16.615 1.00 0.00 H new ATOM 0 HB2 ARG A 61 73.891 -9.849 17.393 1.00 0.00 H new ATOM 0 HB3 ARG A 61 73.928 -11.308 18.363 1.00 0.00 H new ATOM 0 HG2 ARG A 61 76.552 -11.135 18.124 1.00 0.00 H new ATOM 0 HG3 ARG A 61 76.251 -9.481 17.632 1.00 0.00 H new ATOM 0 HD2 ARG A 61 74.800 -9.257 19.773 1.00 0.00 H new ATOM 0 HD3 ARG A 61 75.475 -10.793 20.277 1.00 0.00 H new ATOM 0 HE ARG A 61 77.615 -9.014 19.496 1.00 0.00 H new ATOM 0 HH11 ARG A 61 78.815 -8.055 21.169 1.00 0.00 H new ATOM 0 HH12 ARG A 61 78.163 -7.993 22.810 1.00 0.00 H new ATOM 0 HH21 ARG A 61 75.187 -9.618 21.955 1.00 0.00 H new ATOM 0 HH22 ARG A 61 76.127 -8.870 23.251 1.00 0.00 H new ATOM 951 N GLN A 62 72.607 -12.770 16.503 1.00 0.00 N ATOM 952 CA GLN A 62 71.297 -13.211 16.038 1.00 0.00 C ATOM 953 C GLN A 62 70.190 -12.406 16.711 1.00 0.00 C ATOM 954 O GLN A 62 70.299 -12.041 17.882 1.00 0.00 O ATOM 955 CB GLN A 62 71.107 -14.698 16.345 1.00 0.00 C ATOM 956 CG GLN A 62 71.969 -15.530 15.392 1.00 0.00 C ATOM 957 CD GLN A 62 71.936 -16.998 15.806 1.00 0.00 C ATOM 958 OE1 GLN A 62 71.776 -17.307 16.987 1.00 0.00 O ATOM 959 NE2 GLN A 62 72.078 -17.925 14.899 1.00 0.00 N ATOM 0 H GLN A 62 72.880 -13.135 17.415 1.00 0.00 H new ATOM 0 HA GLN A 62 71.243 -13.052 14.961 1.00 0.00 H new ATOM 0 HB2 GLN A 62 71.385 -14.905 17.378 1.00 0.00 H new ATOM 0 HB3 GLN A 62 70.058 -14.972 16.236 1.00 0.00 H new ATOM 0 HG2 GLN A 62 71.603 -15.423 14.371 1.00 0.00 H new ATOM 0 HG3 GLN A 62 72.995 -15.163 15.403 1.00 0.00 H new ATOM 0 HE21 GLN A 62 72.210 -17.666 13.921 1.00 0.00 H new ATOM 0 HE22 GLN A 62 72.057 -18.909 15.168 1.00 0.00 H new ATOM 968 N ILE A 63 69.126 -12.133 15.964 1.00 0.00 N ATOM 969 CA ILE A 63 68.004 -11.370 16.499 1.00 0.00 C ATOM 970 C ILE A 63 66.680 -12.040 16.145 1.00 0.00 C ATOM 971 O ILE A 63 66.617 -12.870 15.237 1.00 0.00 O ATOM 972 CB ILE A 63 68.024 -9.947 15.936 1.00 0.00 C ATOM 973 CG1 ILE A 63 67.819 -9.997 14.420 1.00 0.00 C ATOM 974 CG2 ILE A 63 69.373 -9.295 16.246 1.00 0.00 C ATOM 975 CD1 ILE A 63 67.793 -8.574 13.862 1.00 0.00 C ATOM 0 H ILE A 63 69.017 -12.426 14.993 1.00 0.00 H new ATOM 0 HA ILE A 63 68.100 -11.333 17.584 1.00 0.00 H new ATOM 0 HB ILE A 63 67.225 -9.364 16.393 1.00 0.00 H new ATOM 0 HG12 ILE A 63 68.621 -10.568 13.952 1.00 0.00 H new ATOM 0 HG13 ILE A 63 66.885 -10.508 14.185 1.00 0.00 H new ATOM 0 HG21 ILE A 63 69.388 -8.281 15.845 1.00 0.00 H new ATOM 0 HG22 ILE A 63 69.521 -9.261 17.325 1.00 0.00 H new ATOM 0 HG23 ILE A 63 70.172 -9.878 15.789 1.00 