USER MOD reduce.3.24.130724 H: found=0, std=0, add=1144, rem=0, adj=36 USER MOD reduce.3.24.130724 removed 1143 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 147 SER OG : rot -101:sc= 0.697 USER MOD Set 1.2: A 149 ASN : amide:sc= 0.127 K(o=0.82,f=-2.6!) USER MOD Set 2.1: A 131 LYS NZ :NH3+ 154:sc= -0.0772 (180deg=-0.431) USER MOD Set 2.2: A 133 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Set 3.1: A 115 CYS SG : rot 15:sc= 0.408 USER MOD Set 3.2: A 119 THR OG1 : rot -128:sc= -0.434 USER MOD Set 4.1: A 102 ASN :FLIP amide:sc= -0.951 F(o=-2.5,f=-1.8) USER MOD Set 4.2: A 111 GLN : amide:sc= -0.812 K(o=-1.8,f=-8.1!) USER MOD Set 5.1: A 61 MET CE :methyl -163:sc= -1.84 (180deg=-2.24) USER MOD Set 5.2: A 63 GLN : amide:sc= -0.0748 K(o=-1.9,f=-4.2) USER MOD Single : A 3 ASN : amide:sc= -1.21 K(o=-1.2,f=-10!) USER MOD Single : A 5 THR OG1 : rot 180:sc= 0 USER MOD Single : A 21 SER OG : rot -153:sc= -3.54 USER MOD Single : A 28 LYS NZ :NH3+ -169:sc= -0.0438 (180deg=-0.267) USER MOD Single : A 31 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 32 THR OG1 : rot 180:sc= 0 USER MOD Single : A 35 ASN : amide:sc= -2.18 K(o=-2.2,f=-8.7!) USER MOD Single : A 40 SER OG : rot 85:sc= 1.08 USER MOD Single : A 41 THR OG1 : rot -79:sc= -0.252 USER MOD Single : A 44 LYS NZ :NH3+ -174:sc= -0.91 (180deg=-0.928) USER MOD Single : A 48 TYR OH : rot 180:sc= 0 USER MOD Single : A 49 LYS NZ :NH3+ -168:sc= 0.448 (180deg=0.355) USER MOD Single : A 51 SER OG : rot 180:sc= 0 USER MOD Single : A 52 CYS SG : rot 33:sc= 0.0697 USER MOD Single : A 54 HIS : no HD1:sc= -0.301 X(o=-0.3,f=-0.13) USER MOD Single : A 62 CYS SG : rot -86:sc= 0.0545 USER MOD Single : A 79 TYR OH : rot 180:sc= 0 USER MOD Single : A 82 LYS NZ :NH3+ 178:sc= -0.685 (180deg=-0.695) USER MOD Single : A 87 ASN : amide:sc= -1.7 K(o=-1.7,f=-8.5!) USER MOD Single : A 91 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 92 HIS : no HD1:sc= -0.618 K(o=-0.62,f=-3.9!) USER MOD Single : A 93 THR OG1 : rot 180:sc= 0.0072 USER MOD Single : A 99 SER OG : rot -8:sc= -0.308 USER MOD Single : A 100 MET CE :methyl -131:sc= -1.99 (180deg=-7.41!) USER MOD Single : A 106 ASN : amide:sc= -1.75 K(o=-1.8,f=-8.4!) USER MOD Single : A 107 THR OG1 : rot -72:sc= 0.0972 USER MOD Single : A 108 ASN : amide:sc= -0.378 X(o=-0.38,f=-0.54) USER MOD Single : A 110 SER OG : rot 68:sc= 0.388 USER MOD Single : A 116 THR OG1 : rot 180:sc= 0 USER MOD Single : A 118 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 125 LYS NZ :NH3+ 167:sc= -0.0128 (180deg=-0.214) USER MOD Single : A 126 HIS : no HE2:sc= -3.01 K(o=-3,f=-6.8!) USER MOD Single : A 136 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 137 ASN : amide:sc= -0.453 K(o=-0.45,f=-1) USER MOD Single : A 142 MET CE :methyl -165:sc= 0 (180deg=-0.227) USER MOD Single : A 151 LYS NZ :NH3+ -161:sc=-0.00329 (180deg=-0.128) USER MOD Single : A 152 THR OG1 : rot 84:sc= 0.319 USER MOD Single : A 153 SER OG : rot 180:sc= 0 USER MOD Single : A 154 LYS NZ :NH3+ -176:sc= 0.415 (180deg=0.409) USER MOD Single : A 155 LYS NZ :NH3+ 172:sc= 0 (180deg=-0.0502) USER MOD Single : A 157 THR OG1 : rot 180:sc= 0 USER MOD Single : A 161 CYS SG : rot 180:sc= -1.98 USER MOD Single : A 163 GLN : amide:sc= -0.775 K(o=-0.78,f=-4.8!) USER MOD ----------------------------------------------------------------- ATOM 18 N VAL A 2 5.416 3.653 -2.495 1.00 0.51 N ATOM 19 CA VAL A 2 4.915 3.936 -1.155 1.00 63.20 C ATOM 20 C VAL A 2 4.004 5.158 -1.155 1.00 75.33 C ATOM 21 O VAL A 2 4.087 6.006 -2.042 1.00 13.52 O ATOM 22 CB VAL A 2 6.069 4.170 -0.162 1.00 44.34 C ATOM 23 CG1 VAL A 2 6.596 5.592 -0.282 1.00 43.11 C ATOM 24 CG2 VAL A 2 5.616 3.879 1.260 1.00 15.11 C ATOM 0 HA VAL A 2 4.345 3.062 -0.839 1.00 63.20 H new ATOM 0 HB VAL A 2 6.881 3.485 -0.407 1.00 44.34 H new ATOM 0 HG11 VAL A 2 7.411 5.739 0.427 1.00 43.11 H new ATOM 0 HG12 VAL A 2 6.962 5.760 -1.295 1.00 43.11 H new ATOM 0 HG13 VAL A 2 5.794 6.297 -0.064 1.00 43.11 H new ATOM 0 HG21 VAL A 2 6.444 4.050 1.948 1.00 15.11 H new ATOM 0 HG22 VAL A 2 4.787 4.537 1.520 1.00 15.11 H new ATOM 0 HG23 VAL A 2 5.292 2.841 1.333 1.00 15.11 H new ATOM 34 N ASN A 3 3.133 5.240 -0.154 1.00 43.00 N ATOM 35 CA ASN A 3 2.205 6.359 -0.038 1.00 71.24 C ATOM 36 C ASN A 3 2.944 7.690 -0.125 1.00 4.50 C ATOM 37 O ASN A 3 4.122 7.798 0.217 1.00 1.44 O ATOM 38 CB ASN A 3 1.435 6.275 1.281 1.00 52.20 C ATOM 39 CG ASN A 3 0.127 5.520 1.140 1.00 23.24 C ATOM 40 OD1 ASN A 3 -0.675 5.806 0.252 1.00 73.02 O ATOM 41 ND2 ASN A 3 -0.093 4.549 2.020 1.00 45.24 N ATOM 0 H ASN A 3 3.051 4.545 0.588 1.00 43.00 H new ATOM 0 HA ASN A 3 1.500 6.301 -0.867 1.00 71.24 H new ATOM 0 HB2 ASN A 3 2.056 5.784 2.030 1.00 52.20 H new ATOM 0 HB3 ASN A 3 1.233 7.282 1.645 1.00 52.20 H new ATOM 0 HD21 ASN A 3 -0.955 4.006 1.976 1.00 45.24 H new ATOM 0 HD22 ASN A 3 0.601 4.346 2.740 1.00 45.24 H new ATOM 48 N PRO A 4 2.238 8.730 -0.593 1.00 51.21 N ATOM 49 CA PRO A 4 2.806 10.074 -0.735 1.00 24.13 C ATOM 50 C PRO A 4 3.072 10.736 0.613 1.00 24.31 C ATOM 51 O PRO A 4 2.334 10.527 1.576 1.00 21.53 O ATOM 52 CB PRO A 4 1.724 10.838 -1.501 1.00 51.01 C ATOM 53 CG PRO A 4 0.457 10.122 -1.183 1.00 21.33 C ATOM 54 CD PRO A 4 0.830 8.674 -1.020 1.00 13.01 C ATOM 0 HA PRO A 4 3.772 10.057 -1.239 1.00 24.13 H new ATOM 0 HB2 PRO A 4 1.679 11.881 -1.187 1.00 51.01 H new ATOM 0 HB3 PRO A 4 1.922 10.836 -2.573 1.00 51.01 H new ATOM 0 HG2 PRO A 4 0.005 10.514 -0.272 1.00 21.33 H new ATOM 0 HG3 PRO A 4 -0.274 10.249 -1.981 1.00 21.33 H new ATOM 0 HD2 PRO A 4 0.204 8.179 -0.277 1.00 13.01 H new ATOM 0 HD3 PRO A 4 0.715 8.122 -1.953 1.00 13.01 H new ATOM 62 N THR A 5 4.132 11.536 0.675 1.00 0.34 N ATOM 63 CA THR A 5 4.496 12.228 1.905 1.00 11.33 C ATOM 64 C THR A 5 4.852 13.685 1.632 1.00 42.02 C ATOM 65 O THR A 5 5.480 14.002 0.621 1.00 35.00 O ATOM 66 CB THR A 5 5.685 11.543 2.605 1.00 42.34 C ATOM 67 OG1 THR A 5 5.221 10.446 3.399 1.00 73.03 O ATOM 68 CG2 THR A 5 6.437 12.530 3.485 1.00 41.33 C ATOM 0 H THR A 5 4.753 11.721 -0.112 1.00 0.34 H new ATOM 0 HA THR A 5 3.626 12.186 2.560 1.00 11.33 H new ATOM 0 HB THR A 5 6.365 11.173 1.838 1.00 42.34 H new ATOM 0 HG1 THR A 5 5.983 10.015 3.839 1.00 73.03 H new ATOM 0 HG21 THR A 5 7.272 12.023 3.969 1.00 41.33 H new ATOM 0 HG22 THR A 5 6.815 13.349 2.873 1.00 41.33 H new ATOM 0 HG23 THR A 5 5.764 12.926 4.245 1.00 41.33 H new ATOM 76 N VAL A 6 4.449 14.569 2.539 1.00 32.43 N ATOM 77 CA VAL A 6 4.727 15.993 2.396 1.00 24.44 C ATOM 78 C VAL A 6 5.232 16.588 3.706 1.00 22.21 C ATOM 79 O VAL A 6 4.789 16.202 4.788 1.00 73.33 O ATOM 80 CB VAL A 6 3.476 16.767 1.942 1.00 33.32 C ATOM 81 CG1 VAL A 6 2.407 15.807 1.442 1.00 14.22 C ATOM 82 CG2 VAL A 6 2.942 17.628 3.076 1.00 10.55 C ATOM 0 H VAL A 6 3.929 14.324 3.381 1.00 32.43 H new ATOM 0 HA VAL A 6 5.500 16.089 1.634 1.00 24.44 H new ATOM 0 HB VAL A 6 3.755 17.424 1.118 1.00 33.32 H new ATOM 0 HG11 VAL A 6 1.530 16.372 1.125 1.00 14.22 H new ATOM 0 HG12 VAL A 6 2.796 15.237 0.598 1.00 14.22 H new ATOM 0 HG13 VAL A 6 2.128 15.123 2.244 1.00 14.22 H new ATOM 0 HG21 VAL A 6 2.058 18.168 2.737 1.00 10.55 H new ATOM 0 HG22 VAL A 6 2.678 16.993 3.922 1.00 10.55 H new ATOM 0 HG23 VAL A 6 3.707 18.341 3.383 1.00 10.55 H new ATOM 92 N PHE A 7 6.162 17.531 3.601 1.00 5.02 N ATOM 93 CA PHE A 7 6.729 18.180 4.778 1.00 52.43 C ATOM 94 C PHE A 7 6.118 19.563 4.983 1.00 55.32 C ATOM 95 O PHE A 7 5.547 20.145 4.060 1.00 13.21 O ATOM 96 CB PHE A 7 8.248 18.297 4.640 1.00 42.30 C ATOM 97 CG PHE A 7 8.684 19.402 3.721 1.00 55.44 C ATOM 98 CD1 PHE A 7 8.849 20.693 4.197 1.00 52.10 C ATOM 99 CD2 PHE A 7 8.928 19.151 2.380 1.00 20.43 C ATOM 100 CE1 PHE A 7 9.248 21.712 3.353 1.00 65.21 C ATOM 101 CE2 PHE A 7 9.328 20.165 1.531 1.00 4.44 C ATOM 102 CZ PHE A 7 9.490 21.447 2.019 1.00 52.52 C ATOM 0 H PHE A 7 6.539 17.863 2.713 1.00 5.02 H new ATOM 0 HA PHE A 7 6.496 17.566 5.648 1.00 52.43 H new ATOM 0 HB2 PHE A 7 8.682 18.463 5.626 1.00 42.30 H new ATOM 0 HB3 PHE A 7 8.645 17.351 4.272 1.00 42.30 H new ATOM 0 HD1 PHE A 7 8.664 20.905 5.240 1.00 52.10 H new ATOM 0 HD2 PHE A 7 8.804 18.150 1.994 1.00 20.43 H new ATOM 0 HE1 PHE A 7 9.370 22.714 3.736 1.00 65.21 H new ATOM 0 HE2 PHE A 7 9.514 19.956 0.488 1.00 4.44 H new ATOM 0 HZ PHE A 7 9.805 22.241 1.359 1.00 52.52 H new ATOM 112 N PHE A 8 6.241 20.084 6.199 1.00 31.44 N ATOM 113 CA PHE A 8 5.700 21.397 6.528 1.00 54.35 C ATOM 114 C PHE A 8 6.654 22.168 7.435 1.00 23.30 C ATOM 115 O PHE A 8 6.639 22.000 8.655 1.00 45.24 O ATOM 116 CB PHE A 8 4.336 21.255 7.206 1.00 13.44 C ATOM 117 CG PHE A 8 3.178 21.496 6.281 1.00 55.30 C ATOM 118 CD1 PHE A 8 2.934 20.642 5.218 1.00 61.14 C ATOM 119 CD2 PHE A 8 2.332 22.577 6.475 1.00 71.44 C ATOM 120 CE1 PHE A 8 1.869 20.862 4.364 1.00 25.11 C ATOM 121 CE2 PHE A 8 1.265 22.801 5.625 1.00 44.44 C ATOM 122 CZ PHE A 8 1.033 21.942 4.569 1.00 44.14 C ATOM 0 H PHE A 8 6.711 19.616 6.974 1.00 31.44 H new ATOM 0 HA PHE A 8 5.580 21.955 5.599 1.00 54.35 H new ATOM 0 HB2 PHE A 8 4.251 20.253 7.627 1.00 13.44 H new ATOM 0 HB3 PHE A 8 4.278 21.957 8.038 1.00 13.44 H new ATOM 0 HD1 PHE A 8 3.583 19.795 5.054 1.00 61.14 H new ATOM 0 HD2 PHE A 8 2.509 23.252 7.300 1.00 71.44 H new ATOM 0 HE1 PHE A 8 1.691 20.190 3.538 1.00 25.11 H new ATOM 0 HE2 PHE A 8 0.613 23.647 5.787 1.00 44.44 H new ATOM 0 HZ PHE A 8 0.199 22.114 3.905 1.00 44.14 H new ATOM 132 N ASP A 9 7.483 23.012 6.831 1.00 64.42 N ATOM 133 CA ASP A 9 8.445 23.809 7.583 1.00 23.31 C ATOM 134 C ASP A 9 7.737 24.693 8.604 1.00 2.44 C ATOM 135 O ASP A 9 6.997 25.608 8.241 1.00 43.04 O ATOM 136 CB ASP A 9 9.279 24.671 6.634 1.00 54.03 C ATOM 137 CG ASP A 9 10.714 24.822 7.098 1.00 51.10 C ATOM 138 OD1 ASP A 9 10.928 25.396 8.187 1.00 65.25 O ATOM 139 OD2 ASP A 9 11.623 24.366 6.373 1.00 35.13 O ATOM 0 H ASP A 9 7.508 23.162 5.822 1.00 64.42 H new ATOM 0 HA ASP A 9 9.107 23.127 8.117 1.00 23.31 H new ATOM 0 HB2 ASP A 9 9.267 24.226 5.639 1.00 54.03 H new ATOM 0 HB3 ASP A 9 8.823 25.657 6.548 1.00 54.03 H new ATOM 144 N ILE A 10 7.968 24.414 9.883 1.00 62.03 N ATOM 145 CA ILE A 10 7.352 25.184 10.956 1.00 44.41 C ATOM 146 C ILE A 10 8.179 26.421 11.289 1.00 4.41 C ATOM 147 O ILE A 10 9.367 26.323 11.595 1.00 22.52 O ATOM 148 CB ILE A 10 7.181 24.337 12.230 1.00 32.14 C ATOM 149 CG1 ILE A 10 6.076 23.297 12.033 1.00 51.12 C ATOM 150 CG2 ILE A 10 6.869 25.230 13.422 1.00 35.30 C ATOM 151 CD1 ILE A 10 4.684 23.889 12.027 1.00 73.54 C ATOM 0 H ILE A 10 8.577 23.660 10.201 1.00 62.03 H new ATOM 0 HA ILE A 10 6.369 25.492 10.600 1.00 44.41 H new ATOM 0 HB ILE A 10 8.116 23.813 12.428 1.00 32.14 H new ATOM 0 HG12 ILE A 10 6.244 22.774 11.091 1.00 51.12 H new ATOM 0 HG13 ILE A 10 6.142 22.553 12.827 1.00 51.12 H new ATOM 0 HG21 ILE A 10 6.751 24.617 14.315 1.00 35.30 H new ATOM 0 HG22 ILE A 10 7.686 25.936 13.572 1.00 35.30 H new ATOM 0 HG23 ILE A 10 5.946 25.779 13.234 1.00 35.30 H new ATOM 0 HD11 ILE A 10 3.951 23.095 11.883 1.00 73.54 H new ATOM 0 HD12 ILE A 10 4.497 24.388 12.978 1.00 73.54 H new ATOM 0 HD13 ILE A 10 4.600 24.612 11.216 1.00 73.54 H new ATOM 163 N ALA A 11 7.542 27.586 11.229 1.00 43.23 N ATOM 164 CA ALA A 11 8.218 28.843 11.528 1.00 72.22 C ATOM 165 C ALA A 11 7.595 29.526 12.741 1.00 61.33 C ATOM 166 O ALA A 11 6.395 29.800 12.763 1.00 22.04 O ATOM 167 CB ALA A 11 8.174 29.766 10.319 1.00 11.23 C ATOM 0 H ALA A 11 6.559 27.686 10.976 1.00 43.23 H new ATOM 0 HA ALA A 11 9.259 28.621 11.764 1.00 72.22 H new ATOM 0 HB1 ALA A 11 8.682 30.701 10.556 1.00 11.23 H new ATOM 0 HB2 ALA A 11 8.672 29.286 9.476 1.00 11.23 H new ATOM 0 HB3 ALA A 11 7.136 29.973 10.057 1.00 11.23 H new ATOM 173 N VAL A 12 8.418 29.797 13.749 1.00 42.34 N ATOM 174 CA VAL A 12 7.948 30.449 14.965 1.00 30.44 C ATOM 175 C VAL A 12 8.417 31.898 15.029 1.00 32.12 C ATOM 176 O VAL A 12 9.524 32.183 15.485 1.00 2.32 O ATOM 177 CB VAL A 12 8.436 29.707 16.224 1.00 62.32 C ATOM 178 CG1 VAL A 12 7.708 30.214 17.459 1.00 3.32 C ATOM 179 CG2 VAL A 12 8.248 28.206 