0.00 H new ATOM 0 HD11 ILE A 63 67.647 -8.609 12.782 1.00 0.00 H new ATOM 0 HD12 ILE A 63 66.975 -8.018 14.321 1.00 0.00 H new ATOM 0 HD13 ILE A 63 68.738 -8.079 14.084 1.00 0.00 H new ATOM 987 N GLU A 64 65.626 -11.676 16.867 1.00 0.00 N ATOM 988 CA GLU A 64 64.308 -12.249 16.619 1.00 0.00 C ATOM 989 C GLU A 64 63.296 -11.151 16.304 1.00 0.00 C ATOM 990 O GLU A 64 62.849 -10.431 17.198 1.00 0.00 O ATOM 991 CB GLU A 64 63.843 -13.038 17.844 1.00 0.00 C ATOM 992 CG GLU A 64 65.057 -13.634 18.559 1.00 0.00 C ATOM 993 CD GLU A 64 64.599 -14.563 19.678 1.00 0.00 C ATOM 994 OE1 GLU A 64 63.636 -14.224 20.345 1.00 0.00 O ATOM 995 OE2 GLU A 64 65.219 -15.599 19.853 1.00 0.00 O ATOM 0 H GLU A 64 65.657 -10.992 17.623 1.00 0.00 H new ATOM 0 HA GLU A 64 64.379 -12.918 15.761 1.00 0.00 H new ATOM 0 HB2 GLU A 64 63.292 -12.386 18.522 1.00 0.00 H new ATOM 0 HB3 GLU A 64 63.160 -13.832 17.541 1.00 0.00 H new ATOM 0 HG2 GLU A 64 65.674 -14.184 17.848 1.00 0.00 H new ATOM 0 HG3 GLU A 64 65.676 -12.836 18.968 1.00 0.00 H new ATOM 1002 N VAL A 65 62.940 -11.029 15.030 1.00 0.00 N ATOM 1003 CA VAL A 65 61.980 -10.015 14.609 1.00 0.00 C ATOM 1004 C VAL A 65 60.551 -10.518 14.798 1.00 0.00 C ATOM 1005 O VAL A 65 60.193 -11.593 14.316 1.00 0.00 O ATOM 1006 CB VAL A 65 62.207 -9.659 13.140 1.00 0.00 C ATOM 1007 CG1 VAL A 65 61.281 -8.509 12.743 1.00 0.00 C ATOM 1008 CG2 VAL A 65 63.663 -9.233 12.939 1.00 0.00 C ATOM 0 H VAL A 65 63.298 -11.615 14.276 1.00 0.00 H new ATOM 0 HA VAL A 65 62.125 -9.127 15.224 1.00 0.00 H new ATOM 0 HB VAL A 65 61.992 -10.528 12.519 1.00 0.00 H new ATOM 0 HG11 VAL A 65 61.444 -8.256 11.695 1.00 0.00 H new ATOM 0 HG12 VAL A 65 60.244 -8.811 12.886 1.00 0.00 H new ATOM 0 HG13 VAL A 65 61.495 -7.639 13.364 1.00 0.00 H new ATOM 0 HG21 VAL A 65 63.826 -8.979 11.892 1.00 0.00 H new ATOM 0 HG22 VAL A 65 63.877 -8.364 13.561 1.00 0.00 H new ATOM 0 HG23 VAL A 65 64.324 -10.053 13.221 1.00 0.00 H new ATOM 1018 N GLU A 66 59.741 -9.734 15.501 1.00 0.00 N ATOM 1019 CA GLU A 66 58.354 -10.110 15.747 1.00 0.00 C ATOM 1020 C GLU A 66 57.406 -9.062 15.176 1.00 0.00 C ATOM 1021 O GLU A 66 57.650 -7.860 15.291 1.00 0.00 O ATOM 1022 CB GLU A 66 58.112 -10.257 17.250 1.00 0.00 C ATOM 1023 CG GLU A 66 56.629 -10.538 17.503 1.00 0.00 C ATOM 1024 CD GLU A 66 56.422 -10.988 18.946 1.00 0.00 C ATOM 1025 OE1 GLU A 66 57.395 -11.022 19.680 1.00 0.00 O ATOM 1026 OE2 GLU A 66 55.293 -11.292 19.294 1.00 0.00 O ATOM 0 H GLU A 66 60.018 -8.841 15.908 1.00 0.00 H new ATOM 0 HA GLU A 66 58.162 -11.063 15.254 1.00 0.00 H new ATOM 0 HB2 GLU A 66 58.720 -11.069 17.649 1.00 0.00 H new ATOM 0 HB3 GLU A 66 58.414 -9.347 17.769 1.00 0.00 H new ATOM 0 HG2 GLU A 66 56.042 -9.641 17.305 1.00 0.00 H new ATOM 0 HG3 GLU A 66 56.274 -11.309 16.819 1.00 0.00 H new ATOM 1033 N ALA A 67 56.321 -9.523 14.562 1.00 0.00 N ATOM 1034 CA ALA A 67 55.341 -8.614 13.977 1.00 0.00 C ATOM 1035 C ALA A 67 53.924 -9.089 14.279 1.00 0.00 C ATOM 1036 O ALA A 67 53.597 -10.260 14.088 1.00 0.00 O ATOM 1037 CB ALA A 67 55.543 -8.534 12.462 1.00 0.00 C ATOM 0 H ALA A 67 56.099 -10.513 14.457 1.00 0.00 H new ATOM 0 HA ALA A 67 55.482 -7.626 14.415 1.00 0.00 H new ATOM 0 HB1 ALA A 67 54.808 -7.854 12.032 1.00 0.00 H new ATOM 0 HB2 ALA A 67 56.546 -8.166 12.248 1.00 0.00 H new ATOM 0 HB3 ALA A 67 55.419 -9.525 12.026 1.00 0.00 H new ATOM 1043 N THR A 68 53.086 -8.172 14.751 1.00 0.00 N ATOM 1044 CA THR A 68 51.704 -8.508 15.077 1.00 0.00 C ATOM 1045 C THR A 68 50.740 -7.569 14.358 1.00 0.00 C ATOM 1046 O THR A 68 50.908 -6.350 14.390 1.00 0.00 O ATOM 1047 CB THR A 68 51.485 -8.410 16.589 1.00 0.00 C ATOM 1048 OG1 THR A 68 52.436 -9.227 17.257 1.00 0.00 O ATOM 1049 CG2 THR A 68 50.071 -8.882 16.932 1.00 0.00 C ATOM 0 H THR A 68 53.337 -7.197 14.916 1.00 0.00 H new ATOM 0 HA THR A 68 51.511 -9.529 14.748 1.00 0.00 H new ATOM 0 HB THR A 68 51.607 -7.375 16.909 1.00 0.00 H new ATOM 0 HG1 THR A 68 52.462 -8.988 18.207 1.00 0.00 H new ATOM 0 HG21 THR A 68 49.915 -8.812 18.009 1.00 0.00 H new ATOM 0 HG22 THR A 68 49.343 -8.254 16.419 1.00 0.00 H new ATOM 0 HG23 THR A 68 49.946 -9.917 16.614 1.00 0.00 H new ATOM 1057 N GLY A 69 49.733 -8.145 13.712 1.00 0.00 N ATOM 1058 CA GLY A 69 48.748 -7.350 12.989 1.00 0.00 C ATOM 1059 C GLY A 69 48.368 -8.019 11.672 1.00 0.00 C ATOM 1060 O GLY A 69 49.055 -8.927 11.204 1.00 0.00 O ATOM 0 H GLY A 69 49.578 -9.152 13.674 1.00 0.00 H new ATOM 0 HA2 GLY A 69 47.858 -7.219 13.605 1.00 0.00 H new ATOM 0 HA3 GLY A 69 49.150 -6.356 12.794 1.00 0.00 H new ATOM 1064 N PRO A 70 47.293 -7.583 11.074 1.00 0.00 N ATOM 1065 CA PRO A 70 46.804 -8.143 9.782 1.00 0.00 C ATOM 1066 C PRO A 70 47.921 -8.263 8.748 1.00 0.00 C ATOM 1067 O PRO A 70 48.003 -9.253 8.022 1.00 0.00 O ATOM 1068 CB PRO A 70 45.745 -7.137 9.328 1.00 0.00 C ATOM 1069 CG PRO A 70 45.262 -6.476 10.576 1.00 0.00 C ATOM 1070 CD PRO A 70 46.425 -6.504 11.570 1.00 0.00 C ATOM 0 HA PRO A 70 46.415 -9.155 9.896 1.00 0.00 H new ATOM 0 HB2 PRO A 70 46.167 -6.408 8.636 1.00 0.00 H new ATOM 0 HB3 