16.063 1.00 23.32 C ATOM 0 H VAL A 12 9.414 29.575 13.747 1.00 42.34 H new ATOM 0 HA VAL A 12 6.859 30.424 14.936 1.00 30.44 H new ATOM 0 HB VAL A 12 9.500 29.906 16.352 1.00 62.32 H new ATOM 0 HG11 VAL A 12 8.066 29.678 18.338 1.00 3.32 H new ATOM 0 HG12 VAL A 12 7.898 31.280 17.581 1.00 3.32 H new ATOM 0 HG13 VAL A 12 6.637 30.048 17.344 1.00 3.32 H new ATOM 0 HG21 VAL A 12 8.598 27.697 16.961 1.00 23.32 H new ATOM 0 HG22 VAL A 12 7.192 27.986 15.909 1.00 23.32 H new ATOM 0 HG23 VAL A 12 8.820 27.858 15.203 1.00 23.32 H new ATOM 189 N ASP A 13 7.567 32.810 14.570 1.00 72.52 N ATOM 190 CA ASP A 13 7.893 34.231 14.576 1.00 60.11 C ATOM 191 C ASP A 13 9.109 34.513 13.699 1.00 51.20 C ATOM 192 O ASP A 13 10.008 35.257 14.088 1.00 63.10 O ATOM 193 CB ASP A 13 8.157 34.709 16.005 1.00 51.25 C ATOM 194 CG ASP A 13 7.451 36.014 16.318 1.00 31.30 C ATOM 195 OD1 ASP A 13 6.295 36.184 15.876 1.00 10.24 O ATOM 196 OD2 ASP A 13 8.054 36.864 17.006 1.00 72.33 O ATOM 0 H ASP A 13 6.647 32.590 14.189 1.00 72.52 H new ATOM 0 HA ASP A 13 7.041 34.776 14.170 1.00 60.11 H new ATOM 0 HB2 ASP A 13 7.828 33.944 16.708 1.00 51.25 H new ATOM 0 HB3 ASP A 13 9.230 34.835 16.151 1.00 51.25 H new ATOM 201 N GLY A 14 9.129 33.913 12.513 1.00 62.42 N ATOM 202 CA GLY A 14 10.240 34.111 11.600 1.00 73.12 C ATOM 203 C GLY A 14 11.409 33.195 11.901 1.00 31.44 C ATOM 204 O GLY A 14 12.420 33.219 11.201 1.00 24.42 O ATOM 0 H GLY A 14 8.396 33.293 12.168 1.00 62.42 H new ATOM 0 HA2 GLY A 14 9.901 33.939 10.578 1.00 73.12 H new ATOM 0 HA3 GLY A 14 10.571 35.148 11.656 1.00 73.12 H new ATOM 208 N GLU A 15 11.271 32.386 12.948 1.00 52.14 N ATOM 209 CA GLU A 15 12.326 31.460 13.341 1.00 2.01 C ATOM 210 C GLU A 15 11.915 30.017 13.063 1.00 22.12 C ATOM 211 O GLU A 15 11.191 29.391 13.838 1.00 41.03 O ATOM 212 CB GLU A 15 12.658 31.631 14.825 1.00 71.30 C ATOM 213 CG GLU A 15 12.692 33.081 15.278 1.00 35.43 C ATOM 214 CD GLU A 15 13.352 33.994 14.264 1.00 70.11 C ATOM 215 OE1 GLU A 15 14.524 33.741 13.913 1.00 33.13 O ATOM 216 OE2 GLU A 15 12.698 34.961 13.821 1.00 20.01 O ATOM 0 H GLU A 15 10.440 32.354 13.538 1.00 52.14 H new ATOM 0 HA GLU A 15 13.213 31.687 12.749 1.00 2.01 H new ATOM 0 HB2 GLU A 15 11.920 31.091 15.418 1.00 71.30 H new ATOM 0 HB3 GLU A 15 13.626 31.173 15.027 1.00 71.30 H new ATOM 0 HG2 GLU A 15 11.674 33.424 15.462 1.00 35.43 H new ATOM 0 HG3 GLU A 15 13.227 33.149 16.225 1.00 35.43 H new ATOM 223 N PRO A 16 12.387 29.475 11.931 1.00 43.34 N ATOM 224 CA PRO A 16 12.082 28.101 11.523 1.00 24.55 C ATOM 225 C PRO A 16 12.762 27.067 12.416 1.00 14.51 C ATOM 226 O PRO A 16 13.965 26.830 12.304 1.00 40.12 O ATOM 227 CB PRO A 16 12.635 28.022 10.098 1.00 22.33 C ATOM 228 CG PRO A 16 13.707 29.055 10.050 1.00 24.12 C ATOM 229 CD PRO A 16 13.256 30.163 10.960 1.00 14.34 C ATOM 0 HA PRO A 16 11.017 27.882 11.594 1.00 24.55 H new ATOM 0 HB2 PRO A 16 13.031 27.030 9.882 1.00 22.33 H new ATOM 0 HB3 PRO A 16 11.858 28.223 9.360 1.00 22.33 H new ATOM 0 HG2 PRO A 16 14.661 28.643 10.380 1.00 24.12 H new ATOM 0 HG3 PRO A 16 13.852 29.420 9.033 1.00 24.12 H new ATOM 0 HD2 PRO A 16 14.100 30.649 11.450 1.00 14.34 H new ATOM 0 HD3 PRO A 16 12.715 30.936 10.414 1.00 14.34 H new ATOM 237 N LEU A 17 11.984 26.455 13.302 1.00 13.41 N ATOM 238 CA LEU A 17 12.510 25.446 14.215 1.00 45.35 C ATOM 239 C LEU A 17 12.975 24.211 13.450 1.00 32.54 C ATOM 240 O LEU A 17 13.953 23.567 13.827 1.00 64.14 O ATOM 241 CB LEU A 17 11.447 25.055 15.242 1.00 21.22 C ATOM 242 CG LEU A 17 11.374 25.925 16.497 1.00 23.04 C ATOM 243 CD1 LEU A 17 11.321 27.398 16.123 1.00 3.14 C ATOM 244 CD2 LEU A 17 10.167 25.543 17.342 1.00 41.44 C ATOM 0 H LEU A 17 10.986 26.640 13.408 1.00 13.41 H new ATOM 0 HA LEU A 17 13.367 25.873 14.735 1.00 45.35 H new ATOM 0 HB2 LEU A 17 10.473 25.076 14.753 1.00 21.22 H new ATOM 0 HB3 LEU A 17 11.628 24.025 15.548 1.00 21.22 H new ATOM 0 HG LEU A 17 12.274 25.754 17.087 1.00 23.04 H new ATOM 0 HD11 LEU A 17 11.269 28.002 17.029 1.00 3.14 H new ATOM 0 HD12 LEU A 17 12.216 27.663 15.561 1.00 3.14 H new ATOM 0 HD13 LEU A 17 10.439 27.586 15.511 1.00 3.14 H new ATOM 0 HD21 LEU A 17 10.131 26.173 18.231 1.00 41.44 H new ATOM 0 HD22 LEU A 17 9.256 25.685 16.760 1.00 41.44 H new ATOM 0 HD23 LEU A 17 10.248 24.498 17.641 1.00 41.44 H new ATOM 256 N GLY A 18 12.266 23.886 12.373 1.00 2.01 N ATOM 257 CA GLY A 18 12.622 22.730 11.572 1.00 62.24 C ATOM 258 C GLY A 18 11.539 22.357 10.579 1.00 63.13 C ATOM 259 O GLY A 18 10.883 23.229 10.009 1.00 32.04 O ATOM 0 H GLY A 18 11.452 24.403 12.041 1.00 2.01 H new ATOM 0 HA2 GLY A 18 13.548 22.935 11.035 1.00 62.24 H new ATOM 0 HA3 GLY A 18 12.816 21.882 12.229 1.00 62.24 H new ATOM 263 N ARG A 19 11.353 21.058 10.369 1.00 71.21 N ATOM 264 CA ARG A 19 10.344 20.572 9.435 1.00 30.34 C ATOM 265 C ARG A 19 9.458 19.518 10.093 1.00 15.21 C ATOM 266 O ARG A 19 9.874 18.840 11.032 1.00 32.22 O ATOM 267 CB ARG A 19 11.011 19.987 8.189 1.00 22.43 C ATOM 268 CG ARG A 19 11.589 18.597 8.403 1.00 34.14 C ATOM 269 CD ARG A 19 12.819 18.636 9.296 1.00 12.34 C ATOM 270 NE ARG A 19 13.818 17.649 8.896 1.00 35.12 N ATOM 271 CZ ARG A 19 14.672 17.832 7.896 1.00 4.01 C ATOM 272 NH1 ARG A 19 14.650 18.959 7.199 1.00 44.52 N ATOM 273 NH2 ARG A 19 15.552 16.886 7.592 1.00 2.41 N ATOM 0 H ARG A 19 11.887 20.323 10.833 1.00 71.21 H new ATOM 0 HA ARG A 19 9.720 21.416 9.142 1.00 30.34 H new ATOM 0 HB2 ARG A 19 10.280 19.947 7.381 1.00 22.43 H new ATOM 0 HB3 ARG A 19 11.808 20.657 7.865 1.00 22.43 H new ATOM 0 HG2 ARG A 19 10.833 17.953 8.851 1.00 34.14 H new ATOM 0 HG3 ARG A 19 11.851 18.159 7.440 1.00 34.14 H new ATOM 0 HD2 ARG A 19 13.260 19.632 9.262 1.00 12.34 H new ATOM 0 HD3 ARG A 19 12.523 18.454 10.329 1.00 12.34 H new ATOM 0 HE ARG A 19 13.862 16.771 9.413 1.00 35.12 H new ATOM 0 HH11 ARG A 19 13.976 19.689 7.430 1.00 44.52 H new ATOM 0 HH12 ARG A 19 15.307 19.097 6.431 1.00 44.52 H new ATOM 0 HH21 ARG A 19 15.572 16.018 8.127 1.00 2.41 H new ATOM 0 HH22 ARG A 19 16.208 17.027 6.824 1.00 2.41 H new ATOM 287 N VAL A 20 8.233 19.387 9.593 1.00 13.25 N ATOM 288 CA VAL A 20 7.287 18.416 10.132 1.00 43.44 C ATOM 289 C VAL A 20 6.412 17.832 9.029 1.00 62.25 C ATOM 290 O VAL A 20 5.412 18.431 8.632 1.00 24.53 O ATOM 291 CB VAL A 20 6.384 19.049 11.207 1.00 23.11 C ATOM 292 CG1 VAL A 20 6.035 18.028 12.279 1.00 10.02 C ATOM 293 CG2 VAL A 20 7.059 20.267 11.819 1.00 12.41 C ATOM 0 H VAL A 20 7.872 19.941 8.816 1.00 13.25 H new ATOM 0 HA VAL A 20 7.876 17.619 10.586 1.00 43.44 H new ATOM 0 HB VAL A 20 5.458 19.375 10.734 1.00 23.11 H new ATOM 0 HG11 VAL A 20 5.397 18.493 13.030 1.00 10.02 H new ATOM 0 HG12 VAL A 20 5.509 17.189 11.824 1.00 10.02 H new ATOM 0 HG13 VAL A 20 6.949 17.670 12.752 1.00 10.02 H new ATOM 0 HG21 VAL A 20 6.407 20.702 12.577 1.00 12.41 H new ATOM 0 HG22 VAL A 20 8.001 19.968 12.279 1.00 12.41 H new ATOM 0 HG23 VAL A 20 7.253 21.005 11.041 1.00 12.41 H new ATOM 303 N SER A 21 6.795 16.658 8.537 1.00 61.24 N ATOM 304 CA SER A 21 6.047 15.993 7.476 1.00 21.32 C ATOM 305 C SER A 21 4.995 15.054 8.060 1.00 44.13 C ATOM 306 O SER A 21 4.952 14.827 9.269 1.00 14.31 O ATOM 307 CB SER A 21 6.997 15.211 6.567 1.00 74.34 C ATOM 308 OG SER A 21 6.358 14.068 6.025 1.00 71.50 O ATOM 0 H SER A 21 7.619 16.148 8.856 1.00 61.24 H new ATOM 0 HA SER A 21 5.540 16.758 6.888 1.00 21.32 H new ATOM 0 HB2 SER A 21 7.345 15.855 5.759 1.00 74.34 H new ATOM 0 HB3 SER A 21 7.877 14.906 7.132 1.00 74.34 H new ATOM 0 HG SER A 21 7.029 13.383 5.824 1.00 71.50 H new ATOM 314 N PHE A 22 4.149 14.511 7.191 1.00 21.20 N ATOM 315 CA PHE A 22 3.096 13.597 7.619 1.00 41.22 C ATOM 316 C PHE A 22 2.847 12.522 6.565 1.00 42.44 C ATOM 317 O PHE A 22 2.556 12.828 5.409 1.00 52.41 O ATOM 318 CB PHE A 22 1.803 14.368 7.893 1.00 70.04 C ATOM 319 CG PHE A 22 2.032 15.751 8.432 1.00 43.14 C ATOM 320 CD1 PHE A 22 2.388 16.789 7.585 1.00 63.51 C ATOM 321 CD2 PHE A 22 1.891 16.014 9.785 1.00 63.14 C ATOM 322 CE1 PHE A 22 2.601 18.062 8.079 1.00 74.15 C ATOM 323 CE2 PHE A 22 2.102 17.285 10.284 1.00 51.50 C ATOM 324 CZ PHE A 22 2.456 18.311 9.429 1.00 20.04 C ATOM 0 H PHE A 22 4.172 14.688 6.187 1.00 21.20 H new ATOM 0 HA PHE A 22 3.423 13.111 8.538 1.00 41.22 H new ATOM 0 HB2 PHE A 22 1.228 14.437 6.969 1.00 70.04 H new ATOM 0 HB3 PHE A 22 1.198 13.805 8.604 1.00 70.04 H new ATOM 0 HD1 PHE A 22 2.500 16.601 6.527 1.00 63.51 H new ATOM 0 HD2 PHE A 22 1.613 15.216 10.458 1.00 63.14 H new ATOM 0 HE1 PHE A 22 2.881 18.862 7.409 1.00 74.15 H new ATOM 0 HE2 PHE A 22 1.990 17.476 11.341 1.00 51.50 H new ATOM 0 HZ PHE A 22 2.619 19.306 9.816 1.00 20.04 H new ATOM 334 N GLU A 23 2.965 11.263 6.973 1.00 62.21 N ATOM 335 CA GLU A 23 2.755 10.143 6.063 1.00 35.33 C ATOM 336 C GLU A 23 1.271 9.964 5.755 1.00 52.13 C ATOM 337 O GLU A 23 0.534 9.350 6.527 1.00 32.41 O ATOM 338 CB GLU A 23 3.320 8.855 6.665 1.00 21.33 C ATOM 339 CG GLU A 23 2.882 7.597 5.933 1.00 1.24 C ATOM 340 CD GLU A 23 3.552 6.347 6.469 1.00 4.01 C ATOM 341 OE1 GLU A 23 4.796 6.261 6.394 1.00 52.11 O ATOM 342 OE2 GLU A 23 2.833 5.454 6.964 1.00 15.41 O ATOM 0 H GLU A 23 3.205 10.993 7.927 1.00 62.21 H new ATOM 0 HA GLU A 23 3.279 10.361 5.132 1.00 35.33 H new ATOM 0 HB2 GLU A 23 4.409 8.908 6.659 1.00 21.33 H new ATOM 0 HB3 GLU A 23 3.010 8.785 7.708 1.00 21.33 H new ATOM 0 HG2 GLU A 23 1.801 7.490 6.018 1.00 1.24 H new ATOM 0 HG3 GLU A 23 3.110 7.700 4.872 1.00 1.24 H new ATOM 349 N LEU A 24 0.839 10.506 4.621 1.00 21.22 N ATOM 350 CA LEU A 24 -0.557 10.408 4.209 1.00 21.42 C ATOM 351 C LEU A 24 -0.815 9.099 3.469 1.00 53.44 C ATOM 352 O LEU A 24 -0.236 8.847 2.412 1.00 41.11 O ATOM 353 CB LEU A 24 -0.931 11.594 3.319 1.00 60.44 C ATOM 354 CG LEU A 24 -0.563 12.978 3.854 1.00 31.34 C ATOM 355 CD1 LEU A 24 -0.069 13.872 2.728 1.00 11.21 C ATOM 356 CD2 LEU A 24 -1.755 13.611 4.558 1.00 43.34 C ATOM 0 H LEU A 24 1.435 11.018 3.971 1.00 21.22 H new ATOM 0 HA LEU A 24 -1.177 10.425 5.105 1.00 21.42 H new ATOM 0 HB2 LEU A 24 -0.449 11.461 2.350 1.00 60.44 H new ATOM 0 HB3 LEU A 24 -2.007 11.568 3.146 1.00 60.44 H new ATOM 0 HG LEU A 24 0.243 12.864 4.579 1.00 31.34 H new ATOM 0 HD11 LEU A 24 0.188 14.853 3.128 1.00 11.21 H new ATOM 0 HD12 LEU A 24 0.813 13.425 2.269 1.00 11.21 H new ATOM 0 HD13 LEU A 24 -0.853 13.980 1.979 1.00 11.21 H new ATOM 0 HD21 LEU A 24 -1.475 14.596 4.933 1.00 43.34 H new ATOM 0 HD22 LEU A 24 -2.582 13.712 3.855 1.00 43.34 H new ATOM 0 HD23 LEU A 24 -2.063 12.980 5.392 1.00 43.34 H new ATOM 368 N PHE A 25 -1.690 8.271 4.029 1.00 55.10 N ATOM 369 CA PHE A 25 -2.027 6.989 3.421 1.00 11.02 C ATOM 370 C PHE A 25 -3.024 7.173 2.281 1.00 73.21 C ATOM 371 O PHE A 25 -4.183 6.770 2.384 1.00 25.02 O ATOM 372 CB PHE A 25 -2.606 6.039 4.472 1.00 63.13 C ATOM 373 CG PHE A 25 -1.675 5.777 5.621 1.00 43.02 C ATOM 374 CD1 PHE A 25 -1.523 6.710 6.634 1.00 54.44 C ATOM 375 CD2 PHE A 25 -0.951 4.597 5.689 1.00 52.34 C ATOM 376 CE1 PHE A 25 -0.667 6.472 7.692 1.00 43.24 C ATOM 377 CE2 PHE A 25 -0.093 4.353 6.745 1.00 52.45 C ATOM 378 CZ PHE A 25 0.048 5.292 7.748 1.00 63.22 C ATOM 0 H PHE A 25 -2.179 8.465 4.903 1.00 55.10 H new ATOM 0 HA PHE A 25 -1.113 6.556 3.014 1.00 11.02 H new ATOM 0 HB2 PHE A 25 -3.536 6.458 4.856 1.00 63.13 H new ATOM 0 HB3 PHE A 25 -2.857 5.092 3.995 1.00 63.13 H new ATOM 0 HD1 PHE A 25 -2.080 7.634 6.596 1.00 54.44 H new ATOM 0 HD2 PHE A 25 -1.059 3.859 4.908 1.00 52.34 H new ATOM 0 HE1 PHE A 25 -0.557 7.208 8.475 1.00 43.24 H new ATOM 0 HE2 PHE A 25 0.466 3.430 6.786 1.00 52.45 H new ATOM 0 HZ PHE A 25 0.717 5.104 8.575 1.00 63.22 H new ATOM 388 N ALA A 26 -2.565 7.785 1.194 1.00 32.42 N ATOM 389 CA ALA A 26 -3.415 8.021 0.034 1.00 72.01 C ATOM 390 C ALA A 26 -4.027 6.719 -0.473 1.00 1.22 C ATOM 391 O ALA A 26 -5.054 6.728 -1.151 1.00 70.24 O ATOM 392 CB ALA A 26 -2.621 8.699 -1.073 1.00 12.23 C ATOM 0 H ALA A 26 -1.609 8.126 1.093 1.00 32.42 H new ATOM 0 HA ALA A 26 -4.228 8.680 0.339 1.00 72.01 H new ATOM 0 HB1 ALA A 26 -3.268 8.869 -1.933 1.00 12.23 H new ATOM 0 HB2 ALA A 26 -2.237 9.654 -0.713 1.00 12.23 H new ATOM 0 HB3 ALA A 26 -1.788 8.060 -1.367 1.00 12.23 H new ATOM 398 N ASP A 27 -3.389 5.602 -0.140 1.00 13.54 N ATOM 399 CA ASP A 27 -3.871 4.292 -0.561 1.00 12.21 C ATOM 400 C ASP A 27 -5.166 3.932 0.160 1.00 32.24 C ATOM 401 O ASP A 27 -5.994 3.186 -0.363 1.00 15.20 O ATOM 402 CB ASP A 27 -2.809 3.224 -0.293 1.00 15.30 C ATOM 403 CG ASP A 27 -3.381 1.820 -0.319 1.00 0.31 C ATOM 404 OD1 ASP A 27 -4.084 1.483 -1.295 1.00 1.41 O ATOM 405 OD2 ASP A 27 -3.125 1.058 0.636 1.00 3.24 O ATOM 0 H ASP A 27 -2.537 5.578 0.420 1.00 13.54 H new ATOM 0 HA ASP A 27 -4.072 4.333 -1.632 1.00 12.21 H new ATOM 0 HB2 ASP A 27 -2.019 3.305 -1.040 1.00 15.30 H new ATOM 0 HB3 ASP A 27 -2.350 3.408 0.678 1.00 15.30 H new ATOM 410 N LYS A 28 -5.334 4.465 1.366 1.00 53.24 N ATOM 411 CA LYS A 28 -6.528 4.201 2.160 1.00 21.02 C ATOM 412 C LYS A 28 -7.485 5.388 2.116 1.00 61.13 C ATOM 413 O LYS A 28 -8.700 5.223 2.223 1.00 72.24 O ATOM 414 CB LYS A 28 -6.144 3.896 3.610 1.00 44.22 C ATOM 415 CG LYS A 28 -5.734 2.452 3.840 1.00 70.24 C ATOM 416 CD LYS A 28 -4.265 2.231 3.520 1.00 51.03 C ATOM 417 CE LYS A 28 -3.878 0.767 3.661 1.00 62.13 C ATOM 418 NZ LYS A 28 -4.232 0.226 5.002 1.00 14.11 N ATOM 0 H LYS A 28 -4.658 5.083 1.815 1.00 53.24 H new ATOM 0 HA LYS A 28 -7.033 3.334 1.734 1.00 21.02 H new ATOM 0 HB2 LYS A 28 -5.323 4.549 3.905 1.00 44.22 H new ATOM 0 HB3 LYS A 28 -6.988 4.133 4.258 1.00 44.22 H new ATOM 0 HG2 LYS A 28 -5.926 2.179 4.878 1.00 70.24 H new ATOM 0 HG3 LYS A 28 -6.345 1.796 3.220 1.00 70.24 H new ATOM 0 HD2 LYS A 28 -4.058 2.567 2.504 1.00 51.03 H new ATOM 0 HD3 LYS A 28 -3.651 2.837 4.187 1.00 51.03 H new ATOM 0 HE2 LYS A 28 -4.380 0.183 2.890 1.00 62.13 H new ATOM 0 HE3 LYS A 28 -2.806 0.657 3.497 1.00 62.13 H new ATOM 0 HZ1 LYS A 28 -3.791 -0.707 5.127 1.00 14.11 H new ATOM 0 HZ2 LYS A 28 -3.888 0.874 5.739 1.00 14.11 H new ATOM 0 HZ3 LYS A 28 -5.265 0.133 5.077 1.00 14.11 H new ATOM 432 N VAL A 29 -6.929 6.585 1.956 1.00 71.23 N ATOM 433 CA VAL A 29 -7.734 7.799 1.894 1.00 4.33 C ATOM 434 C VAL A 29 -7.211 8.751 0.824 1.00 11.01 C ATOM 435 O VAL A 29 -6.719 9.842 1.115 1.00 73.35 O ATOM 436 CB VAL A 29 -7.752 8.529 3.250 1.00 11.43 C ATOM 437 CG1 VAL A 29 -9.091 8.333 3.945 1.00 71.33 C ATOM 438 CG2 VAL A 29 -6.610 8.046 4.131 1.00 44.22 C ATOM 0 H VAL A 29 -5.925 6.740 1.867 1.00 71.23 H new ATOM 0 HA VAL A 29 -8.749 7.494 1.640 1.00 4.33 H new ATOM 0 HB VAL A 29 -7.616 9.595 3.070 1.00 11.43 H new ATOM 0 HG11 VAL A 29 -9.085 8.856 4.901 1.00 71.33 H new ATOM 0 HG12 VAL A 29 -9.888 8.733 3.318 1.00 71.33 H new ATOM 0 HG13 VAL A 29 -9.261 7.270 4.114 1.00 71.33 H new ATOM 0 HG21 VAL A 29 -6.638 8.573 5.085 1.00 44.22 H new ATOM 0 HG22 VAL A 29 -6.712 6.975 4.305 1.00 44.22 H new ATOM 0 HG23 VAL A 29 -5.659 8.244 3.636 1.00 44.22 H new ATOM 448 N PRO A 30 -7.319 8.331 -0.445 1.00 73.01 N ATOM 449 CA PRO A 30 -6.864 9.132 -1.586 1.00 31.35 C ATOM 450 C PRO A 30 -7.736 10.362 -1.815 1.00 62.41 C ATOM 451 O PRO A 30 -7.245 11.418 -2.213 1.00 4.22 O ATOM 452 CB PRO A 30 -6.981 8.165 -2.767 1.00 12.32 C ATOM 453 CG PRO A 30 -8.029 7.189 -2.355 1.00 43.12 C ATOM 454 CD PRO A 30 -7.895 7.042 -0.865 1.00 10.23 C ATOM 0 HA PRO A 30 -5.857 9.522 -1.435 1.00 31.35 H new ATOM 0 HB2 PRO A 30 -7.264 8.688 -3.680 1.00 12.32 H new ATOM 0 HB3 PRO A 30 -6.032 7.667 -2.966 1.00 12.32 H new ATOM 0 HG2 PRO A 30 -9.023 7.547 -2.624 1.00 43.12 H new ATOM 0 HG3 PRO A 30 -7.889 6.231 -2.856 1.00 43.12 H new ATOM 0 HD2 PRO A 30 -8.859 6.859 -0.391 1.00 10.23 H new ATOM 0 HD3 PRO A 30 -7.246 6.207 -0.600 1.00 10.23 H new ATOM 462 N LYS A 31 -9.032 10.218 -1.562 1.00 31.14 N ATOM 463 CA LYS A 31 -9.973 11.317 -1.739 1.00 13.44 C ATOM 464 C LYS A 31 -9.572 12.519 -0.889 1.00 40.24 C ATOM 465 O LYS A 31 -9.732 13.668 -1.305 1.00 25.44 O ATOM 466 CB LYS A 31 -11.389 10.869 -1.369 1.00 60.54 C ATOM 467 CG LYS A 31 -12.388 11.011 -2.505 1.00 23.41 C ATOM 468 CD LYS A 31 -12.082 10.048 -3.640 1.00 71.20 C ATOM 469 CE LYS A 31 -13.012 10.268 -4.824 1.00 3.45 C ATOM 470 NZ LYS A 31 -14.258 9.462 -4.707 1.00 54.33 N ATOM 0 H LYS A 31 -9.455 9.350 -1.233 1.00 31.14 H new ATOM 0 HA LYS A 31 -9.954 11.612 -2.788 1.00 13.44 H new ATOM 0 HB2 LYS A 31 -11.360 9.827 -1.050 1.00 60.54 H new ATOM 0 HB3 LYS A 31 -11.735 11.454 -0.517 1.00 60.54 H new ATOM 0 HG2 LYS A 31 -13.395 10.826 -2.131 1.00 23.41 H new ATOM 0 HG3 LYS A 31 -12.371 12.034 -2.880 1.00 23.41 H new ATOM 0 HD2 LYS A 31 -11.048 10.177 -3.959 1.00 71.20 H new ATOM 0 HD3 LYS A 31 -12.180 9.022 -3.285 1.00 71.20 H new ATOM 0 HE2 LYS A 31 -13.268 11.325 -4.893 1.00 3.45 H new ATOM 0 HE3 LYS A 31 -12.494 10.005 -5.746 1.00 3.45 H new ATOM 0 HZ1 LYS A 31 -14.865 9.640 -5.533 1.00 54.33 H new ATOM 0 HZ2 LYS A 31 -14.015 8.452 -4.667 1.00 54.33 H new ATOM 0 HZ3 LYS A 31 -14.765 9.731 -3.840 1.00 54.33 H new ATOM 484 N THR A 32 -9.049 12.248 0.302 1.00 24.02 N ATOM 485 CA THR A 32 -8.624 13.307 1.209 1.00 30.45 C ATOM 486 C THR A 32 -7.139 13.607 1.046 1.00 5.55 C ATOM 487 O THR A 32 -6.729 14.768 1.024 1.00 75.21 O ATOM 488 CB THR A 32 -8.903 12.933 2.678 1.00 45.43 C ATOM 489 OG1 THR A 32 -10.292 12.634 2.852 1.00 62.51 O ATOM 490 CG2 THR A 32 -8.503 14.067 3.610 1.00 44.45 C ATOM 0 H THR A 32 -8.909 11.304 0.661 1.00 24.02 H new ATOM 0 HA THR A 32 -9.201 14.195 0.952 1.00 30.45 H new ATOM 0 HB THR A 32 -8.309 12.053 2.925 1.00 45.43 H new ATOM 0 HG1 THR A 32 -10.461 12.396 3.788 1.00 62.51 H new ATOM 0 HG21 THR A 32 -8.709 13.780 4.641 1.00 44.45 H new ATOM 0 HG22 THR A 32 -7.439 14.273 3.496 1.00 44.45 H new ATOM 0 HG23 THR A 32 -9.074 14.961 3.361 1.00 44.45 H new ATOM 498 N ALA A 33 -6.335 12.555 0.933 1.00 73.25 N ATOM 499 CA ALA A 33 -4.895 12.707 0.769 1.00 40.03 C ATOM 500 C ALA A 33 -4.566 13.474 -0.508 1.00 23.14 C ATOM 501 O ALA A 33 -3.742 14.388 -0.498 1.00 22.33 O ATOM 502 CB ALA A 33 -4.218 11.344 0.758 1.00 51.45 C ATOM 0 H ALA A 33 -6.657 11.587 0.952 1.00 73.25 H new ATOM 0 HA ALA A 33 -4.516 13.281 1.614 1.00 40.03 H new ATOM 0 HB1 ALA A 33 -3.143 11.473 0.635 1.00 51.45 H new ATOM 0 HB2 ALA A 33 -4.417 10.832 1.699 1.00 51.45 H new ATOM 0 HB3 ALA A 33 -4.609 10.750 -0.068 1.00 51.45 H new ATOM 508 N GLU A 34 -5.214 13.095 -1.604 1.00 74.14 N ATOM 509 CA GLU A 34 -4.988 13.747 -2.889 1.00 1.23 C ATOM 510 C GLU A 34 -5.097 15.263 -2.756 1.00 10.44 C ATOM 511 O GLU A 34 -4.376 16.009 -3.417 1.00 62.54 O ATOM 512 CB GLU A 34 -5.992 13.242 -3.927 1.00 33.24 C ATOM 513 CG GLU A 34 -5.852 13.909 -5.285 1.00 21.24 C ATOM 514 CD GLU A 34 -6.011 12.932 -6.434 1.00 13.15 C ATOM 515 OE1 GLU A 34 -5.429 11.830 -6.359 1.00 63.24 O ATOM 516 OE2 GLU A 34 -6.718 13.270 -7.406 1.00 62.42 O ATOM 0 H GLU A 34 -5.900 12.340 -1.629 1.00 74.14 H new ATOM 0 HA GLU A 34 -3.979 13.500 -3.220 1.00 1.23 H new ATOM 0 HB2 GLU A 34 -5.868 12.166 -4.046 1.00 33.24 H new ATOM 0 HB3 GLU A 34 -7.002 13.407 -3.553 1.00 33.24 H new ATOM 0 HG2 GLU A 34 -6.599 14.697 -5.377 1.00 21.24 H new ATOM 0 HG3 GLU A 34 -4.875 14.387 -5.352 1.00 21.24 H new ATOM 523 N ASN A 35 -6.005 15.712 -1.895 1.00 51.21 N ATOM 524 CA ASN A 35 -6.210 17.139 -1.675 1.00 53.33 C ATOM 525 C ASN A 35 -4.968 17.780 -1.064 1.00 20.44 C ATOM 526 O ASN A 35 -4.331 18.635 -1.678 1.00 43.22 O ATOM 527 CB ASN A 35 -7.417 17.368 -0.763 1.00 72.41 C ATOM 528 CG ASN A 35 -7.508 18.799 -0.272 1.00 1.52 C ATOM 529 OD1 ASN A 35 -8.109 19.654 -0.923 1.00 34.12 O ATOM 530 ND2 ASN A 35 -6.909 19.068 0.882 1.00 23.25 N ATOM 0 H ASN A 35 -6.610 15.108 -1.339 1.00 51.21 H new ATOM 0 HA ASN A 35 -6.400 17.606 -2.641 1.00 53.33 H new ATOM 0 HB2 ASN A 35 -8.330 17.113 -1.302 1.00 72.41 H new ATOM 0 HB3 ASN A 35 -7.354 16.696 0.093 1.00 72.41 H new ATOM 0 HD21 ASN A 35 -6.936 20.014 1.262 1.00 23.25 H new ATOM 0 HD22 ASN A 35 -6.422 18.329 1.388 1.00 23.25 H new ATOM 537 N PHE A 36 -4.629 17.359 0.151 1.00 71.15 N ATOM 538 CA PHE A 36 -3.463 17.891 0.846 1.00 12.03 C ATOM 539 C PHE A 36 -2.201 17.712 0.008 1.00 21.21 C ATOM 540 O PHE A 36 -1.297 18.548 0.041 1.00 75.44 O ATOM 541 CB PHE A 36 -3.292 17.200 2.201 1.00 41.32 C ATOM 542 CG PHE A 36 -2.445 17.978 3.167 1.00 32.14 C ATOM 543 CD1 PHE A 36 -2.640 19.339 3.341 1.00 73.42 C ATOM 544 CD2 PHE A 36 -1.454 17.348 3.902 1.00 4.13 C ATOM 545 CE1 PHE A 36 -1.863 20.057 4.230 1.00 51.12 C ATOM 546 CE2 PHE A 36 -0.674 18.061 4.793 1.00 44.21 C ATOM 547 CZ PHE A 36 -0.878 19.418 4.956 1.00 63.50 C ATOM 0 H PHE A 36 -5.145 16.651 0.674 1.00 71.15 H new ATOM 0 HA PHE A 36 -3.622 18.957 1.007 1.00 12.03 H new ATOM 0 HB2 PHE A 36 -4.275 17.035 2.643 1.00 41.32 H new ATOM 0 HB3 PHE A 36 -2.844 16.219 2.046 1.00 41.32 H new ATOM 0 HD1 PHE A 36 -3.408 19.845 2.775 1.00 73.42 H new ATOM 0 HD2 PHE A 36 -1.289 16.288 3.777 1.00 4.13 H new ATOM 0 HE1 PHE A 36 -2.026 21.117 4.357 1.00 51.12 H new ATOM 0 HE2 PHE A 36 0.094 17.558 5.361 1.00 44.21 H new ATOM 0 HZ PHE A 36 -0.268 19.977 5.650 1.00 63.50 H new ATOM 557 N ARG A 37 -2.146 16.616 -0.741 1.00 72.44 N ATOM 558 CA ARG A 37 -0.995 16.325 -1.587 1.00 24.11 C ATOM 559 C ARG A 37 -0.926 17.293 -2.764 1.00 11.50 C ATOM 560 O ARG A 37 0.099 17.934 -2.995 1.00 21.13 O ATOM 561 CB ARG A 37 -1.063 14.885 -2.100 1.00 45.54 C ATOM 562 CG ARG A 37 0.301 14.242 -2.291 1.00 22.33 C ATOM 563 CD ARG A 37 0.416 13.573 -3.651 1.00 64.24 C ATOM 564 NE ARG A 37 0.137 14.501 -4.743 1.00 54.43 N ATOM 565 CZ ARG A 37 0.384 14.230 -6.020 1.00 52.50 C ATOM 566 NH1 ARG A 37 0.913 13.064 -6.363 1.00 54.13 N ATOM 567 NH2 ARG A 37 0.101 15.127 -6.957 1.00 3.15 N ATOM 0 H ARG A 37 -2.885 15.914 -0.779 1.00 72.44 H new ATOM 0 HA ARG A 37 -0.094 16.447 -0.986 1.00 24.11 H new ATOM 0 HB2 ARG A 37 -1.643 14.285 -1.399 1.00 45.54 H new ATOM 0 HB3 ARG A 37 -1.598 14.871 -3.050 1.00 45.54 H new ATOM 0 HG2 ARG A 37 1.079 14.999 -2.190 1.00 22.33 H new ATOM 0 HG3 ARG A 37 0.470 13.505 -1.506 1.00 22.33 H new ATOM 0 HD2 ARG A 37 1.419 13.164 -3.770 1.00 64.24 H new ATOM 0 HD3 ARG A 37 -0.278 12.734 -3.702 1.00 64.24 H new ATOM 0 HE ARG A 37 -0.270 15.407 -4.513 1.00 54.43 H new ATOM 0 HH11 ARG A 37 1.131 12.372 -5.646 1.00 54.13 H new ATOM 0 HH12 ARG A 37 1.102 12.858 -7.344 1.00 54.13 H new ATOM 0 HH21 ARG A 37 -0.306 16.025 -6.697 1.00 3.15 H new ATOM 0 HH22 ARG A 37 0.291 14.918 -7.937 1.00 3.15 H new ATOM 581 N ALA A 38 -2.024 17.394 -3.505 1.00 54.34 N ATOM 582 CA ALA A 38 -2.089 18.285 -4.657 1.00 55.22 C ATOM 583 C ALA A 38 -1.770 19.722 -4.259 1.00 21.03 C ATOM 584 O ALA A 38 -1.154 20.467 -5.023 1.00 31.35 O ATOM 585 CB ALA A 38 -3.463 18.209 -5.307 1.00 33.33 C ATOM 0 H ALA A 38 -2.881 16.870 -3.328 1.00 54.34 H new ATOM 0 HA ALA A 38 -1.339 17.960 -5.378 1.00 55.22 H new ATOM 0 HB1 ALA A 38 -3.497 18.880 -6.166 1.00 33.33 H new ATOM 0 HB2 ALA A 38 -3.654 17.188 -5.636 1.00 33.33 H new ATOM 0 HB3 ALA A 38 -4.224 18.505 -4.585 1.00 33.33 H new ATOM 591 N LEU A 39 -2.192 20.106 -3.059 1.00 53.12 N ATOM 592 CA LEU A 39 -1.951 21.455 -2.559 1.00 55.10 C ATOM 593 C LEU A 39 -0.482 21.649 -2.201 1.00 24.35 C ATOM 594 O LEU A 39 0.189 22.527 -2.743 1.00 25.24 O ATOM 595 CB LEU A 39 -2.827 21.731 -1.335 1.00 72.55 C ATOM 596 CG LEU A 39 -4.310 21.978 -1.613 1.00 73.15 C ATOM 597 CD1 LEU A 39 -5.142 21.679 -0.376 1.00 54.40 C ATOM 598 CD2 LEU A 39 -4.535 23.410 -2.077 1.00 5.04 C ATOM 0 H LEU A 39 -2.703 19.502 -2.415 1.00 53.12 H new ATOM 0 HA LEU A 39 -2.209 22.160 -3.349 1.00 55.10 H new ATOM 0 HB2 LEU A 39 -2.742 20.884 -0.654 1.00 72.55 H new ATOM 0 HB3 LEU A 39 -2.426 22.601 -0.815 1.00 72.55 H new ATOM 0 HG LEU A 39 -4.627 21.306 -2.410 1.00 73.15 H new ATOM 0 HD11 LEU A 39 -6.195 21.861 -0.593 1.00 54.40 H new ATOM 0 HD12 LEU A 39 -5.005 20.636 -0.089 1.00 54.40 H new ATOM 0 HD13 LEU A 39 -4.823 22.325 0.442 1.00 54.40 H new ATOM 0 HD21 LEU A 39 -5.596 23.567 -2.270 1.00 5.04 H new ATOM 0 HD22 LEU A 39 -4.201 24.100 -1.302 1.00 5.04 H new ATOM 0 HD23 LEU A 39 -3.969 23.589 -2.991 1.00 5.04 H new