PRO A 70 44.928 -7.636 8.807 1.00 0.00 H new ATOM 0 HG2 PRO A 70 44.950 -5.451 10.375 1.00 0.00 H new ATOM 0 HG3 PRO A 70 44.395 -6.999 10.980 1.00 0.00 H new ATOM 0 HD2 PRO A 70 46.951 -5.549 11.596 1.00 0.00 H new ATOM 0 HD3 PRO A 70 46.079 -6.705 12.584 1.00 0.00 H new ATOM 1078 N GLN A 71 48.777 -7.248 8.689 1.00 0.00 N ATOM 1079 CA GLN A 71 49.885 -7.251 7.741 1.00 0.00 C ATOM 1080 C GLN A 71 51.187 -7.627 8.439 1.00 0.00 C ATOM 1081 O GLN A 71 52.275 -7.351 7.937 1.00 0.00 O ATOM 1082 CB GLN A 71 50.028 -5.869 7.101 1.00 0.00 C ATOM 1083 CG GLN A 71 48.780 -5.558 6.272 1.00 0.00 C ATOM 1084 CD GLN A 71 49.005 -5.963 4.819 1.00 0.00 C ATOM 1085 OE1 GLN A 71 49.119 -7.150 4.516 1.00 0.00 O ATOM 1086 NE2 GLN A 71 49.076 -5.042 3.898 1.00 0.00 N ATOM 0 H GLN A 71 48.726 -6.419 9.281 1.00 0.00 H new ATOM 0 HA GLN A 71 49.674 -7.990 6.968 1.00 0.00 H new ATOM 0 HB2 GLN A 71 50.163 -5.111 7.873 1.00 0.00 H new ATOM 0 HB3 GLN A 71 50.915 -5.840 6.468 1.00 0.00 H new ATOM 0 HG2 GLN A 71 47.921 -6.092 6.678 1.00 0.00 H new ATOM 0 HG3 GLN A 71 48.550 -4.494 6.330 1.00 0.00 H new ATOM 0 HE21 GLN A 71 48.981 -4.059 4.152 1.00 0.00 H new ATOM 0 HE22 GLN A 71 49.226 -5.305 2.924 1.00 0.00 H new ATOM 1095 N GLU A 72 51.067 -8.260 9.602 1.00 0.00 N ATOM 1096 CA GLU A 72 52.242 -8.671 10.362 1.00 0.00 C ATOM 1097 C GLU A 72 53.232 -9.405 9.462 1.00 0.00 C ATOM 1098 O GLU A 72 54.443 -9.216 9.574 1.00 0.00 O ATOM 1099 CB GLU A 72 51.826 -9.584 11.516 1.00 0.00 C ATOM 1100 CG GLU A 72 51.343 -10.925 10.958 1.00 0.00 C ATOM 1101 CD GLU A 72 50.718 -11.759 12.071 1.00 0.00 C ATOM 1102 OE1 GLU A 72 50.698 -11.289 13.198 1.00 0.00 O ATOM 1103 OE2 GLU A 72 50.268 -12.856 11.783 1.00 0.00 O ATOM 0 H GLU A 72 50.175 -8.498 10.036 1.00 0.00 H new ATOM 0 HA GLU A 72 52.723 -7.778 10.761 1.00 0.00 H new ATOM 0 HB2 GLU A 72 52.667 -9.741 12.191 1.00 0.00 H new ATOM 0 HB3 GLU A 72 51.034 -9.114 12.098 1.00 0.00 H new ATOM 0 HG2 GLU A 72 50.614 -10.757 10.165 1.00 0.00 H new ATOM 0 HG3 GLU A 72 52.179 -11.465 10.513 1.00 0.00 H new ATOM 1110 N GLU A 73 52.708 -10.240 8.572 1.00 0.00 N ATOM 1111 CA GLU A 73 53.556 -10.997 7.658 1.00 0.00 C ATOM 1112 C GLU A 73 54.293 -10.057 6.709 1.00 0.00 C ATOM 1113 O GLU A 73 55.506 -10.170 6.527 1.00 0.00 O ATOM 1114 CB GLU A 73 52.706 -11.978 6.849 1.00 0.00 C ATOM 1115 CG GLU A 73 52.113 -13.033 7.784 1.00 0.00 C ATOM 1116 CD GLU A 73 51.392 -14.104 6.973 1.00 0.00 C ATOM 1117 OE1 GLU A 73 51.439 -14.029 5.756 1.00 0.00 O ATOM 1118 OE2 GLU