ATOM 610 N SER A 40 0.013 20.821 -1.285 1.00 51.32 N ATOM 611 CA SER A 40 1.403 20.902 -0.853 1.00 42.30 C ATOM 612 C SER A 40 2.346 20.898 -2.052 1.00 41.14 C ATOM 613 O SER A 40 3.331 21.637 -2.086 1.00 71.24 O ATOM 614 CB SER A 40 1.739 19.736 0.078 1.00 72.40 C ATOM 615 OG SER A 40 0.789 19.628 1.124 1.00 55.03 O ATOM 0 H SER A 40 -0.528 20.087 -0.828 1.00 51.32 H new ATOM 0 HA SER A 40 1.535 21.839 -0.312 1.00 42.30 H new ATOM 0 HB2 SER A 40 1.764 18.807 -0.492 1.00 72.40 H new ATOM 0 HB3 SER A 40 2.734 19.878 0.500 1.00 72.40 H new ATOM 0 HG SER A 40 0.017 19.111 0.813 1.00 55.03 H new ATOM 621 N THR A 41 2.037 20.060 -3.037 1.00 25.40 N ATOM 622 CA THR A 41 2.856 19.957 -4.238 1.00 63.12 C ATOM 623 C THR A 41 2.691 21.187 -5.123 1.00 41.11 C ATOM 624 O THR A 41 3.602 21.559 -5.862 1.00 74.12 O ATOM 625 CB THR A 41 2.501 18.700 -5.055 1.00 31.15 C ATOM 626 OG1 THR A 41 1.141 18.772 -5.497 1.00 70.52 O ATOM 627 CG2 THR A 41 2.704 17.441 -4.225 1.00 71.22 C ATOM 0 H THR A 41 1.225 19.443 -3.026 1.00 25.40 H new ATOM 0 HA THR A 41 3.892 19.886 -3.908 1.00 63.12 H new ATOM 0 HB THR A 41 3.162 18.656 -5.920 1.00 31.15 H new ATOM 0 HG1 THR A 41 0.544 18.526 -4.760 1.00 70.52 H new ATOM 0 HG21 THR A 41 2.447 16.566 -4.822 1.00 71.22 H new ATOM 0 HG22 THR A 41 3.746 17.375 -3.914 1.00 71.22 H new ATOM 0 HG23 THR A 41 2.064 17.479 -3.344 1.00 71.22 H new ATOM 635 N GLY A 42 1.522 21.816 -5.042 1.00 44.14 N ATOM 636 CA GLY A 42 1.260 22.999 -5.841 1.00 72.23 C ATOM 637 C GLY A 42 0.749 22.660 -7.228 1.00 0.33 C ATOM 638 O GLY A 42 0.701 23.521 -8.105 1.00 43.53 O ATOM 0 H GLY A 42 0.752 21.528 -4.438 1.00 44.14 H new ATOM 0 HA2 GLY A 42 0.528 23.624 -5.330 1.00 72.23 H new ATOM 0 HA3 GLY A 42 2.175 23.585 -5.927 1.00 72.23 H new ATOM 642 N GLU A 43 0.368 21.402 -7.426 1.00 11.25 N ATOM 643 CA GLU A 43 -0.139 20.952 -8.717 1.00 13.44 C ATOM 644 C GLU A 43 -1.606 21.337 -8.889 1.00 1.00 C ATOM 645 O GLU A 43 -2.127 21.359 -10.004 1.00 73.41 O ATOM 646 CB GLU A 43 0.021 19.437 -8.853 1.00 23.24 C ATOM 647 CG GLU A 43 -0.698 18.649 -7.771 1.00 21.04 C ATOM 648 CD GLU A 43 -1.888 17.876 -8.305 1.00 41.10 C ATOM 649 OE1 GLU A 43 -2.501 18.339 -9.290 1.00 34.14 O ATOM 650 OE2 GLU A 43 -2.206 16.809 -7.739 1.00 40.43 O ATOM 0 H GLU A 43 0.401 20.677 -6.709 1.00 11.25 H new ATOM 0 HA GLU A 43 0.442 21.443 -9.498 1.00 13.44 H new ATOM 0 HB2 GLU A 43 -0.356 19.127 -9.828 1.00 23.24 H new ATOM 0 HB3 GLU A 43 1.082 19.188 -8.827 1.00 23.24 H new ATOM 0 HG2 GLU A 43 0.002 17.955 -7.306 1.00 21.04 H new ATOM 0 HG3 GLU A 43 -1.034 19.333 -6.991 1.00 21.04 H new ATOM 657 N LYS A 44 -2.267 21.640 -7.777 1.00 24.33 N ATOM 658 CA LYS A 44 -3.673 22.024 -7.802 1.00 42.42 C ATOM 659 C LYS A 44 -3.821 23.537 -7.936 1.00 22.45 C ATOM 660 O LYS A 44 -4.791 24.120 -7.455 1.00 34.14 O ATOM 661 CB LYS A 44 -4.378 21.542 -6.532 1.00 42.33 C ATOM 662 CG LYS A 44 -5.891 21.660 -6.594 1.00 42.15 C ATOM 663 CD LYS A 44 -6.542 20.322 -6.899 1.00 73.31 C ATOM 664 CE LYS A 44 -6.178 19.829 -8.291 1.00 75.33 C ATOM 665 NZ LYS A 44 -6.520 20.829 -9.341 1.00 21.44 N ATOM 0 H LYS A 44 -1.851 21.627 -6.846 1.00 24.33 H new ATOM 0 HA LYS A 44 -4.137 21.553 -8.668 1.00 42.42 H new ATOM 0 HB2 LYS A 44 -4.110 20.501 -6.351 1.00 42.33 H new ATOM 0 HB3 LYS A 44 -4.012 22.118 -5.682 1.00 42.33 H new ATOM 0 HG2 LYS A 44 -6.266 22.040 -5.644 1.00 42.15 H new ATOM 0 HG3 LYS A 44 -6.169 22.384 -7.360 1.00 42.15 H new ATOM 0 HD2 LYS A 44 -6.229 19.587 -6.158 1.00 73.31 H new ATOM 0 HD3 LYS A 44 -7.625 20.416 -6.817 1.00 73.31 H new ATOM 0 HE2 LYS A 44 -5.111 19.611 -8.331 1.00 75.33 H new ATOM 0 HE3 LYS A 44 -6.702 18.895 -8.494 1.00 75.33 H new ATOM 0 HZ1 LYS A 44 -6.352 20.417 -10.281 1.00 21.44 H new ATOM 0 HZ2 LYS A 44 -7.522 21.095 -9.254 1.00 21.44 H new ATOM 0 HZ3 LYS A 44 -5.926 21.674 -9.222 1.00 21.44 H new ATOM 679 N GLY A 45 -2.852 24.166 -8.593 1.00 42.14 N ATOM 680 CA GLY A 45 -2.894 25.605 -8.779 1.00 75.32 C ATOM 681 C GLY A 45 -2.253 26.357 -7.630 1.00 14.10 C ATOM 682 O GLY A 45 -1.827 27.501 -7.788 1.00 52.23 O ATOM 0 H GLY A 45 -2.038 23.705 -9.000 1.00 42.14 H new ATOM 0 HA2 GLY A 45 -2.385 25.863 -9.707 1.00 75.32 H new ATOM 0 HA3 GLY A 45 -3.931 25.924 -8.885 1.00 75.32 H new ATOM 686 N PHE A 46 -2.186 25.715 -6.469 1.00 21.53 N ATOM 687 CA PHE A 46 -1.595 26.331 -5.287 1.00 4.41 C ATOM 688 C PHE A 46 -1.624 25.372 -4.101 1.00 2.24 C ATOM 689 O PHE A 46 -1.921 24.188 -4.253 1.00 12.24 O ATOM 690 CB PHE A 46 -2.338 27.621 -4.933 1.00 2.11 C ATOM 691 CG PHE A 46 -3.773 27.400 -4.548 1.00 24.21 C ATOM 692 CD1 PHE A 46 -4.721 27.088 -5.509 1.00 31.34 C ATOM 693 CD2 PHE A 46 -4.173 27.503 -3.226 1.00 2.35 C ATOM 694 CE1 PHE A 46 -6.042 26.884 -5.157 1.00 12.40 C ATOM 695 CE2 PHE A 46 -5.492 27.301 -2.868 1.00 35.42 C ATOM 696 CZ PHE A 46 -6.428 26.990 -3.835 1.00 31.31 C ATOM 0 H PHE A 46 -2.534 24.768 -6.321 1.00 21.53 H new ATOM 0 HA PHE A 46 -0.556 26.569 -5.513 1.00 4.41 H new ATOM 0 HB2 PHE A 46 -1.821 28.114 -4.110 1.00 2.11 H new ATOM 0 HB3 PHE A 46 -2.299 28.299 -5.786 1.00 2.11 H new ATOM 0 HD1 PHE A 46 -4.425 27.003 -6.544 1.00 31.34 H new ATOM 0 HD2 PHE A 46 -3.445 27.744 -2.466 1.00 2.35 H new ATOM 0 HE1 PHE A 46 -6.772 26.642 -5.915 1.00 12.40 H new ATOM 0 HE2 PHE A 46 -5.791 27.386 -1.834 1.00 35.42 H new ATOM 0 HZ PHE A 46 -7.460 26.830 -3.558 1.00 31.31 H new ATOM 706 N GLY A 47 -1.312 25.893 -2.918 1.00 3.53 N ATOM 707 CA GLY A 47 -1.307 25.071 -1.722 1.00 72.44 C ATOM 708 C GLY A 47 -1.569 25.874 -0.464 1.00 55.32 C ATOM 709 O GLY A 47 -2.461 26.723 -0.436 1.00 31.00 O ATOM 0 H GLY A 47 -1.062 26.870 -2.767 1.00 3.53 H new ATOM 0 HA2 GLY A 47 -2.065 24.293 -1.817 1.00 72.44 H new ATOM 0 HA3 GLY A 47 -0.344 24.569 -1.634 1.00 72.44 H new ATOM 713 N TYR A 48 -0.793 25.606 0.579 1.00 2.45 N ATOM 714 CA TYR A 48 -0.948 26.308 1.848 1.00 13.20 C ATOM 715 C TYR A 48 0.390 26.433 2.569 1.00 23.03 C ATOM 716 O TYR A 48 0.541 25.984 3.706 1.00 45.22 O ATOM 717 CB TYR A 48 -1.954 25.578 2.739 1.00 32.32 C ATOM 718 CG TYR A 48 -2.920 26.502 3.446 1.00 73.35 C ATOM 719 CD1 TYR A 48 -2.460 27.552 4.230 1.00 44.10 C ATOM 720 CD2 TYR A 48 -4.293 26.324 3.329 1.00 13.15 C ATOM 721 CE1 TYR A 48 -3.338 28.399 4.878 1.00 74.41 C ATOM 722 CE2 TYR A 48 -5.179 27.167 3.972 1.00 34.55 C ATOM 723 CZ TYR A 48 -4.697 28.202 4.746 1.00 52.04 C ATOM 724 OH TYR A 48 -5.577 29.042 5.389 1.00 43.51 O ATOM 0 H TYR A 48 -0.050 24.908 0.572 1.00 2.45 H new ATOM 0 HA TYR A 48 -1.320 27.310 1.636 1.00 13.20 H new ATOM 0 HB2 TYR A 48 -2.519 24.872 2.131 1.00 32.32 H new ATOM 0 HB3 TYR A 48 -1.411 24.995 3.483 1.00 32.32 H new ATOM 0 HD1 TYR A 48 -1.397 27.709 4.335 1.00 44.10 H new ATOM 0 HD2 TYR A 48 -4.674 25.513 2.726 1.00 13.15 H new ATOM 0 HE1 TYR A 48 -2.963 29.210 5.484 1.00 74.41 H new ATOM 0 HE2 TYR A 48 -6.243 27.016 3.869 1.00 34.55 H new ATOM 0 HH TYR A 48 -6.496 28.766 5.191 1.00 43.51 H new ATOM 734 N LYS A 49 1.360 27.047 1.900 1.00 24.22 N ATOM 735 CA LYS A 49 2.687 27.234 2.475 1.00 1.22 C ATOM 736 C LYS A 49 2.748 28.519 3.295 1.00 22.24 C ATOM 737 O LYS A 49 3.665 29.324 3.139 1.00 64.40 O ATOM 738 CB LYS A 49 3.744 27.272 1.369 1.00 21.01 C ATOM 739 CG LYS A 49 3.341 26.514 0.116 1.00 14.40 C ATOM 740 CD LYS A 49 4.554 26.093 -0.696 1.00 30.44 C ATOM 741 CE LYS A 49 4.396 24.682 -1.242 1.00 24.24 C ATOM 742 NZ LYS A 49 3.353 24.611 -2.302 1.00 32.45 N ATOM 0 H LYS A 49 1.252 27.424 0.958 1.00 24.22 H new ATOM 0 HA LYS A 49 2.891 26.392 3.136 1.00 1.22 H new ATOM 0 HB2 LYS A 49 3.946 28.310 1.106 1.00 21.01 H new ATOM 0 HB3 LYS A 49 4.675 26.854 1.753 1.00 21.01 H new ATOM 0 HG2 LYS A 49 2.764 25.632 0.393 1.00 14.40 H new ATOM 0 HG3 LYS A 49 2.692 27.140 -0.496 1.00 14.40 H new ATOM 0 HD2 LYS A 49 4.700 26.790 -1.522 1.00 30.44 H new ATOM 0 HD3 LYS A 49 5.447 26.145 -0.073 1.00 30.44 H new ATOM 0 HE2 LYS A 49 5.349 24.340 -1.647 1.00 24.24 H new ATOM 0 HE3 LYS A 49 4.134 24.005 -0.429 1.00 24.24 H new ATOM 0 HZ1 LYS A 49 3.131 23.615 -2.504 1.00 32.45 H new ATOM 0 HZ2 LYS A 49 2.494 25.098 -1.977 1.00 32.45 H new ATOM 0 HZ3 LYS A 49 3.705 25.070 -3.167 1.00 32.45 H new ATOM 756 N GLY A 50 1.765 28.704 4.172 1.00 63.34 N ATOM 757 CA GLY A 50 1.727 29.892 5.004 1.00 25.32 C ATOM 758 C GLY A 50 0.463 29.977 5.836 1.00 22.42 C ATOM 759 O GLY A 50 -0.257 30.973 5.783 1.00 11.41 O ATOM 0 H GLY A 50 0.995 28.052 4.321 1.00 63.34 H new ATOM 0 HA2 GLY A 50 2.594 29.897 5.665 1.00 25.32 H new ATOM 0 HA3 GLY A 50 1.803 30.777 4.372 1.00 25.32 H new ATOM 763 N SER A 51 0.192 28.928 6.606 1.00 74.41 N ATOM 764 CA SER A 51 -0.998 28.885 7.449 1.00 43.33 C ATOM 765 C SER A 51 -0.648 29.209 8.898 1.00 12.20 C ATOM 766 O SER A 51 0.293 28.649 9.461 1.00 33.43 O ATOM 767 CB SER A 51 -1.658 27.508 7.367 1.00 62.41 C ATOM 768 OG SER A 51 -1.357 26.729 8.512 1.00 2.11 O ATOM 0 H SER A 51 0.780 28.097 6.664 1.00 74.41 H new ATOM 0 HA SER A 51 -1.698 29.637 7.085 1.00 43.33 H new ATOM 0 HB2 SER A 51 -2.738 27.624 7.276 1.00 62.41 H new ATOM 0 HB3 SER A 51 -1.316 26.990 6.471 1.00 62.41 H new ATOM 0 HG SER A 51 -1.792 25.854 8.436 1.00 2.11 H new ATOM 774 N CYS A 52 -1.412 30.117 9.495 1.00 11.02 N ATOM 775 CA CYS A 52 -1.184 30.517 10.879 1.00 1.42 C ATOM 776 C CYS A 52 -2.100 29.748 11.826 1.00 41.53 C ATOM 777 O CYS A 52 -3.324 29.808 11.707 1.00 61.34 O ATOM 778 CB CYS A 52 -1.410 32.021 11.041 1.00 50.33 C ATOM 779 SG CYS A 52 -3.034 32.588 10.483 1.00 60.30 S ATOM 0 H CYS A 52 -2.194 30.590 9.043 1.00 11.02 H new ATOM 0 HA CYS A 52 -0.150 30.283 11.133 1.00 1.42 H new ATOM 0 HB2 CYS A 52 -1.286 32.285 12.091 1.00 50.33 H new ATOM 0 HB3 CYS A 52 -0.640 32.555 10.485 1.00 50.33 H new ATOM 0 HG CYS A 52 -3.916 31.658 10.699 1.00 60.30 H new ATOM 785 N PHE A 53 -1.499 29.026 12.765 1.00 20.31 N ATOM 786 CA PHE A 53 -2.260 28.242 13.731 1.00 55.30 C ATOM 787 C PHE A 53 -2.767 29.124 14.868 1.00 1.44 C ATOM 788 O PHE A 53 -1.980 29.705 15.617 1.00 63.51 O ATOM 789 CB PHE A 53 -1.399 27.110 14.294 1.00 60.24 C ATOM 790 CG PHE A 53 -1.212 25.967 13.337 1.00 32.22 C ATOM 791 CD1 PHE A 53 -0.586 26.163 12.117 1.00 73.34 C ATOM 792 CD2 PHE A 53 -1.662 24.696 13.659 1.00 51.41 C ATOM 793 CE1 PHE A 53 -0.414 25.113 11.235 1.00 70.25 C ATOM 794 CE2 PHE A 53 -1.492 23.642 12.781 1.00 52.41 C ATOM 795 CZ PHE A 53 -0.866 23.851 11.568 1.00 73.15 C ATOM 0 H PHE A 53 -0.487 28.967 12.878 1.00 20.31 H new ATOM 0 HA PHE A 53 -3.119 27.813 13.216 1.00 55.30 H new ATOM 0 HB2 PHE A 53 -0.422 27.509 14.567 1.00 60.24 H new ATOM 0 HB3 PHE A 53 -1.858 26.736 15.209 1.00 60.24 H new ATOM 0 HD1 PHE A 53 -0.228 27.147 11.852 1.00 73.34 H new ATOM 0 HD2 PHE A 53 -2.151 24.527 14.607 1.00 51.41 H new ATOM 0 HE1 PHE A 53 0.074 25.279 10.286 1.00 70.25 H new ATOM 0 HE2 PHE A 53 -1.848 22.657 13.043 1.00 52.41 H new ATOM 0 HZ PHE A 53 -0.730 23.029 10.881 1.00 73.15 H new ATOM 805 N HIS A 54 -4.087 29.221 14.992 1.00 41.25 N ATOM 806 CA HIS A 54 -4.700 30.032 16.037 1.00 3.54 C ATOM 807 C HIS A 54 -5.456 29.156 17.032 1.00 44.32 C ATOM 808 O HIS A 54 -6.443 29.587 17.628 1.00 2.20 O ATOM 809 CB HIS A 54 -5.648 31.062 15.423 1.00 14.33 C ATOM 810 CG HIS A 54 -6.915 30.467 14.891 1.00 74.11 C ATOM 811 ND1 HIS A 54 -8.162 30.782 15.388 1.00 12.24 N ATOM 812 CD2 HIS A 54 -7.124 29.572 13.897 1.00 22.22 C ATOM 813 CE1 HIS A 54 -9.083 30.105 14.725 1.00 45.51 C ATOM 814 NE2 HIS A 54 -8.479 29.364 13.814 1.00 24.20 N ATOM 0 H HIS A 54 -4.753 28.748 14.381 1.00 41.25 H new ATOM 0 HA HIS A 54 -3.905 30.554 16.570 1.00 3.54 H new ATOM 0 HB2 HIS A 54 -5.896 31.810 16.176 1.00 14.33 H new ATOM 0 HB3 HIS A 54 -5.133 31.582 14.615 1.00 14.33 H new ATOM 0 HD2 HIS A 54 -6.366 29.108 13.283 1.00 22.22 H new ATOM 0 HE1 HIS A 54 -10.148 30.150 14.899 1.00 45.51 H new ATOM 0 HE2 HIS A 54 -8.943 28.739 13.156 1.00 24.20 H new ATOM 822 N ARG A 55 -4.986 27.925 17.205 1.00 41.24 N ATOM 823 CA ARG A 55 -5.619 26.988 18.125 1.00 2.20 C ATOM 824 C ARG A 55 -4.703 25.800 18.406 1.00 14.33 C ATOM 825 O ARG A 55 -4.727 24.802 17.686 1.00 45.14 O ATOM 826 CB ARG A 55 -6.949 26.496 17.551 1.00 2.21 C ATOM 827 CG ARG A 55 -7.845 25.826 18.579 1.00 20.43 C ATOM 828 CD ARG A 55 -8.943 26.763 19.056 1.00 35.45 C ATOM 829 NE ARG A 55 -8.475 28.141 19.171 1.00 14.22 N ATOM 830 CZ ARG A 55 -9.283 29.196 19.147 1.00 23.21 C ATOM 831 NH1 ARG A 55 -10.591 29.030 19.014 1.00 54.24 N ATOM 832 NH2 ARG A 55 -8.781 30.419 19.257 1.00 12.43 N ATOM 0 H ARG A 55 -4.169 27.553 16.720 1.00 41.24 H new ATOM 0 HA ARG A 55 -5.807 27.510 19.063 1.00 2.20 H new ATOM 0 HB2 ARG A 55 -7.481 27.341 17.113 1.00 2.21 H new ATOM 0 HB3 ARG A 55 -6.748 25.793 16.743 1.00 2.21 H new ATOM 0 HG2 ARG A 55 -8.292 24.931 18.146 1.00 20.43 H new ATOM 0 HG3 ARG A 55 -7.246 25.503 19.430 1.00 20.43 H new ATOM 0 HD2 ARG A 55 -9.782 26.722 18.361 1.00 35.45 H new ATOM 0 HD3 ARG A 55 -9.314 26.424 20.023 1.00 35.45 H new ATOM 0 HE ARG A 55 -7.473 28.303 19.275 1.00 14.22 H new ATOM 0 HH11 ARG A 55 -10.980 28.091 18.930 1.00 54.24 H new ATOM 0 HH12 ARG A 55 -11.209 29.841 18.996 1.00 54.24 H new ATOM 0 HH21 ARG A 55 -7.775 30.550 19.360 1.00 12.43 H new ATOM 0 HH22 ARG A 55 -9.401 31.228 19.239 1.00 12.43 H new ATOM 846 N ILE A 56 -3.899 25.916 19.457 1.00 21.14 N ATOM 847 CA ILE A 56 -2.977 24.852 19.834 1.00 63.44 C ATOM 848 C ILE A 56 -3.125 24.492 21.308 1.00 24.21 C ATOM 849 O ILE A 56 -2.864 25.314 22.187 1.00 24.31 O ATOM 850 CB ILE A 56 -1.515 25.250 19.558 1.00 23.01 C ATOM 851 CG1 ILE A 56 -1.100 24.812 18.152 1.00 54.53 C ATOM 852 CG2 ILE A 56 -0.593 24.638 20.602 1.00 32.53 C ATOM 853 CD1 ILE A 56 0.188 25.447 17.676 1.00 13.33 C ATOM 0 H ILE A 56 -3.867 26.736 20.063 1.00 21.14 H new ATOM 0 HA ILE A 56 -3.230 23.985 19.224 1.00 63.44 H new ATOM 0 HB ILE A 56 -1.433 26.335 19.619 1.00 23.01 H new ATOM 0 HG12 ILE A 56 -0.988 23.728 18.136 1.00 54.53 H new ATOM 0 HG13 ILE A 56 -1.898 25.061 17.453 1.00 54.53 H new ATOM 0 HG21 ILE A 56 0.437 24.928 20.393 1.00 32.53 H new ATOM 0 HG22 ILE A 56 -0.877 24.995 21.592 1.00 32.53 H new ATOM 0 HG23 ILE A 56 -0.677 23.552 20.570 1.00 32.53 H new ATOM 0 HD11 ILE A 56 0.420 25.091 16.672 1.00 13.33 H new ATOM 0 HD12 ILE A 56 0.075 26.531 17.659 1.00 13.33 H new ATOM 0 HD13 ILE A 56 0.998 25.178 18.353 1.00 13.33 H new ATOM 865 N ILE A 57 -3.543 23.258 21.571 1.00 10.43 N ATOM 866 CA ILE A 57 -3.722 22.789 22.939 1.00 35.15 C ATOM 867 C ILE A 57 -2.635 21.792 23.326 1.00 74.45 C ATOM 868 O ILE A 57 -2.649 20.631 22.915 1.00 44.13 O ATOM 869 CB ILE A 57 -5.101 22.129 23.132 1.00 63.10 C ATOM 870 CG1 ILE A 57 -6.216 23.112 22.772 1.00 11.52 C ATOM 871 CG2 ILE A 57 -5.259 21.641 24.564 1.00 1.03 C ATOM 872 CD1 ILE A 57 -7.526 22.440 22.426 1.00 13.14 C ATOM 0 H ILE A 57 -3.764 22.566 20.855 1.00 10.43 H new ATOM 0 HA ILE A 57 -3.654 23.665 23.584 1.00 35.15 H new ATOM 0 HB ILE A 57 -5.172 21.269 22.466 1.00 63.10 H new ATOM 0 HG12 ILE A 57 -6.375 23.791 23.610 1.00 11.52 H new ATOM 0 HG13 ILE A 57 -5.894 23.720 21.926 1.00 11.52 H new ATOM 0 HG21 ILE A 57 -6.238 21.177 24.684 1.00 1.03 H new ATOM 0 HG22 ILE A 57 -4.482 20.910 24.787 1.00 1.03 H new ATOM 0 HG23 ILE A 57 -5.171 22.485 25.248 1.00 1.03 H new ATOM 0 HD11 ILE A 57 -8.270 23.198 22.181 1.00 13.14 H new ATOM 0 HD12 ILE A 57 -7.382 21.783 21.569 1.00 13.14 H new ATOM 0 HD13 ILE A 57 -7.871 21.855 23.278 1.00 13.14 H new ATOM 884 N PRO A 58 -1.671 22.252 24.136 1.00 1.01 N ATOM 885 CA PRO A 58 -0.559 21.416 24.598 1.00 70.21 C ATOM 886 C PRO A 58 -1.011 20.343 25.583 1.00 3.11 C ATOM 887 O PRO A 58 -0.850 20.491 26.794 1.00 52.22 O ATOM 888 CB PRO A 58 0.374 22.415 25.286 1.00 2.01 C ATOM 889 CG PRO A 58 -0.514 23.534 25.709 1.00 31.31 C ATOM 890 CD PRO A 58 -1.592 23.624 24.665 1.00 40.25 C ATOM 0 HA PRO A 58 -0.091 20.870 23.778 1.00 70.21 H new ATOM 0 HB2 PRO A 58 0.876 21.963 26.141 1.00 2.01 H new ATOM 0 HB3 PRO A 58 1.152 22.762 24.607 1.00 2.01 H new ATOM 0 HG2 PRO A 58 -0.940 23.343 26.694 1.00 31.31 H new ATOM 0 HG3 PRO A 58 0.042 24.469 25.778 1.00 31.31 H new ATOM 0 HD2 PRO A 58 -2.541 23.944 25.094 1.00 40.25 H new ATOM 0 HD3 PRO A 58 -1.337 24.341 23.885 1.00 40.25 H new ATOM 898 N GLY A 59 -1.576 19.262 25.055 1.00 35.44 N ATOM 899 CA GLY A 59 -2.042 18.180 25.903 1.00 33.31 C ATOM 900 C GLY A 59 -3.133 17.357 25.247 1.00 54.45 C ATOM 901 O GLY A 59 -3.331 16.191 25.586 1.00 20.42 O ATOM 0 H GLY A 59 -1.719 19.116 24.056 1.00 35.44 H new ATOM 0 HA2 GLY A 59 -1.203 17.531 26.153 1.00 33.31 H new ATOM 0 HA3 GLY A 59 -2.416 18.592 26.840 1.00 33.31 H new ATOM 905 N PHE A 60 -3.845 17.967 24.304 1.00 34.33 N ATOM 906 CA PHE A 60 -4.925 17.284 23.600 1.00 4.02 C ATOM 907 C PHE A 60 -4.621 17.181 22.108 1.00 13.43 C ATOM 908 O PHE A 60 -4.558 16.086 21.551 1.00 24.01 O ATOM 909 CB PHE A 60 -6.248 18.022 23.813 1.00 30.35 C ATOM 910 CG PHE A 60 -7.393 17.112 24.158 1.00 4.20 C ATOM 911 CD1 PHE A 60 -7.233 16.097 25.088 1.00 44.51 C ATOM 912 CD2 PHE A 60 -8.628 17.272 23.553 1.00 55.25 C ATOM 913 CE1 PHE A 60 -8.284 15.259 25.406 1.00 30.30 C ATOM 914 CE2 PHE A 60 -9.684 16.437 23.867 1.00 22.30 C ATOM 915 CZ PHE A 60 -9.511 15.429 24.796 1.00 54.32 C ATOM 0 H PHE A 60 -3.694 18.932 24.010 1.00 34.33 H new ATOM 0 HA PHE A 60 -5.010 16.276 24.006 1.00 4.02 H new ATOM 0 HB2 PHE A 60 -6.122 18.754 24.611 1.00 30.35 H new ATOM 0 HB3 PHE A 60 -6.495 18.577 22.908 1.00 30.35 H new ATOM 0 HD1 PHE A 60 -6.276 15.960 25.569 1.00 44.51 H new ATOM 0 HD2 PHE A 60 -8.768 18.059 22.827 1.00 55.25 H new ATOM 0 HE1 PHE A 60 -8.146 14.471 26.132 1.00 30.30 H new ATOM 0 HE2 PHE A 60 -10.642 16.572 23.387 1.00 22.30 H new ATOM 0 HZ PHE A 60 -10.334 14.775 25.045 1.00 54.32 H new ATOM 925 N MET A 61 -4.436 18.331 21.468 1.00 42.01 N ATOM 926 CA MET A 61 -4.139 18.371 20.041 1.00 44.03 C ATOM 927 C MET A 61 -4.063 19.810 19.541 1.00 11.43 C ATOM 928 O MET A 61 -4.626 20.719 20.152 1.00 13.51 O ATOM 929 CB MET A 61 -5.202 17.601 19.255 1.00 42.32 C ATOM 930 CG MET A 61 -6.619 18.089 19.511 1.00 45.03 C ATOM 931 SD MET A 61 -7.328 18.940 18.088 1.00 61.30 S ATOM 932 CE MET A 61 -7.423 20.617 18.709 1.00 21.01 C ATOM 0 H MET A 61 -4.486 19.247 21.915 1.00 42.01 H new ATOM 0 HA MET A 61 -3.169 17.899 19.884 1.00 44.03 H new ATOM 0 HB2 MET A 61 -4.985 17.683 18.190 1.00 42.32 H new ATOM 0 HB3 MET A 61 -5.138 16.544 19.513 1.00 42.32 H new ATOM 0 HG2 MET A 61 -7.250 17.240 19.773 1.00 45.03 H new ATOM 0 HG3 MET A 61 -6.618 18.762 20.369 1.00 45.03 H new ATOM 0 HE1 MET A 61 -8.102 21.198 18.085 1.00 21.01 H new ATOM 0 HE2 MET A 61 -7.793 20.605 19.734 1.00 21.01 H new ATOM 0 HE3 MET A 61 -6.432 21.070 18.686 1.00 21.01 H new ATOM 942 N CYS A 62 -3.365 20.010 18.429 1.00 25.02 N ATOM 943 CA CYS A 62 -3.215 21.340 17.849 1.00 62.33 C ATOM 944 C CYS A 62 -4.327 21.623 16.844 1.00 63.42 C ATOM 945 O CYS A 62 -5.317 20.895 16.780 1.00 53.24 O ATOM 946 CB CYS A 62 -1.851 21.472 17.169 1.00 30.42 C ATOM 947 SG CYS A 62 -0.457 20.985 18.212 1.00 25.12 S ATOM 0 H CYS A 62 -2.894 19.268 17.911 1.00 25.02 H new ATOM 0 HA CYS A 62 -3.283 22.071 18.655 1.00 62.33 H new ATOM 0 HB2 CYS A 62 -1.846 20.861 16.266 1.00 30.42 H new ATOM 0 HB3 CYS A 62 -1.712 22.506 16.855 1.00 30.42 H new ATOM 0 HG CYS A 62 -0.077 22.000 18.930 1.00 25.12 H new ATOM 953 N GLN A 63 -4.156 22.684 16.063 1.00 45.41 N ATOM 954 CA GLN A 63 -5.146 23.064 15.063 1.00 53.31 C ATOM 955 C GLN A 63 -4.770 24.384 14.398 1.00 41.04 C ATOM 956 O GLN A 63 -4.263 25.296 15.049 1.00 43.45 O ATOM 957 CB GLN A 63 -6.531 23.179 15.704 1.00 45.23 C ATOM 958 CG GLN A 63 -7.507 24.018 14.896 1.00 52.33 C ATOM 959 CD GLN A 63 -8.914 23.982 15.460 1.00 22.12 C ATOM 960 OE1 GLN A 63 -9.172 23.332 16.474 1.00 62.35 O ATOM 961 NE2 GLN A 63 -9.833 24.682 14.806 1.00 41.12 N ATOM 0 H GLN A 63 -3.341 23.296 16.103 1.00 45.41 H new ATOM 0 HA GLN A 63 -5.170 22.287 14.299 1.00 53.31 H new ATOM 0 HB2 GLN A 63 -6.946 22.180 15.835 1.00 45.23 H new ATOM 0 HB3 GLN A 63 -6.427 23.614 16.698 1.00 45.23 H new ATOM 0 HG2 GLN A 63 -7.157 25.050 14.869 1.00 52.33 H new ATOM 0 HG3 GLN A 63 -7.523 23.659 13.867 1.00 52.33 H new ATOM 0 HE21 GLN A 63 -9.575 25.206 13.970 1.00 41.12 H new ATOM 0 HE22 GLN A 63 -10.797 24.696 15.140 1.00 41.12 H new ATOM 970 N GLY A 64 -5.022 24.478 13.095 1.00 24.23 N ATOM 971 CA GLY A 64 -4.702 25.690 12.363 1.00 32.54 C ATOM 972 C GLY A 64 -5.095 25.605 10.902 1.00 74.21 C ATOM 973 O GLY A 64 -5.067 24.529 10.305 1.00 4.24 O ATOM 0 H GLY A 64 -5.442 23.737 12.534 1.00 24.23 H new ATOM 0 HA2 GLY A 64 -5.212 26.535 12.825 1.00 32.54 H new ATOM 0 HA3 GLY A 64 -3.632 25.884 12.438 1.00 32.54 H new ATOM 1153 N ILE A 78 -10.126 21.745 -2.393 1.00 31.34 N ATOM 1154 CA ILE A 78 -9.698 21.847 -3.782 1.00 53.13 C ATOM 1155 C ILE A 78 -10.786 21.353 -4.730 1.00 51.51 C ATOM 1156 O ILE A 78 -10.524 21.069 -5.899 1.00 44.51 O ATOM 1157 CB ILE A 78 -8.409 21.043 -4.035 1.00 52.22 C ATOM 1158 CG1 ILE A 78 -8.648 19.556 -3.763 1.00 43.52 C ATOM 1159 CG2 ILE A 78 -7.277 21.571 -3.167 1.00 41.11 C ATOM 1160 CD1 ILE A 78 -9.101 18.784 -4.982 1.00 42.23 C ATOM 0 HA ILE A 78 -9.502 22.902 -3.975 1.00 53.13 H new ATOM 0 HB ILE A 78 -8.124 21.160 -5.080 1.00 52.22 H new ATOM 0 HG12 ILE A 78 -7.728 19.112 -3.383 1.00 43.52 H new ATOM 0 HG13 ILE A 78 -9.398 19.454 -2.979 1.00 43.52 H new ATOM 0 HG21 ILE A 78 -6.373 20.993 -3.357 1.00 41.11 H new ATOM 0 HG22 ILE A 78 -7.094 22.619 -3.405 1.00 41.11 H new ATOM 0 HG23 ILE A 78 -7.552 21.480 -2.116 1.00 41.11 H new ATOM 0 HD11 ILE A 78 -9.251 17.738 -4.715 1.00 42.23 H new ATOM 0 HD12 ILE A 78 -10.038 19.202 -5.350 1.00 42.23 H new ATOM 0 HD13 ILE A 78 -8.341 18.855 -5.760 1.00 42.23 H new ATOM 1172 N TYR A 79 -12.008 21.255 -4.219 1.00 52.41 N ATOM 1173 CA TYR A 79 -13.137 20.796 -5.020 1.00 22.43 C ATOM 1174 C TYR A 79 -14.093 21.945 -5.324 1.00 62.13 C ATOM 1175 O TYR A 79 -14.257 22.342 -6.477 1.00 1.20 O ATOM 1176 CB TYR A 79 -13.883 19.676 -4.292 1.00 0.12 C ATOM 1177 CG TYR A 79 -13.723 18.320 -4.941 1.00 24.12 C ATOM 1178 CD1 TYR A 79 -14.464 17.974 -6.064 1.00 65.22 C ATOM 1179 CD2 TYR A 79 -12.831 17.384 -4.430 1.00 52.54 C ATOM 1180 CE1 TYR A 79 -14.321 16.736 -6.660 1.00 60.42 C ATOM 1181 CE2 TYR A 79 -12.681 16.145 -5.021 1.00 30.43 C ATOM 1182 CZ TYR A 79 -13.428 15.825 -6.135 1.00 72.21 C ATOM 1183 OH TYR A 79 -13.283 14.590 -6.725 1.00 45.22 O ATOM 0 H TYR A 79 -12.242 21.487 -3.254 1.00 52.41 H new ATOM 0 HA TYR A 79 -12.748 20.412 -5.963 1.00 22.43 H new ATOM 0 HB2 TYR A 79 -13.526 19.622 -3.264 1.00 0.12 H new ATOM 0 HB3 TYR A 79 -14.943 19.926 -4.248 1.00 0.12 H new ATOM 0 HD1 TYR A 79 -15.164 18.685 -6.478 1.00 65.22 H new ATOM 0 HD2 TYR A 79 -12.246 17.630 -3.556 1.00 52.54 H new ATOM 0 HE1 TYR A 79 -14.905 16.483 -7.532 1.00 60.42 H new ATOM 0 HE2 TYR A 79 -11.982 15.430 -4.613 1.00 30.43 H new ATOM 0 HH TYR A 79 -12.614 14.069 -6.233 1.00 45.22 H new ATOM 1193 N GLY A 80 -14.722 22.476 -4.280 1.00 23.31 N ATOM 1194 CA GLY A 80 -15.653 23.575 -4.455 1.00 33.41 C ATOM 1195 C GLY A 80 -16.319 23.983 -3.156 1.00 33.42 C ATOM 1196 O GLY A 80 -16.623 25.157 -2.949 1.00 43.03 O ATOM 0 H GLY A 80 -14.603 22.164 -3.316 1.00 23.31 H new ATOM 0 HA2 GLY A 80 -15.125 24.432 -4.873 1.00 33.41 H new ATOM 0 HA3 GLY A 80 -16.417 23.288 -5.177 1.00 33.41 H new ATOM 1200 N GLU A 81 -16.548 23.010 -2.279 1.00 14.01 N ATOM 1201 CA GLU A 81 -17.185 23.275 -0.994 1.00 54.03 C ATOM 1202 C GLU A 81 -16.547 22.441 0.112 1.00 24.42 C ATOM 1203 O GLU A 81 -16.095 22.974 1.126 1.00 61.31 O ATOM 1204 CB GLU A 81 -18.684 22.977 -1.072 1.00 52.20 C ATOM 1205 CG GLU A 81 -19.344 23.500 -2.337 1.00 1.20 C ATOM 1206 CD GLU A 81 -19.371 25.015 -2.397 1.00 53.11 C ATOM 1207 OE1 GLU A 81 -18.852 25.655 -1.459 1.00 25.12 O ATOM 1208 OE2 GLU A 81 -19.912 25.561 -3.381 1.00 71.24 O ATOM 0 H GLU A 81 -16.302 22.032 -2.435 1.00 14.01 H new ATOM 0 HA GLU A 81 -17.043 24.330 -0.758 1.00 54.03 H new ATOM 0 HB2 GLU A 81 -18.835 21.899 -1.013 1.00 52.20 H new ATOM 0 