A 73 50.803 -14.983 7.579 1.00 0.00 O ATOM 0 H GLU A 73 51.708 -10.409 8.464 1.00 0.00 H new ATOM 0 HA GLU A 73 54.289 -11.550 8.245 1.00 0.00 H new ATOM 0 HB2 GLU A 73 51.908 -11.444 6.333 1.00 0.00 H new ATOM 0 HB3 GLU A 73 53.315 -12.457 6.083 1.00 0.00 H new ATOM 0 HG2 GLU A 73 52.904 -13.488 8.380 1.00 0.00 H new ATOM 0 HG3 GLU A 73 51.418 -12.564 8.481 1.00 0.00 H new ATOM 1125 N GLU A 74 53.554 -9.132 6.108 1.00 0.00 N ATOM 1126 CA GLU A 74 54.149 -8.177 5.179 1.00 0.00 C ATOM 1127 C GLU A 74 55.317 -7.448 5.834 1.00 0.00 C ATOM 1128 O GLU A 74 56.410 -7.374 5.271 1.00 0.00 O ATOM 1129 CB GLU A 74 53.098 -7.162 4.729 1.00 0.00 C ATOM 1130 CG GLU A 74 53.609 -6.406 3.501 1.00 0.00 C ATOM 1131 CD GLU A 74 53.886 -7.385 2.365 1.00 0.00 C ATOM 1132 OE1 GLU A 74 53.392 -8.497 2.434 1.00 0.00 O ATOM 1133 OE2 GLU A 74 54.588 -7.007 1.441 1.00 0.00 O ATOM 0 H GLU A 74 52.549 -9.022 6.245 1.00 0.00 H new ATOM 0 HA GLU A 74 54.519 -8.725 4.312 1.00 0.00 H new ATOM 0 HB2 GLU A 74 52.164 -7.671 4.493 1.00 0.00 H new ATOM 0 HB3 GLU A 74 52.884 -6.462 5.537 1.00 0.00 H new ATOM 0 HG2 GLU A 74 52.872 -5.668 3.185 1.00 0.00 H new ATOM 0 HG3 GLU A 74 54.519 -5.860 3.752 1.00 0.00 H new ATOM 1140 N ALA A 75 55.080 -6.911 7.027 1.00 0.00 N ATOM 1141 CA ALA A 75 56.120 -6.190 7.750 1.00 0.00 C ATOM 1142 C ALA A 75 57.361 -7.061 7.911 1.00 0.00 C ATOM 1143 O ALA A 75 58.481 -6.617 7.653 1.00 0.00 O ATOM 1144 CB ALA A 75 55.605 -5.772 9.129 1.00 0.00 C ATOM 0 H ALA A 75 54.183 -6.961 7.510 1.00 0.00 H new ATOM 0 HA ALA A 75 56.385 -5.301 7.177 1.00 0.00 H new ATOM 0 HB1 ALA A 75 56.389 -5.234 9.662 1.00 0.00 H new ATOM 0 HB2 ALA A 75 54.736 -5.125 9.012 1.00 0.00 H new ATOM 0 HB3 ALA A 75 55.323 -6.659 9.696 1.00 0.00 H new ATOM 1150 N LEU A 76 57.156 -8.302 8.339 1.00 0.00 N ATOM 1151 CA LEU A 76 58.268 -9.227 8.530 1.00 0.00 C ATOM 1152 C LEU A 76 58.984 -9.484 7.208 1.00 0.00 C ATOM 1153 O LEU A 76 60.213 -9.492 7.148 1.00 0.00 O ATOM 1154 CB LEU A 76 57.753 -10.552 9.099 1.00 0.00 C ATOM 1155 CG LEU A 76 58.937 -11.414 9.536 1.00 0.00 C ATOM 1156 CD1 LEU A 76 59.314 -11.073 10.979 1.00 0.00 C ATOM 1157 CD2 LEU A 76 58.550 -12.892 9.448 1.00 0.00 C ATOM 0 H LEU A 76 56.238 -8.689 8.559 1.00 0.00 H new ATOM 0 HA LEU A 76 58.972 -8.779 9.231 1.00 0.00 H new ATOM 0 HB2 LEU A 76 57.094 -10.364 9.947 1.00 0.00 H new ATOM 0 HB3 LEU A 76 57.164 -11.078 8.348 1.00 0.00 H new ATOM 0 HG LEU A 76 59.788 -11.219 8.883 1.00 0.00 H new ATOM 0 HD11 LEU A 76 60.158 -11.688 11.290 