HB3 GLU A 81 -19.179 23.417 -0.206 1.00 52.20 H new ATOM 0 HG2 GLU A 81 -18.811 23.115 -3.206 1.00 1.20 H new ATOM 0 HG3 GLU A 81 -20.364 23.120 -2.394 1.00 1.20 H new ATOM 1215 N LYS A 82 -16.513 21.128 -0.090 1.00 21.34 N ATOM 1216 CA LYS A 82 -15.930 20.217 0.889 1.00 43.53 C ATOM 1217 C LYS A 82 -16.148 18.765 0.478 1.00 65.31 C ATOM 1218 O LYS A 82 -16.709 18.486 -0.582 1.00 44.41 O ATOM 1219 CB LYS A 82 -16.538 20.464 2.271 1.00 4.23 C ATOM 1220 CG LYS A 82 -18.043 20.663 2.247 1.00 12.21 C ATOM 1221 CD LYS A 82 -18.766 19.399 1.814 1.00 61.31 C ATOM 1222 CE LYS A 82 -19.334 19.535 0.410 1.00 71.34 C ATOM 1223 NZ LYS A 82 -20.432 20.539 0.350 1.00 33.25 N ATOM 0 H LYS A 82 -16.883 20.670 -0.923 1.00 21.34 H new ATOM 0 HA LYS A 82 -14.858 20.407 0.932 1.00 43.53 H new ATOM 0 HB2 LYS A 82 -16.302 19.620 2.919 1.00 4.23 H new ATOM 0 HB3 LYS A 82 -16.071 21.344 2.712 1.00 4.23 H new ATOM 0 HG2 LYS A 82 -18.388 20.959 3.238 1.00 12.21 H new ATOM 0 HG3 LYS A 82 -18.292 21.477 1.566 1.00 12.21 H new ATOM 0 HD2 LYS A 82 -18.077 18.555 1.849 1.00 61.31 H new ATOM 0 HD3 LYS A 82 -19.572 19.182 2.514 1.00 61.31 H new ATOM 0 HE2 LYS A 82 -18.539 19.825 -0.277 1.00 71.34 H new ATOM 0 HE3 LYS A 82 -19.708 18.568 0.074 1.00 71.34 H new ATOM 0 HZ1 LYS A 82 -20.769 20.627 -0.630 1.00 33.25 H new ATOM 0 HZ2 LYS A 82 -21.217 20.232 0.960 1.00 33.25 H new ATOM 0 HZ3 LYS A 82 -20.078 21.460 0.678 1.00 33.25 H new ATOM 1237 N PHE A 83 -15.702 17.842 1.324 1.00 44.01 N ATOM 1238 CA PHE A 83 -15.848 16.418 1.049 1.00 75.44 C ATOM 1239 C PHE A 83 -16.885 15.789 1.975 1.00 21.42 C ATOM 1240 O PHE A 83 -17.632 16.491 2.655 1.00 50.52 O ATOM 1241 CB PHE A 83 -14.504 15.704 1.209 1.00 15.24 C ATOM 1242 CG PHE A 83 -13.321 16.582 0.916 1.00 32.42 C ATOM 1243 CD1 PHE A 83 -12.885 17.512 1.845 1.00 11.43 C ATOM 1244 CD2 PHE A 83 -12.645 16.476 -0.289 1.00 14.12 C ATOM 1245 CE1 PHE A 83 -11.796 18.321 1.579 1.00 53.21 C ATOM 1246 CE2 PHE A 83 -11.556 17.282 -0.561 1.00 21.24 C ATOM 1247 CZ PHE A 83 -11.132 18.206 0.374 1.00 44.32 C ATOM 0 H PHE A 83 -15.236 18.055 2.206 1.00 44.01 H new ATOM 0 HA PHE A 83 -16.190 16.306 0.020 1.00 75.44 H new ATOM 0 HB2 PHE A 83 -14.422 15.325 2.228 1.00 15.24 H new ATOM 0 HB3 PHE A 83 -14.479 14.840 0.545 1.00 15.24 H new ATOM 0 HD1 PHE A 83 -13.402 17.606 2.789 1.00 11.43 H new ATOM 0 HD2 PHE A 83 -12.973 15.755 -1.024 1.00 14.12 H new ATOM 0 HE1 PHE A 83 -11.465 19.042 2.312 1.00 53.21 H new ATOM 0 HE2 PHE A 83 -11.037 17.190 -1.504 1.00 21.24 H new ATOM 0 HZ PHE A 83 -10.282 18.838 0.163 1.00 44.32 H new ATOM 1257 N GLU A 84 -16.923 14.460 1.995 1.00 32.13 N ATOM 1258 CA GLU A 84 -17.869 13.736 2.837 1.00 2.31 C ATOM 1259 C GLU A 84 -17.172 12.608 3.592 1.00 10.14 C ATOM 1260 O GLU A 84 -16.068 12.197 3.236 1.00 44.42 O ATOM 1261 CB GLU A 84 -19.010 13.169 1.990 1.00 44.03 C ATOM 1262 CG GLU A 84 -18.556 12.139 0.969 1.00 24.12 C ATOM 1263 CD GLU A 84 -18.040 12.772 -0.309 1.00 22.43 C ATOM 1264 OE1 GLU A 84 -18.438 13.917 -0.607 1.00 71.32 O ATOM 1265 OE2 GLU A 84 -17.237 12.121 -1.010 1.00 60.20 O ATOM 0 H GLU A 84 -16.311 13.864 1.439 1.00 32.13 H new ATOM 0 HA GLU A 84 -18.280 14.437 3.564 1.00 2.31 H new ATOM 0 HB2 GLU A 84 -19.749 12.714 2.649 1.00 44.03 H new ATOM 0 HB3 GLU A 84 -19.508 13.988 1.471 1.00 44.03 H new ATOM 0 HG2 GLU A 84 -17.772 11.521 1.406 1.00 24.12 H new ATOM 0 HG3 GLU A 84 -19.389 11.477 0.732 1.00 24.12 H new ATOM 1272 N ASP A 85 -17.825 12.112 4.638 1.00 52.54 N ATOM 1273 CA ASP A 85 -17.270 11.032 5.444 1.00 61.41 C ATOM 1274 C ASP A 85 -16.752 9.903 4.557 1.00 12.25 C ATOM 1275 O ASP A 85 -17.532 9.124 4.011 1.00 21.52 O ATOM 1276 CB ASP A 85 -18.326 10.494 6.411 1.00 63.20 C ATOM 1277 CG ASP A 85 -17.941 9.151 6.999 1.00 33.53 C ATOM 1278 OD1 ASP A 85 -16.785 9.009 7.451 1.00 15.23 O ATOM 1279 OD2 ASP A 85 -18.796 8.241 7.009 1.00 74.24 O ATOM 0 H ASP A 85 -18.740 12.441 4.947 1.00 52.54 H new ATOM 0 HA ASP A 85 -16.434 11.432 6.017 1.00 61.41 H new ATOM 0 HB2 ASP A 85 -18.475 11.212 7.218 1.00 63.20 H new ATOM 0 HB3 ASP A 85 -19.278 10.399 5.889 1.00 63.20 H new ATOM 1284 N GLU A 86 -15.432 9.824 4.419 1.00 34.12 N ATOM 1285 CA GLU A 86 -14.812 8.792 3.597 1.00 22.22 C ATOM 1286 C GLU A 86 -14.721 7.472 4.358 1.00 43.11 C ATOM 1287 O GLU A 86 -15.384 6.496 4.010 1.00 43.01 O ATOM 1288 CB GLU A 86 -13.416 9.234 3.152 1.00 72.20 C ATOM 1289 CG GLU A 86 -13.013 8.695 1.790 1.00 42.13 C ATOM 1290 CD GLU A 86 -14.019 9.034 0.707 1.00 1.10 C ATOM 1291 OE1 GLU A 86 -14.494 10.189 0.681 1.00 75.34 O ATOM 1292 OE2 GLU A 86 -14.331 8.146 -0.113 1.00 61.21 O ATOM 0 H GLU A 86 -14.773 10.461 4.865 1.00 34.12 H new ATOM 0 HA GLU A 86 -15.436 8.641 2.716 1.00 22.22 H new ATOM 0 HB2 GLU A 86 -13.379 10.323 3.128 1.00 72.20 H new ATOM 0 HB3 GLU A 86 -12.687 8.907 3.893 1.00 72.20 H new ATOM 0 HG2 GLU A 86 -12.039 9.101 1.516 1.00 42.13 H new ATOM 0 HG3 GLU A 86 -12.901 7.612 1.851 1.00 42.13 H new ATOM 1299 N ASN A 87 -13.894 7.451 5.398 1.00 2.32 N ATOM 1300 CA ASN A 87 -13.714 6.252 6.208 1.00 33.11 C ATOM 1301 C ASN A 87 -12.757 6.516 7.367 1.00 73.14 C ATOM 1302 O ASN A 87 -12.155 7.586 7.457 1.00 62.22 O ATOM 1303 CB ASN A 87 -13.185 5.104 5.346 1.00 30.23 C ATOM 1304 CG ASN A 87 -11.892 5.461 4.638 1.00 32.44 C ATOM 1305 OD1 ASN A 87 -11.187 6.387 5.039 1.00 31.35 O ATOM 1306 ND2 ASN A 87 -11.575 4.725 3.579 1.00 15.20 N ATOM 0 H ASN A 87 -13.338 8.251 5.700 1.00 2.32 H new ATOM 0 HA ASN A 87 -14.684 5.972 6.619 1.00 33.11 H new ATOM 0 HB2 ASN A 87 -13.023 4.227 5.973 1.00 30.23 H new ATOM 0 HB3 ASN A 87 -13.938 4.832 4.606 1.00 30.23 H new ATOM 0 HD21 ASN A 87 -10.717 4.918 3.062 1.00 15.20 H new ATOM 0 HD22 ASN A 87 -12.190 3.967 3.282 1.00 15.20 H new ATOM 1313 N PHE A 88 -12.622 5.533 8.251 1.00 41.12 N ATOM 1314 CA PHE A 88 -11.739 5.659 9.404 1.00 25.32 C ATOM 1315 C PHE A 88 -10.787 4.469 9.493 1.00 74.11 C ATOM 1316 O PHE A 88 -10.451 4.010 10.585 1.00 43.11 O ATOM 1317 CB PHE A 88 -12.558 5.768 10.692 1.00 72.14 C ATOM 1318 CG PHE A 88 -13.972 6.220 10.465 1.00 15.13 C ATOM 1319 CD1 PHE A 88 -14.966 5.304 10.159 1.00 10.12 C ATOM 1320 CD2 PHE A 88 -14.309 7.561 10.559 1.00 64.00 C ATOM 1321 CE1 PHE A 88 -16.268 5.718 9.950 1.00 60.33 C ATOM 1322 CE2 PHE A 88 -15.609 7.981 10.351 1.00 71.51 C ATOM 1323 CZ PHE A 88 -16.590 7.057 10.047 1.00 52.31 C ATOM 0 H PHE A 88 -13.113 4.641 8.191 1.00 41.12 H new ATOM 0 HA PHE A 88 -11.148 6.567 9.279 1.00 25.32 H new ATOM 0 HB2 PHE A 88 -12.570 4.798 11.189 1.00 72.14 H new ATOM 0 HB3 PHE A 88 -12.066 6.467 11.369 1.00 72.14 H new ATOM 0 HD1 PHE A 88 -14.720 4.255 10.083 1.00 10.12 H new ATOM 0 HD2 PHE A 88 -13.546 8.287 10.798 1.00 64.00 H new ATOM 0 HE1 PHE A 88 -17.033 4.994 9.711 1.00 60.33 H new ATOM 0 HE2 PHE A 88 -15.858 9.029 10.426 1.00 71.51 H new ATOM 0 HZ PHE A 88 -17.607 7.382 9.885 1.00 52.31 H new ATOM 1333 N ILE A 89 -10.359 3.974 8.337 1.00 41.24 N ATOM 1334 CA ILE A 89 -9.447 2.839 8.283 1.00 23.42 C ATOM 1335 C ILE A 89 -8.247 3.053 9.200 1.00 13.31 C ATOM 1336 O ILE A 89 -7.666 2.097 9.714 1.00 23.11 O ATOM 1337 CB ILE A 89 -8.944 2.587 6.849 1.00 1.33 C ATOM 1338 CG1 ILE A 89 -10.123 2.515 5.877 1.00 13.23 C ATOM 1339 CG2 ILE A 89 -8.124 1.307 6.792 1.00 33.22 C ATOM 1340 CD1 ILE A 89 -9.818 1.742 4.614 1.00 74.44 C ATOM 0 H ILE A 89 -10.629 4.341 7.425 1.00 41.24 H new ATOM 0 HA ILE A 89 -10.009 1.968 8.620 1.00 23.42 H new ATOM 0 HB ILE A 89 -8.304 3.418 6.553 1.00 1.33 H new ATOM 0 HG12 ILE A 89 -10.971 2.052 6.381 1.00 13.23 H new ATOM 0 HG13 ILE A 89 -10.425 3.528 5.610 1.00 13.23 H new ATOM 0 HG21 ILE A 89 -7.776 1.143 5.772 1.00 33.22 H new ATOM 0 HG22 ILE A 89 -7.266 1.395 7.459 1.00 33.22 H new ATOM 0 HG23 ILE A 89 -8.742 0.465 7.104 1.00 33.22 H new ATOM 0 HD11 ILE A 89 -10.699 1.732 3.972 1.00 74.44 H new ATOM 0 HD12 ILE A 89 -8.990 2.217 4.087 1.00 74.44 H new ATOM 0 HD13 ILE A 89 -9.545 0.719 4.871 1.00 74.44 H new ATOM 1352 N LEU A 90 -7.883 4.315 9.403 1.00 70.43 N ATOM 1353 CA LEU A 90 -6.753 4.656 10.260 1.00 13.42 C ATOM 1354 C LEU A 90 -7.210 5.483 11.458 1.00 24.34 C ATOM 1355 O LEU A 90 -6.892 6.667 11.567 1.00 41.21 O ATOM 1356 CB LEU A 90 -5.700 5.429 9.465 1.00 44.11 C ATOM 1357 CG LEU A 90 -5.262 4.800 8.142 1.00 74.24 C ATOM 1358 CD1 LEU A 90 -4.550 5.825 7.273 1.00 72.43 C ATOM 1359 CD2 LEU A 90 -4.366 3.596 8.394 1.00 42.41 C ATOM 0 H LEU A 90 -8.354 5.118 8.986 1.00 70.43 H new ATOM 0 HA LEU A 90 -6.314 3.729 10.627 1.00 13.42 H new ATOM 0 HB2 LEU A 90 -6.089 6.426 9.259 1.00 44.11 H new ATOM 0 HB3 LEU A 90 -4.819 5.554 10.094 1.00 44.11 H new ATOM 0 HG LEU A 90 -6.152 4.460 7.612 1.00 74.24 H new ATOM 0 HD11 LEU A 90 -4.246 5.359 6.336 1.00 72.43 H new ATOM 0 HD12 LEU A 90 -5.224 6.655 7.063 1.00 72.43 H new ATOM 0 HD13 LEU A 90 -3.669 6.196 7.796 1.00 72.43 H new ATOM 0 HD21 LEU A 90 -4.064 3.161 7.441 1.00 42.41 H new ATOM 0 HD22 LEU A 90 -3.480 3.911 8.946 1.00 42.41 H new ATOM 0 HD23 LEU A 90 -4.911 2.852 8.976 1.00 42.41 H new ATOM 1371 N LYS A 91 -7.955 4.849 12.358 1.00 41.52 N ATOM 1372 CA LYS A 91 -8.453 5.524 13.551 1.00 63.40 C ATOM 1373 C LYS A 91 -7.299 5.999 14.428 1.00 11.52 C ATOM 1374 O LYS A 91 -6.152 5.593 14.237 1.00 13.33 O ATOM 1375 CB LYS A 91 -9.362 4.587 14.349 1.00 23.45 C ATOM 1376 CG LYS A 91 -10.838 4.762 14.040 1.00 73.45 C ATOM 1377 CD LYS A 91 -11.670 3.636 14.631 1.00 25.33 C ATOM 1378 CE LYS A 91 -12.933 4.164 15.294 1.00 43.15 C ATOM 1379 NZ LYS A 91 -14.109 4.091 14.383 1.00 45.44 N ATOM 0 H LYS A 91 -8.227 3.869 12.284 1.00 41.52 H new ATOM 0 HA LYS A 91 -9.027 6.394 13.234 1.00 63.40 H new ATOM 0 HB2 LYS A 91 -9.076 3.555 14.143 1.00 23.45 H new ATOM 0 HB3 LYS A 91 -9.200 4.757 15.413 1.00 23.45 H new ATOM 0 HG2 LYS A 91 -11.183 5.717 14.437 1.00 73.45 H new ATOM 0 HG3 LYS A 91 -10.983 4.794 12.960 1.00 73.45 H new ATOM 0 HD2 LYS A 91 -11.938 2.930 13.845 1.00 25.33 H new ATOM 0 HD3 LYS A 91 -11.076 3.088 15.362 1.00 25.33 H new ATOM 0 HE2 LYS A 91 -13.137 3.589 16.197 1.00 43.15 H new ATOM 0 HE3 LYS A 91 -12.776 5.198 15.603 1.00 43.15 H new ATOM 0 HZ1 LYS A 91 -14.950 4.460 14.871 1.00 45.44 H new ATOM 0 HZ2 LYS A 91 -13.925 4.660 13.532 1.00 45.44 H new ATOM 0 HZ3 LYS A 91 -14.274 3.102 14.108 1.00 45.44 H new ATOM 1393 N HIS A 92 -7.610 6.861 15.391 1.00 13.41 N ATOM 1394 CA HIS A 92 -6.599 7.391 16.299 1.00 32.34 C ATOM 1395 C HIS A 92 -6.079 6.299 17.229 1.00 64.51 C ATOM 1396 O HIS A 92 -6.542 6.159 18.361 1.00 21.43 O ATOM 1397 CB HIS A 92 -7.175 8.544 17.121 1.00 13.23 C ATOM 1398 CG HIS A 92 -8.209 9.343 16.390 1.00 54.04 C ATOM 1399 ND1 HIS A 92 -9.538 8.979 16.329 1.00 30.22 N ATOM 1400 CD2 HIS A 92 -8.104 10.495 15.686 1.00 32.32 C ATOM 1401 CE1 HIS A 92 -10.205 9.871 15.619 1.00 61.12 C ATOM 1402 NE2 HIS A 92 -9.358 10.801 15.217 1.00 1.54 N ATOM 0 H HIS A 92 -8.554 7.207 15.563 1.00 13.41 H new ATOM 0 HA HIS A 92 -5.767 7.762 15.700 1.00 32.34 H new ATOM 0 HB2 HIS A 92 -7.616 8.144 18.034 1.00 13.23 H new ATOM 0 HB3 HIS A 92 -6.363 9.206 17.423 1.00 13.23 H new ATOM 0 HD2 HIS A 92 -7.202 11.067 15.524 1.00 32.32 H new ATOM 0 HE1 HIS A 92 -11.263 9.844 15.404 1.00 61.12 H new ATOM 0 HE2 HIS A 92 -9.596 11.615 14.650 1.00 1.54 H new ATOM 1410 N THR A 93 -5.113 5.525 16.743 1.00 43.03 N ATOM 1411 CA THR A 93 -4.531 4.444 17.528 1.00 4.34 C ATOM 1412 C THR A 93 -3.201 4.866 18.143 1.00 63.22 C ATOM 1413 O THR A 93 -2.352 4.028 18.445 1.00 33.14 O ATOM 1414 CB THR A 93 -4.311 3.183 16.672 1.00 22.24 C ATOM 1415 OG1 THR A 93 -3.806 3.548 15.383 1.00 72.51 O ATOM 1416 CG2 THR A 93 -5.608 2.404 16.513 1.00 1.03 C ATOM 0 H THR A 93 -4.717 5.627 15.808 1.00 43.03 H new ATOM 0 HA THR A 93 -5.240 4.214 18.324 1.00 4.34 H new ATOM 0 HB THR A 93 -3.585 2.548 17.179 1.00 22.24 H new ATOM 0 HG1 THR A 93 -3.667 2.740 14.845 1.00 72.51 H new ATOM 0 HG21 THR A 93 -5.428 1.518 15.905 1.00 1.03 H new ATOM 0 HG22 THR A 93 -5.974 2.102 17.494 1.00 1.03 H new ATOM 0 HG23 THR A 93 -6.353 3.033 16.026 1.00 1.03 H new ATOM 1424 N GLY A 94 -3.025 6.171 18.325 1.00 15.24 N ATOM 1425 CA GLY A 94 -1.796 6.681 18.904 1.00 60.22 C ATOM 1426 C GLY A 94 -1.521 8.118 18.508 1.00 70.12 C ATOM 1427 O GLY A 94 -2.265 8.725 17.737 1.00 2.12 O ATOM 0 H GLY A 94 -3.712 6.885 18.082 1.00 15.24 H new ATOM 0 HA2 GLY A 94 -1.854 6.611 19.990 1.00 60.22 H new ATOM 0 HA3 GLY A 94 -0.962 6.054 18.588 1.00 60.22 H new ATOM 1431 N PRO A 95 -0.430 8.685 19.043 1.00 23.12 N ATOM 1432 CA PRO A 95 -0.034 10.067 18.756 1.00 30.02 C ATOM 1433 C PRO A 95 0.457 10.244 17.323 1.00 21.34 C ATOM 1434 O PRO A 95 0.663 9.268 16.603 1.00 45.21 O ATOM 1435 CB PRO A 95 1.104 10.323 19.747 1.00 3.01 C ATOM 1436 CG PRO A 95 1.663 8.973 20.039 1.00 44.42 C ATOM 1437 CD PRO A 95 0.502 8.020 19.969 1.00 3.35 C ATOM 0 HA PRO A 95 -0.869 10.760 18.857 1.00 30.02 H new ATOM 0 HB2 PRO A 95 1.861 10.981 19.320 1.00 3.01 H new ATOM 0 HB3 PRO A 95 0.738 10.805 20.654 1.00 3.01 H new ATOM 0 HG2 PRO A 95 2.433 8.704 19.315 1.00 44.42 H new ATOM 0 HG3 PRO A 95 2.129 8.948 21.024 1.00 44.42 H new ATOM 0 HD2 PRO A 95 0.807 7.042 19.598 1.00 3.35 H new ATOM 0 HD3 PRO A 95 0.051 7.863 20.949 1.00 3.35 H new ATOM 1445 N GLY A 96 0.643 11.496 16.916 1.00 32.14 N ATOM 1446 CA GLY A 96 1.109 11.777 15.571 1.00 12.21 C ATOM 1447 C GLY A 96 0.109 11.358 14.512 1.00 61.53 C ATOM 1448 O GLY A 96 0.488 10.828 13.466 1.00 1.35 O ATOM 0 H GLY A 96 0.479 12.320 17.494 1.00 32.14 H new ATOM 0 HA2 GLY A 96 1.310 12.844 15.475 1.00 12.21 H new ATOM 0 HA3 GLY A 96 2.053 11.258 15.401 1.00 12.21 H new ATOM 1452 N ILE A 97 -1.170 11.592 14.782 1.00 55.21 N ATOM 1453 CA ILE A 97 -2.227 11.234 13.844 1.00 40.12 C ATOM 1454 C ILE A 97 -2.841 12.476 13.207 1.00 13.34 C ATOM 1455 O ILE A 97 -3.117 13.465 13.889 1.00 74.51 O ATOM 1456 CB ILE A 97 -3.339 10.420 14.532 1.00 42.22 C ATOM 1457 CG1 ILE A 97 -2.834 9.018 14.879 1.00 0.23 C ATOM 1458 CG2 ILE A 97 -4.567 10.340 13.638 1.00 52.32 C ATOM 1459 CD1 ILE A 97 -2.422 8.208 13.671 1.00 63.45 C ATOM 0 H ILE A 97 -1.500 12.028 15.643 1.00 55.21 H new ATOM 0 HA ILE A 97 -1.766 10.621 13.069 1.00 40.12 H new ATOM 0 HB ILE A 97 -3.619 10.924 15.457 1.00 42.22 H new ATOM 0 HG12 ILE A 97 -1.984 9.104 15.556 1.00 0.23 H new ATOM 0 HG13 ILE A 97 -3.616 8.482 15.416 1.00 0.23 H new ATOM 0 HG21 ILE A 97 -5.344 9.762 14.138 1.00 52.32 H new ATOM 0 HG22 ILE A 97 -4.936 11.345 13.436 1.00 52.32 H new ATOM 0 HG23 ILE A 97 -4.302 9.855 12.698 1.00 52.32 H new ATOM 0 HD11 ILE A 97 -2.075 7.226 13.993 1.00 63.45 H new ATOM 0 HD12 ILE A 97 -3.276 8.091 13.003 1.00 63.45 H new ATOM 0 HD13 ILE A 97 -1.618 8.723 13.145 1.00 63.45 H new ATOM 1471 N LEU A 98 -3.055 12.419 11.898 1.00 42.05 N ATOM 1472 CA LEU A 98 -3.639 13.539 11.168 1.00 51.01 C ATOM 1473 C LEU A 98 -5.104 13.270 10.840 1.00 52.05 C ATOM 1474 O LEU A 98 -5.539 12.119 10.792 1.00 0.44 O ATOM 1475 CB LEU A 98 -2.855 13.799 9.880 1.00 34.22 C ATOM 1476 CG LEU A 98 -2.190 15.171 9.765 1.00 72.25 C ATOM 1477 CD1 LEU A 98 -1.792 15.451 8.324 1.00 52.32 C ATOM 1478 CD2 LEU A 98 -3.118 16.259 10.285 1.00 70.10 C ATOM 0 H LEU A 98 -2.833 11.609 11.319 1.00 42.05 H new ATOM 0 HA LEU A 98 -3.584 14.423 11.803 1.00 51.01 H new ATOM 0 HB2 LEU A 98 -2.084 13.035 9.787 1.00 34.22 H new ATOM 0 HB3 LEU A 98 -3.532 13.673 9.035 1.00 34.22 H new ATOM 0 HG LEU A 98 -1.288 15.169 10.376 1.00 72.25 H new ATOM 0 HD11 LEU A 98 -1.320 16.432 8.261 1.00 52.32 H new ATOM 0 HD12 LEU A 98 -1.091 14.688 7.986 1.00 52.32 H new ATOM 0 HD13 LEU A 98 -2.680 15.434 7.692 1.00 52.32 H new ATOM 0 HD21 LEU A 98 -2.628 17.229 10.195 1.00 70.10 H new ATOM 0 HD22 LEU A 98 -4.038 16.262 9.701 1.00 70.10 H new ATOM 0 HD23 LEU A 98 -3.353 16.067 11.332 1.00 70.10 H new ATOM 1490 N SER A 99 -5.860 14.339 10.611 1.00 11.21 N ATOM 1491 CA SER A 99 -7.277 14.219 10.288 1.00 30.24 C ATOM 1492 C SER A 99 -7.801 15.504 9.654 1.00 21.32 C ATOM 1493 O SER A 99 -7.126 16.123 8.833 1.00 41.05 O ATOM 1494 CB SER A 99 -8.083 13.893 11.547 1.00 23.24 C ATOM 1495 OG SER A 99 -9.321 13.289 11.218 1.00 34.40 O ATOM 0 H SER A 99 -5.515 15.298 10.643 1.00 11.21 H new ATOM 0 HA SER A 99 -7.393 13.407 9.570 1.00 30.24 H new ATOM 0 HB2 SER A 99 -7.508 13.225 12.188 1.00 23.24 H new ATOM 0 HB3 SER A 99 -8.260 14.806 12.116 1.00 23.24 H new ATOM 0 HG SER A 99 -9.458 13.331 10.249 1.00 34.40 H new ATOM 1501 N MET A 100 -9.009 15.898 10.043 1.00 72.14 N ATOM 1502 CA MET A 100 -9.624 17.110 9.513 1.00 31.34 C ATOM 1503 C MET A 100 -10.611 17.701 10.515 1.00 21.33 C ATOM 1504 O MET A 100 -11.254 16.972 11.271 1.00 42.54 O ATOM 1505 CB MET A 100 -10.337 16.811 8.193 1.00 32.23 C ATOM 1506 CG MET A 100 -9.388 16.565 7.032 1.00 42.32 C ATOM 1507 SD MET A 100 -8.348 17.994 6.671 1.00 72.43 S ATOM 1508 CE MET A 100 -7.773 17.586 5.024 1.00 53.30 C ATOM 0 H MET A 100 -9.581 15.397 10.722 1.00 72.14 H new ATOM 0 HA MET A 100 -8.834 17.840 9.333 1.00 31.34 H new ATOM 0 HB2 MET A 100 -10.973 15.936 8.323 1.00 32.23 H new ATOM 0 HB3 MET A 100 -10.992 17.647 7.946 1.00 32.23 H new ATOM 0 HG2 MET A 100 -8.755 15.708 7.261 1.00 42.32 H new ATOM 0 HG3 MET A 100 -9.965 16.307 6.144 1.00 42.32 H new ATOM 0 HE1 MET A 100 -6.691 17.709 4.976 1.00 53.30 H new ATOM 0 HE2 MET A 100 -8.032 16.552 4.794 1.00 53.30 H new ATOM 0 HE3 MET A 100 -8.246 18.248 4.299 1.00 53.30 H new ATOM 1518 N ALA A 101 -10.725 19.025 10.516 1.00 21.20 N ATOM 1519 CA ALA A 101 -11.634 19.713 11.424 1.00 75.31 C ATOM 1520 C ALA A 101 -12.623 20.583 10.655 1.00 2.44 C ATOM 1521 O ALA A 101 -12.320 21.068 9.566 1.00 55.20 O ATOM 1522 CB ALA A 101 -10.850 20.554 12.420 1.00 40.24 C ATOM 0 H ALA A 101 -10.199 19.643 9.898 1.00 21.20 H new ATOM 0 HA ALA A 101 -12.202 18.960 11.970 1.00 75.31 H new ATOM 0 HB1 ALA A 101 -11.542 21.062 13.092 1.00 40.24 H new ATOM 0 HB2 ALA A 101 -10.189 19.910 13.000 1.00 40.24 H new ATOM 0 HB3 ALA A 101 -10.256 21.294 11.883 1.00 40.24 H new ATOM 1528 N ASN A 102 -13.805 20.777 11.230 1.00 34.24 N ATOM 1529 CA ASN A 102 -14.839 21.588 10.598 1.00 0.51 C ATOM 1530 C ASN A 102 -16.180 21.406 11.302 1.00 74.45 C ATOM 1531 O ASN A 102 -16.844 22.379 11.657 1.00 73.13 O ATOM 1532 CB ASN A 102 -14.972 21.221 9.119 1.00 62.31 C ATOM 1533 CG ASN A 102 -14.642 22.383 8.202 1.00 13.13 C ATOM 1534 OD1 ASN A 102 -13.591 23.122 8.538 1.00 31.22 O flip ATOM 1535 ND2 ASN A 102 -15.325 22.614 7.204 1.00 30.41 N flip ATOM 0 H ASN A 102 -14.071 20.384 12.133 1.00 34.24 H new ATOM 0 HA ASN A 102 -14.545 22.634 10.680 1.00 0.51 H new ATOM 0 HB2 ASN A 102 -14.310 20.385 8.894 1.00 62.31 H new ATOM 0 HB3 ASN A 102 -15.989 20.884 8.921 1.00 62.31 H new ATOM 0 HD21 ASN A 102 -16.124 22.020 6.984 1.00 30.41 H new ATOM 0 HD22 ASN A 102 -15.092 23.400 6.597 1.00 30.41 H new ATOM 1542 N ALA A 103 -16.572 20.151 11.500 1.00 52.23 N ATOM 1543 CA ALA A 103 -17.832 19.840 12.163 1.00 55.32 C ATOM 1544 C ALA A 103 -17.982 18.339 12.382 1.00 63.42 C ATOM 1545 O ALA A 103 -19.093 17.812 12.405 1.00 14.23 O ATOM 1546 CB ALA A 103 -19.002 20.376 11.351 1.00 73.02 C ATOM 0 H ALA A 103 -16.035 19.334 11.211 1.00 52.23 H new ATOM 0 HA ALA A 103 -17.829 20.324 13.139 1.00 55.32 H new ATOM 0 HB1 ALA A 103 -19.937 20.137 11.858 1.00 73.02 H new ATOM 0 HB2 ALA A 103 -18.910 21.458 11.251 1.00 73.02 H new ATOM 0 HB3 ALA A 103 -18.998 19.918 10.362 1.00 73.02 H new ATOM 1552 N GLY A 104 -16.853 17.653 12.541 1.00 14.22 N ATOM 1553 CA GLY A 104 -16.881 16.218 12.755 1.00 11.13 C ATOM 1554 C GLY A 104 -17.054 15.443 11.464 1.00 31.44 C ATOM 1555 O GLY A 104 -16.207 15.484 10.572 1.00 24.53 O ATOM 0 H GLY A 104 -15.920 18.066 12.525 1.00 14.22 H new ATOM 0 HA2 GLY A 104 -15.955 15.908 13.240 1.00 11.13 H new ATOM 0 HA3 GLY A 104 -17.696 15.971 13.436 1.00 11.13 H new ATOM 1559 N PRO A 105 -18.175 14.714 11.353 1.00 63.11 N ATOM 1560 CA PRO A 105 -18.482 13.911 10.166 1.00 63.33 C ATOM 1561 C PRO A 105 -18.804 14.773 8.950 1.00 35.31 C ATOM 1562 O PRO A 105 -19.690 15.625 9.000 1.00 51.14 O ATOM 1563 CB PRO A 105 -19.711 13.104 10.591 1.00 14.53 C ATOM 1564 CG PRO A 105 -20.352 13.925 11.657 1.00 22.23 C ATOM 1565 CD PRO A 105 -19.229 14.619 12.377 1.00 65.40 C ATOM 0 HA PRO A 105 -17.636 13.295 9.861 1.00 63.33 H new ATOM 0 HB2 PRO A 105 -20.389 12.944 9.753 1.00 14.53 H new ATOM 0 HB3 PRO A 105 -19.429 12.120 10.965 1.00 14.53 H new ATOM 0 HG2 PRO A 105 -21.046 14.648 11.228 1.00 22.23 H new ATOM 0 HG3 PRO A 105 -20.925 13.299 12.340 1.00 22.23 H new ATOM 0 HD2 PRO A 105 -19.530 15.603 12.737 1.00 65.40 H new ATOM 0 HD3 PRO A 105 -18.896 14.050 13.245 1.00 65.40 H new ATOM 1573 N ASN A 106 -18.080 14.544 7.859 1.00 12.43 N ATOM 1574 CA ASN A 106 -18.290 15.301 6.630 1.00 11.03 C ATOM 1575 C ASN A 106 -17.813 16.741 6.790 1.00 43.31 C ATOM 1576 O ASN A 106 -17.571 17.208 7.904 1.00 72.23 O ATOM 1577 CB ASN A 106 -19.770 15.282 6.242 1.00 42.52 C ATOM 1578 CG ASN A 106 -20.441 13.967 6.586 1.00 54.02 C ATOM 1579 OD1 ASN A 106 -19.813 12.909 6.551 1.00 32.14 O ATOM 1580 ND2 ASN A 106 -21.725 14.028 6.920 1.00 73.03 N ATOM 0 H ASN A 106 -17.343 13.841 7.801 1.00 12.43 H new ATOM 0 HA ASN A 106 -17.707 14.830 5.838 1.00 11.03 H new ATOM 0 HB2 ASN A 106 -20.287 16.095 6.752 1.00 42.52 H new ATOM 0 HB3 ASN A 106 -19.865 15.466 5.172 1.00 42.52 H new ATOM 0 HD21 ASN A 106 -22.230 13.175 7.161 1.00 73.03 H new ATOM 0 HD22 ASN A 106 -22.206 14.927 6.936 1.00 73.03 H new ATOM 1587 N THR A 107 -17.679 17.442 5.668 1.00 1.53 N ATOM 1588 CA THR A 107 -17.230 18.829 5.683 1.00 73.04 C ATOM 1589 C THR A 107 -15.779 18.933 6.137 1.00 62.51 C ATOM 1590 O THR A 107 -15.371 19.937 6.718 1.00 43.23 O ATOM 1591 CB THR A 107 -18.108 19.694 6.606 1.00 13.14 C ATOM 1592 OG1 THR A 107 -17.594 19.661 7.943 1.00 55.25 O ATOM 1593 CG2 THR A 107 -19.548 19.204 6.599 1.00 33.42 C ATOM 0 H THR A 107 -17.875 17.072 4.738 1.00 1.53 H new ATOM 0 HA THR A 107 -17.315 19.199 4.661 1.00 73.04 H new ATOM 0 HB THR A 107 -18.088 20.718 6.234 1.00 13.14 H new ATOM 0 HG1 THR A 107 -17.768 18.781 8.339 1.00 55.25 H new ATOM 0 HG21 THR A 107 -20.149 19.831 7.258 1.00 33.42 H new ATOM 0 HG22 THR A 107 -19.946 19.258 5.586 1.00 33.42 H new ATOM 0 HG23 THR A 107 -19.583 18.172 6.948 1.00 33.42 H new ATOM 1601 N ASN A 108 -15.003 17.887 5.868 1.00 53.23 N ATOM 1602 CA ASN A 108 -13.596 17.861 6.249 1.00 0.32 C ATOM 1603 C ASN A 108 -12.807 18.925 5.491 1.00 33.05 C ATOM 1604 O ASN A 108 -12.291 18.673 4.404 1.00 64.41 O ATOM 1605 CB ASN A 108 -12.998 16.479 5.980 1.00 74.24 C ATOM 1606 CG ASN A 108 -13.660 15.392 6.805 1.00 3.13 C ATOM 1607 OD1 ASN A 108 -14.046 15.617 7.953 1.00 65.04 O ATOM 1608 ND2 ASN A 108 -13.793 14.206 6.224 1.00 71.23 N ATOM 0 H ASN A 108 -15.325 17.047 5.388 1.00 53.23 H new ATOM 0 HA ASN A 108 -13.531 18.076 7.316 1.00 0.32 H new ATOM 0 HB2 ASN A 108 -13.101 16.241 4.921 1.00 74.24 H new ATOM 0 HB3 ASN A 108 -11.931 16.499 6.200 1.00 74.24 H new ATOM 0 HD21 ASN A 108 -14.230 13.436 6.731 1.00 71.23 H new ATOM 0 HD22 ASN A 108 -13.459 14.065 5.271 1.00 71.23 H new ATOM 1615 N GLY A 109 -12.719 20.116 6.075 1.00 4.43 N ATOM 1616 CA GLY A 109 -11.991 21.201 5.442 1.00 72.42 C ATOM 1617 C GLY A 109 -10.502 20.928 5.357 1.00 55.03 C ATOM 1618 O GLY A 109 -10.085 19.851 4.932 1.00 31.31 O ATOM 0 H GLY A 109 -13.139 20.349 6.975 1.00 4.43 H new ATOM 0 HA2 GLY A 109 -12.386 21.363 4.439 1.00 72.42 H new ATOM 0 HA3 GLY A 109 -12.157 22.121 6.002 1.00 72.42 H new ATOM 1622 N SER A 110 -9.699 21.907 5.760 1.00 51.31 N ATOM 1623 CA SER A 110 -8.248 21.770 5.722 1.00 21.11 C ATOM 1624 C SER A 110 -7.624 22.233 7.035 1.00 30.21 C ATOM 1625 O SER A 110 -6.456 22.618 7.077 1.00 0.00 O ATOM 1626 CB SER A 110 -7.668 22.575 4.557 1.00 34.23 C ATOM 1627 OG SER A 110 -7.400 23.911 4.945 1.00 43.24 O ATOM 0 H SER A 110 -10.029 22.804 6.117 1.00 51.31 H new ATOM 0 HA SER A 110 -8.011 20.716 5.579 1.00 21.11 H new ATOM 0 HB2 SER A 110 -6.750 22.104 4.206 1.00 34.23 H new ATOM 0 HB3 SER A 110 -8.369 22.569 3.722 1.00 34.23 H new ATOM 0 HG SER