1.00 0.00 H new ATOM 0 HD12 LEU A 76 59.589 -10.020 11.044 1.00 0.00 H new ATOM 0 HD13 LEU A 76 58.464 -11.267 11.633 1.00 0.00 H new ATOM 0 HD21 LEU A 76 59.394 -13.508 9.759 1.00 0.00 H new ATOM 0 HD22 LEU A 76 57.699 -13.085 10.101 1.00 0.00 H new ATOM 0 HD23 LEU A 76 58.281 -13.137 8.420 1.00 0.00 H new ATOM 1169 N ALA A 77 58.206 -9.692 6.150 1.00 0.00 N ATOM 1170 CA ALA A 77 58.778 -9.948 4.833 1.00 0.00 C ATOM 1171 C ALA A 77 59.617 -8.759 4.375 1.00 0.00 C ATOM 1172 O ALA A 77 60.709 -8.931 3.831 1.00 0.00 O ATOM 1173 CB ALA A 77 57.661 -10.206 3.821 1.00 0.00 C ATOM 0 H ALA A 77 57.186 -9.688 6.178 1.00 0.00 H new ATOM 0 HA ALA A 77 59.419 -10.827 4.899 1.00 0.00 H new ATOM 0 HB1 ALA A 77 58.096 -10.396 2.840 1.00 0.00 H new ATOM 0 HB2 ALA A 77 57.079 -11.073 4.134 1.00 0.00 H new ATOM 0 HB3 ALA A 77 57.011 -9.333 3.766 1.00 0.00 H new ATOM 1179 N ALA A 78 59.102 -7.555 4.599 1.00 0.00 N ATOM 1180 CA ALA A 78 59.814 -6.345 4.205 1.00 0.00 C ATOM 1181 C ALA A 78 61.143 -6.241 4.947 1.00 0.00 C ATOM 1182 O ALA A 78 62.172 -5.918 4.353 1.00 0.00 O ATOM 1183 CB ALA A 78 58.959 -5.113 4.510 1.00 0.00 C ATOM 0 H ALA A 78 58.201 -7.391 5.048 1.00 0.00 H new ATOM 0 HA ALA A 78 60.011 -6.394 3.134 1.00 0.00 H new ATOM 0 HB1 ALA A 78 59.498 -4.213 4.213 1.00 0.00 H new ATOM 0 HB2 ALA A 78 58.022 -5.174 3.956 1.00 0.00 H new ATOM 0 HB3 ALA A 78 58.747 -5.073 5.578 1.00 0.00 H new ATOM 1189 N VAL A 79 61.113 -6.519 6.246 1.00 0.00 N ATOM 1190 CA VAL A 79 62.321 -6.454 7.059 1.00 0.00 C ATOM 1191 C VAL A 79 63.300 -7.549 6.648 1.00 0.00 C ATOM 1192 O VAL A 79 64.501 -7.305 6.517 1.00 0.00 O ATOM 1193 CB VAL A 79 61.967 -6.614 8.538 1.00 0.00 C ATOM 1194 CG1 VAL A 79 63.237 -6.511 9.382 1.00 0.00 C ATOM 1195 CG2 VAL A 79 60.992 -5.507 8.949 1.00 0.00 C ATOM 0 H VAL A 79 60.272 -6.790 6.755 1.00 0.00 H new ATOM 0 HA VAL A 79 62.790 -5.483 6.902 1.00 0.00 H new ATOM 0 HB VAL A 79 61.504 -7.588 8.697 1.00 0.00 H new ATOM 0 HG11 VAL A 79 62.984 -6.625 10.436 1.00 0.00 H new ATOM 0 HG12 VAL A 79 63.933 -7.297 9.089 1.00 0.00 H new ATOM 0 HG13 VAL A 79 63.701 -5.537 9.224 1.00 0.00 H new ATOM 0 HG21 VAL A 79 60.738 -5.619 10.003 1.00 0.00 H new ATOM 0 HG22 VAL A 79 61.457 -4.534 8.789 1.00 0.00 H new ATOM 0 HG23 VAL A 79 60.086 -5.579 8.348 1.00 0.00 H new ATOM 1205 N ILE A 80 62.780 -8.755 6.443 1.00 0.00 N ATOM 1206 CA ILE A 80 63.618 -9.880 6.046 1.00 0.00 C ATOM 1207 C ILE A 80 64.219 -9.637 4.665 1.00 0.00 C ATOM 1208 O ILE A 80 65.380 -9.962 4.416 1.00 0.00 O ATOM 1209 CB ILE A 80 62.792 -11.167 6.025 1.00 0.00 C ATOM 1210 CG1 ILE A 80 62.524 -11.621 7.462 1.00 0.00 C ATOM 1211 CG2 ILE A 80 63.562 -12.258 5.281 1.00 0.00 C ATOM 1212 CD1 ILE A 80 61.551 -12.802 7.452 1.00 0.00 C ATOM 0 H ILE A 80 61.790 -8.977 6.544 1.00 0.00 H new ATOM 0 HA ILE A 80 64.426 -9.980 6.771 1.00 0.00 H new ATOM 0 HB ILE A 80 61.845 -10.983 5.517 1.00 0.00 H new ATOM 0 HG12 ILE A 80 63.458 -11.910 7.943 1.00 0.00 H new ATOM 0 HG13 ILE A 80 62.107 -10.798 8.043 1.00 0.00 H new ATOM 0 HG21 ILE A 80 62.972 -13.174 5.267 1.00 0.00 H new ATOM 0 HG22 ILE A 80 63.754 -11.934 4.258 1.00 0.00 H new ATOM 0 HG23 ILE A 80 64.509 -12.444 5.787 1.00 0.00 H new ATOM 0 HD11 ILE A 80 61.360 -13.125 8.475 1.00 0.00 H new ATOM 0 HD12 ILE A 80 60.613 -12.497 6.987 1.00 0.00 H new ATOM 0 HD13 ILE A 80 61.985 -13.626 6.886 1.00 0.00 H new ATOM 1224 N ALA A 81 63.421 -9.063 3.771 1.00 0.00 N ATOM 1225 CA ALA A 81 63.885 -8.779 2.418 1.00 0.00 C ATOM 1226 C ALA A 81 65.031 -7.774 2.446 1.00 0.00 C ATOM 1227 O ALA A 81 65.973 -7.869 1.660 1.00 0.00 O ATOM 1228 CB ALA A 81 62.735 -8.222 1.578 1.00 0.00 C ATOM 0 H ALA A 81 62.457 -8.787 3.957 1.00 0.00 H new ATOM 0 HA ALA A 81 64.242 -9.708 1.973 1.00 0.00 H new ATOM 0 HB1 ALA A 81 63.090 -8.012 0.569 1.00 0.00 H new ATOM 0 HB2 ALA A 81 61.928 -8.954 1.534 1.00 0.00 H new ATOM 0 HB3 ALA A 81 62.366 -7.302 2.031 1.00 0.00 H new ATOM 1234 N LEU A 82 64.945 -6.811 3.359 1.00 0.00 N ATOM 1235 CA LEU A 82 65.981 -5.794 3.483 1.00 0.00 C ATOM 1236 C LEU A 82 67.265 -6.403 4.036 1.00 0.00 C ATOM 1237 O LEU A 82 68.363 -6.079 3.584 1.00 0.00 O ATOM 1238 CB LEU A 82 65.506 -4.672 4.408 1.00 0.00 C ATOM 1239 CG LEU A 82 64.492 -3.797 3.670 1.00 0.00 C ATOM 1240 CD1 LEU A 82 63.781 -2.883 4.670 1.00 0.00 C ATOM 1241 CD2 LEU A 82 65.219 -2.942 2.629 1.00 0.00 C ATOM 0 H LEU A 82 64.174 -6.715 4.019 1.00 0.00 H new ATOM 0 HA LEU A 82 66.183 -5.386 2.493 1.00 0.00 H new ATOM 0 HB2 LEU A 82 65.053 -5.093 5.306 1.00 0.00 H new ATOM 0 HB3 LEU A 82 66.355 -4.069 4.732 1.00 0.00 H new ATOM 0 HG LEU A 82 63.759 -4.433 3.173 1.00 0.00 H new ATOM 0 HD11 LEU A 82 63.058 -2.260 4.143 1.00 0.00 H new ATOM 0 HD12 LEU A 82 63.263 -3.490 5.413 1.00 0.00 H new ATOM 0 HD13 LEU A 82 64.514 -2.248 5.167 1.00 0.00 H new ATOM 0 HD21 LEU A 82 64.497 -2.318 2.102 1.00 0.00 H new ATOM 0 HD22 LEU A 82 65.952 -2.307 3.127 1.00 0.00 H new ATOM 0 HD23 LEU A 82 65.726 -3.591 1.915 1.00 0.00 H new ATOM 1253 N PHE A 83 67.118 -7.289 5.015 1.00 0.00 N ATOM 1254 CA PHE A 83 68.273 -7.939 5.624 1.00 0.00 C ATOM 1255 C PHE A 83 68.915 -8.915 4.643 1.00 0.00 C ATOM 1256 O PHE A 83 70.125 -9.142 4.679 1.00 0.00 O ATOM 1257 CB PHE A 83 67.846 -8.689 6.887 1.00 0.00 C ATOM 1258 CG PHE A 83 67.292 -7.709 7.892 1.00 0.00 C ATOM 1259 CD1 PHE A 83 67.187 -6.352 7.562 1.00 0.00 C ATOM 1260 CD2 PHE A 83 66.885 -8.156 9.155 1.00 0.00 C ATOM 1261 CE1 PHE A 83 66.674 -5.443 8.495 1.00 0.00 C ATOM 1262 CE2 PHE A 83 66.372 -7.247 10.088 1.00 0.00 C ATOM 1263 CZ PHE A 83 66.266 -5.890 9.758 1.00 0.00 C ATOM 0 H PHE A 83 66.218 -7.572 5.402 1.00 0.00 H new ATOM 0 HA PHE A 83 69.001 -7.172 5.887 1.00 0.00 H new ATOM 0 HB2 PHE A 83 67.093 -9.438 6.641 1.00 0.00 H new ATOM 0 HB3 PHE A 83 68.697 -9.220 7.313 1.00 0.00 H new ATOM 0 HD1 PHE A 83 67.502 -6.007 6.588 1.00 0.00 H new ATOM 0 HD2 PHE A 83 66.967 -9.202 9.409 1.00 0.00 H new ATOM 0 HE1 PHE A 83 66.593 -4.397 8.241 1.00 0.00 H new ATOM 0 HE2 PHE A 83 66.058 -7.592 11.062 1.00 0.00 H new ATOM 0 HZ PHE A 83 65.870 -5.189 10.477 1.00 0.00 H new ATOM 1273 N ASN A 84 68.097 -9.490 3.768 1.00 0.00 N ATOM 1274 CA ASN A 84 68.594 -10.441 2.780 1.00 0.00 C ATOM 1275 C ASN A 84 69.117 -9.709 1.548 1.00 0.00 C ATOM 1276 O ASN A 84 69.617 -10.331 0.611 1.00 0.00 O ATOM 1277 CB ASN A 84 67.477 -11.401 2.370 1.00 0.00 C ATOM 1278 CG ASN A 84 68.012 -12.434 1.385 1.00 0.00 C ATOM 1279 OD1 ASN A 84 69.215 -12.696 1.350 1.00 0.00 O ATOM 1280 ND2 ASN A 84 67.187 -13.040 0.576 1.00 0.00 N ATOM 0 H ASN A 84 67.093 -9.316 3.722 1.00 0.00 H new ATOM 0 HA ASN A 84 69.412 -11.006 3.227 1.00 0.00 H new ATOM 0 HB2 ASN A 84 67.075 -11.901 3.251 1.00 0.00 H new ATOM 0 HB3 ASN A 84 66.657 -10.845 1.916 1.00 0.00 H new ATOM 0 HD21 ASN A 84 67.538 -13.732 -0.086 1.00 0.00 H new ATOM 0 HD22 ASN A 84 66.191 -12.822 0.606 1.00 0.00 H new ATOM 1287 N SER A 85 68.998 -8.386 1.558 1.00 0.00 N ATOM 1288 CA SER A 85 69.462 -7.579 0.435 1.00 0.00 C ATOM 1289 C SER A 85 70.396 -6.474 0.919 1.00 0.00 C ATOM 1290 O SER A 85 70.795 -5.662 0.101 1.00 0.00 O ATOM 1291 CB SER A 85 68.268 -6.958 -0.290 1.00 0.00 C ATOM 1292 OG SER A 85 68.739 -6.069 -1.294 1.00 0.00 O ATOM 1293 OXT SER A 85 70.697 -6.456 2.101 1.00 0.00 O ATOM 0 H SER A 85 68.588 -7.853 2.325 1.00 0.00 H new ATOM 0 HA SER A 85 70.008 -8.226 -0.252 1.00 0.00 H new ATOM 0 HB2 SER A 85 67.654 -7.739 -0.738 1.00 0.00 H new ATOM 0 HB3 SER A 85 67.636 -6.423 0.418 1.00 0.00 H new ATOM 0 HG SER A 85 69.482 -5.538 -0.938 1.00 0.00 H new TER 1299 SER A 85