A 110 -6.659 23.923 5.587 1.00 43.24 H new ATOM 1633 N GLN A 111 -8.412 22.192 8.104 1.00 33.45 N ATOM 1634 CA GLN A 111 -7.938 22.607 9.419 1.00 1.40 C ATOM 1635 C GLN A 111 -7.713 21.400 10.323 1.00 2.25 C ATOM 1636 O GLN A 111 -8.272 21.318 11.417 1.00 2.34 O ATOM 1637 CB GLN A 111 -8.940 23.565 10.067 1.00 43.04 C ATOM 1638 CG GLN A 111 -10.385 23.110 9.941 1.00 42.35 C ATOM 1639 CD GLN A 111 -11.317 23.863 10.870 1.00 25.30 C ATOM 1640 OE1 GLN A 111 -12.183 23.269 11.513 1.00 54.55 O ATOM 1641 NE2 GLN A 111 -11.142 25.177 10.947 1.00 75.13 N ATOM 0 H GLN A 111 -9.382 21.876 8.086 1.00 33.45 H new ATOM 0 HA GLN A 111 -6.986 23.122 9.288 1.00 1.40 H new ATOM 0 HB2 GLN A 111 -8.693 23.676 11.123 1.00 43.04 H new ATOM 0 HB3 GLN A 111 -8.837 24.549 9.610 1.00 43.04 H new ATOM 0 HG2 GLN A 111 -10.716 23.246 8.912 1.00 42.35 H new ATOM 0 HG3 GLN A 111 -10.446 22.043 10.157 1.00 42.35 H new ATOM 0 HE21 GLN A 111 -10.411 25.627 10.396 1.00 75.13 H new ATOM 0 HE22 GLN A 111 -11.738 25.736 11.557 1.00 75.13 H new ATOM 1650 N PHE A 112 -6.891 20.465 9.860 1.00 60.45 N ATOM 1651 CA PHE A 112 -6.593 19.260 10.626 1.00 1.51 C ATOM 1652 C PHE A 112 -5.987 19.614 11.981 1.00 43.40 C ATOM 1653 O PHE A 112 -6.001 20.773 12.397 1.00 51.35 O ATOM 1654 CB PHE A 112 -5.635 18.358 9.846 1.00 24.02 C ATOM 1655 CG PHE A 112 -4.369 19.049 9.425 1.00 31.04 C ATOM 1656 CD1 PHE A 112 -3.457 19.488 10.371 1.00 43.40 C ATOM 1657 CD2 PHE A 112 -4.092 19.260 8.084 1.00 32.42 C ATOM 1658 CE1 PHE A 112 -2.291 20.124 9.987 1.00 10.32 C ATOM 1659 CE2 PHE A 112 -2.928 19.894 7.694 1.00 11.44 C ATOM 1660 CZ PHE A 112 -2.027 20.328 8.647 1.00 10.40 C ATOM 0 H PHE A 112 -6.419 20.518 8.957 1.00 60.45 H new ATOM 0 HA PHE A 112 -7.528 18.725 10.794 1.00 1.51 H new ATOM 0 HB2 PHE A 112 -5.381 17.494 10.460 1.00 24.02 H new ATOM 0 HB3 PHE A 112 -6.145 17.980 8.960 1.00 24.02 H new ATOM 0 HD1 PHE A 112 -3.659 19.332 11.420 1.00 43.40 H new ATOM 0 HD2 PHE A 112 -4.794 18.925 7.335 1.00 32.42 H new ATOM 0 HE1 PHE A 112 -1.588 20.461 10.734 1.00 10.32 H new ATOM 0 HE2 PHE A 112 -2.723 20.050 6.645 1.00 11.44 H new ATOM 0 HZ PHE A 112 -1.118 20.826 8.345 1.00 10.40 H new ATOM 1670 N PHE A 113 -5.455 18.607 12.666 1.00 41.33 N ATOM 1671 CA PHE A 113 -4.845 18.811 13.975 1.00 62.44 C ATOM 1672 C PHE A 113 -3.771 17.760 14.243 1.00 12.13 C ATOM 1673 O PHE A 113 -3.747 16.706 13.608 1.00 70.42 O ATOM 1674 CB PHE A 113 -5.911 18.759 15.071 1.00 4.02 C ATOM 1675 CG PHE A 113 -6.934 17.680 14.862 1.00 54.12 C ATOM 1676 CD1 PHE A 113 -6.549 16.354 14.749 1.00 73.12 C ATOM 1677 CD2 PHE A 113 -8.282 17.992 14.778 1.00 22.05 C ATOM 1678 CE1 PHE A 113 -7.489 15.359 14.555 1.00 13.43 C ATOM 1679 CE2 PHE A 113 -9.227 17.002 14.585 1.00 25.44 C ATOM 1680 CZ PHE A 113 -8.830 15.683 14.475 1.00 44.43 C ATOM 0 H PHE A 113 -5.434 17.642 12.337 1.00 41.33 H new ATOM 0 HA PHE A 113 -4.376 19.795 13.981 1.00 62.44 H new ATOM 0 HB2 PHE A 113 -5.424 18.605 16.034 1.00 4.02 H new ATOM 0 HB3 PHE A 113 -6.417 19.723 15.121 1.00 4.02 H new ATOM 0 HD1 PHE A 113 -5.503 16.095 14.813 1.00 73.12 H new ATOM 0 HD2 PHE A 113 -8.598 19.021 14.864 1.00 22.05 H new ATOM 0 HE1 PHE A 113 -7.176 14.329 14.466 1.00 13.43 H new ATOM 0 HE2 PHE A 113 -10.274 17.259 14.520 1.00 25.44 H new ATOM 0 HZ PHE A 113 -9.566 14.907 14.327 1.00 44.43 H new ATOM 1690 N ILE A 114 -2.885 18.057 15.188 1.00 34.52 N ATOM 1691 CA ILE A 114 -1.810 17.138 15.541 1.00 1.35 C ATOM 1692 C ILE A 114 -2.092 16.447 16.871 1.00 20.11 C ATOM 1693 O ILE A 114 -1.727 16.951 17.934 1.00 22.40 O ATOM 1694 CB ILE A 114 -0.455 17.866 15.631 1.00 33.41 C ATOM 1695 CG1 ILE A 114 -0.006 18.326 14.243 1.00 72.02 C ATOM 1696 CG2 ILE A 114 0.592 16.959 16.259 1.00 23.40 C ATOM 1697 CD1 ILE A 114 0.110 19.829 14.113 1.00 73.44 C ATOM 0 H ILE A 114 -2.890 18.926 15.722 1.00 34.52 H new ATOM 0 HA ILE A 114 -1.761 16.390 14.749 1.00 1.35 H new ATOM 0 HB ILE A 114 -0.572 18.745 16.264 1.00 33.41 H new ATOM 0 HG12 ILE A 114 0.959 17.874 14.014 1.00 72.02 H new ATOM 0 HG13 ILE A 114 -0.714 17.959 13.500 1.00 72.02 H new ATOM 0 HG21 ILE A 114 1.544 17.487 16.316 1.00 23.40 H new ATOM 0 HG22 ILE A 114 0.274 16.676 17.262 1.00 23.40 H new ATOM 0 HG23 ILE A 114 0.710 16.063 15.650 1.00 23.40 H new ATOM 0 HD11 ILE A 114 0.433 20.083 13.103 1.00 73.44 H new ATOM 0 HD12 ILE A 114 -0.859 20.287 14.310 1.00 73.44 H new ATOM 0 HD13 ILE A 114 0.840 20.201 14.832 1.00 73.44 H new ATOM 1709 N CYS A 115 -2.742 15.290 16.804 1.00 41.51 N ATOM 1710 CA CYS A 115 -3.072 14.528 18.003 1.00 53.31 C ATOM 1711 C CYS A 115 -1.808 14.054 18.711 1.00 24.22 C ATOM 1712 O CYS A 115 -1.287 12.976 18.422 1.00 75.43 O ATOM 1713 CB CYS A 115 -3.951 13.329 17.644 1.00 1.11 C ATOM 1714 SG CYS A 115 -5.451 13.760 16.732 1.00 54.02 S ATOM 0 H CYS A 115 -3.051 14.859 15.932 1.00 41.51 H new ATOM 0 HA CYS A 115 -3.621 15.182 18.680 1.00 53.31 H new ATOM 0 HB2 CYS A 115 -3.366 12.628 17.049 1.00 1.11 H new ATOM 0 HB3 CYS A 115 -4.232 12.811 18.561 1.00 1.11 H new ATOM 0 HG CYS A 115 -5.353 14.977 16.286 1.00 54.02 H new ATOM 1720 N THR A 116 -1.316 14.867 19.641 1.00 65.12 N ATOM 1721 CA THR A 116 -0.110 14.532 20.389 1.00 52.24 C ATOM 1722 C THR A 116 -0.320 13.286 21.241 1.00 14.22 C ATOM 1723 O THR A 116 0.635 12.708 21.759 1.00 51.34 O ATOM 1724 CB THR A 116 0.327 15.695 21.299 1.00 43.42 C ATOM 1725 OG1 THR A 116 -0.760 16.095 22.140 1.00 55.33 O ATOM 1726 CG2 THR A 116 0.798 16.882 20.472 1.00 65.03 C ATOM 0 H THR A 116 -1.734 15.762 19.894 1.00 65.12 H new ATOM 0 HA THR A 116 0.674 14.339 19.656 1.00 52.24 H new ATOM 0 HB THR A 116 1.156 15.351 21.917 1.00 43.42 H new ATOM 0 HG1 THR A 116 -0.473 16.834 22.716 1.00 55.33 H new ATOM 0 HG21 THR A 116 1.101 17.691 21.137 1.00 65.03 H new ATOM 0 HG22 THR A 116 1.645 16.582 19.855 1.00 65.03 H new ATOM 0 HG23 THR A 116 -0.015 17.224 19.831 1.00 65.03 H new ATOM 1734 N ALA A 117 -1.577 12.877 21.383 1.00 62.22 N ATOM 1735 CA ALA A 117 -1.912 11.697 22.171 1.00 43.13 C ATOM 1736 C ALA A 117 -3.062 10.922 21.537 1.00 14.55 C ATOM 1737 O ALA A 117 -3.856 11.479 20.779 1.00 55.21 O ATOM 1738 CB ALA A 117 -2.263 12.097 23.596 1.00 31.31 C ATOM 0 H ALA A 117 -2.380 13.345 20.963 1.00 62.22 H new ATOM 0 HA ALA A 117 -1.039 11.045 22.194 1.00 43.13 H new ATOM 0 HB1 ALA A 117 -2.511 11.206 24.173 1.00 31.31 H new ATOM 0 HB2 ALA A 117 -1.411 12.600 24.053 1.00 31.31 H new ATOM 0 HB3 ALA A 117 -3.119 12.772 23.584 1.00 31.31 H new ATOM 1744 N LYS A 118 -3.147 9.635 21.853 1.00 61.51 N ATOM 1745 CA LYS A 118 -4.201 8.782 21.316 1.00 42.24 C ATOM 1746 C LYS A 118 -5.579 9.350 21.641 1.00 44.45 C ATOM 1747 O LYS A 118 -6.118 9.119 22.723 1.00 0.13 O ATOM 1748 CB LYS A 118 -4.076 7.365 21.879 1.00 20.13 C ATOM 1749 CG LYS A 118 -5.368 6.569 21.814 1.00 23.44 C ATOM 1750 CD LYS A 118 -5.100 5.088 21.599 1.00 51.40 C ATOM 1751 CE LYS A 118 -6.025 4.226 22.444 1.00 0.01 C ATOM 1752 NZ LYS A 118 -5.316 3.048 23.015 1.00 32.45 N ATOM 0 H LYS A 118 -2.498 9.159 22.479 1.00 61.51 H new ATOM 0 HA LYS A 118 -4.088 8.747 20.232 1.00 42.24 H new ATOM 0 HB2 LYS A 118 -3.302 6.831 21.328 1.00 20.13 H new ATOM 0 HB3 LYS A 118 -3.746 7.423 22.916 1.00 20.13 H new ATOM 0 HG2 LYS A 118 -5.929 6.708 22.738 1.00 23.44 H new ATOM 0 HG3 LYS A 118 -5.990 6.949 21.003 1.00 23.44 H new ATOM 0 HD2 LYS A 118 -5.233 4.842 20.545 1.00 51.40 H new ATOM 0 HD3 LYS A 118 -4.063 4.865 21.850 1.00 51.40 H new ATOM 0 HE2 LYS A 118 -6.443 4.826 23.253 1.00 0.01 H new ATOM 0 HE3 LYS A 118 -6.862 3.886 21.834 1.00 0.01 H new ATOM 0 HZ1 LYS A 118 -5.980 2.486 23.584 1.00 32.45 H new ATOM 0 HZ2 LYS A 118 -4.939 2.462 22.243 1.00 32.45 H new ATOM 0 HZ3 LYS A 118 -4.533 3.373 23.617 1.00 32.45 H new ATOM 1766 N THR A 119 -6.145 10.094 20.695 1.00 11.45 N ATOM 1767 CA THR A 119 -7.460 10.695 20.881 1.00 21.02 C ATOM 1768 C THR A 119 -8.548 9.849 20.230 1.00 21.43 C ATOM 1769 O THR A 119 -9.375 10.359 19.475 1.00 22.14 O ATOM 1770 CB THR A 119 -7.515 12.119 20.297 1.00 44.14 C ATOM 1771 OG1 THR A 119 -7.520 12.061 18.866 1.00 45.42 O ATOM 1772 CG2 THR A 119 -6.329 12.945 20.772 1.00 41.11 C ATOM 0 H THR A 119 -5.713 10.294 19.793 1.00 11.45 H new ATOM 0 HA THR A 119 -7.636 10.744 21.956 1.00 21.02 H new ATOM 0 HB THR A 119 -8.432 12.596 20.644 1.00 44.14 H new ATOM 0 HG1 THR A 119 -6.811 12.638 18.513 1.00 45.42 H new ATOM 0 HG21 THR A 119 -6.390 13.947 20.347 1.00 41.11 H new ATOM 0 HG22 THR A 119 -6.344 13.011 21.860 1.00 41.11 H new ATOM 0 HG23 THR A 119 -5.402 12.470 20.450 1.00 41.11 H new ATOM 1780 N GLU A 120 -8.541 8.553 20.529 1.00 53.14 N ATOM 1781 CA GLU A 120 -9.529 7.637 19.971 1.00 30.41 C ATOM 1782 C GLU A 120 -10.927 7.963 20.489 1.00 70.14 C ATOM 1783 O GLU A 120 -11.928 7.643 19.847 1.00 21.33 O ATOM 1784 CB GLU A 120 -9.169 6.191 20.319 1.00 71.41 C ATOM 1785 CG GLU A 120 -9.174 5.904 21.811 1.00 12.21 C ATOM 1786 CD GLU A 120 -10.098 4.761 22.183 1.00 74.25 C ATOM 1787 OE1 GLU A 120 -10.158 3.775 21.418 1.00 22.34 O ATOM 1788 OE2 GLU A 120 -10.762 4.852 23.236 1.00 21.13 O ATOM 0 H GLU A 120 -7.864 8.115 21.153 1.00 53.14 H new ATOM 0 HA GLU A 120 -9.525 7.755 18.887 1.00 30.41 H new ATOM 0 HB2 GLU A 120 -9.874 5.521 19.827 1.00 71.41 H new ATOM 0 HB3 GLU A 120 -8.181 5.965 19.917 1.00 71.41 H new ATOM 0 HG2 GLU A 120 -8.161 5.667 22.135 1.00 12.21 H new ATOM 0 HG3 GLU A 120 -9.479 6.802 22.349 1.00 12.21 H new ATOM 1795 N TRP A 121 -10.987 8.601 21.652 1.00 64.32 N ATOM 1796 CA TRP A 121 -12.262 8.970 22.256 1.00 4.04 C ATOM 1797 C TRP A 121 -13.169 9.653 21.239 1.00 61.10 C ATOM 1798 O TRP A 121 -14.394 9.549 21.316 1.00 22.04 O ATOM 1799 CB TRP A 121 -12.033 9.893 23.455 1.00 60.34 C ATOM 1800 CG TRP A 121 -11.102 11.030 23.160 1.00 73.14 C ATOM 1801 CD1 TRP A 121 -11.367 12.128 22.392 1.00 74.10 C ATOM 1802 CD2 TRP A 121 -9.757 11.179 23.626 1.00 41.22 C ATOM 1803 NE1 TRP A 121 -10.268 12.951 22.353 1.00 63.11 N ATOM 1804 CE2 TRP A 121 -9.267 12.392 23.103 1.00 62.25 C ATOM 1805 CE3 TRP A 121 -8.919 10.408 24.436 1.00 52.01 C ATOM 1806 CZ2 TRP A 121 -7.977 12.848 23.363 1.00 33.52 C ATOM 1807 CZ3 TRP A 121 -7.640 10.862 24.693 1.00 24.45 C ATOM 1808 CH2 TRP A 121 -7.179 12.072 24.159 1.00 3.34 C ATOM 0 H TRP A 121 -10.168 8.874 22.196 1.00 64.32 H new ATOM 0 HA TRP A 121 -12.752 8.058 22.596 1.00 4.04 H new ATOM 0 HB2 TRP A 121 -12.992 10.294 23.784 1.00 60.34 H new ATOM 0 HB3 TRP A 121 -11.631 9.309 24.283 1.00 60.34 H new ATOM 0 HD1 TRP A 121 -12.303 12.321 21.889 1.00 74.10 H new ATOM 0 HE1 TRP A 121 -10.207 13.835 21.848 1.00 63.11 H new ATOM 0 HE3 TRP A 121 -9.265 9.474 24.854 1.00 52.01 H new ATOM 0 HZ2 TRP A 121 -7.619 13.780 22.951 1.00 33.52 H new ATOM 0 HZ3 TRP A 121 -6.984 10.273 25.317 1.00 24.45 H new ATOM 0 HH2 TRP A 121 -6.174 12.399 24.380 1.00 3.34 H new ATOM 1819 N LEU A 122 -12.562 10.351 20.286 1.00 65.12 N ATOM 1820 CA LEU A 122 -13.316 11.051 19.252 1.00 43.22 C ATOM 1821 C LEU A 122 -14.387 10.146 18.652 1.00 43.13 C ATOM 1822 O LEU A 122 -15.470 10.605 18.290 1.00 52.31 O ATOM 1823 CB LEU A 122 -12.374 11.545 18.152 1.00 20.30 C ATOM 1824 CG LEU A 122 -11.327 12.575 18.577 1.00 12.11 C ATOM 1825 CD1 LEU A 122 -10.127 12.533 17.644 1.00 54.55 C ATOM 1826 CD2 LEU A 122 -11.934 13.970 18.607 1.00 1.40 C ATOM 0 H LEU A 122 -11.550 10.447 20.208 1.00 65.12 H new ATOM 0 HA LEU A 122 -13.807 11.908 19.713 1.00 43.22 H new ATOM 0 HB2 LEU A 122 -11.856 10.683 17.731 1.00 20.30 H new ATOM 0 HB3 LEU A 122 -12.976 11.977 17.353 1.00 20.30 H new ATOM 0 HG LEU A 122 -10.987 12.326 19.582 1.00 12.11 H new ATOM 0 HD11 LEU A 122 -9.393 13.273 17.962 1.00 54.55 H new ATOM 0 HD12 LEU A 122 -9.678 11.540 17.673 1.00 54.55 H new ATOM 0 HD13 LEU A 122 -10.449 12.756 16.627 1.00 54.55 H new ATOM 0 HD21 LEU A 122 -11.175 14.691 18.912 1.00 1.40 H new ATOM 0 HD22 LEU A 122 -12.302 14.228 17.614 1.00 1.40 H new ATOM 0 HD23 LEU A 122 -12.761 13.992 19.317 1.00 1.40 H new ATOM 1838 N ASP A 123 -14.077 8.858 18.551 1.00 10.21 N ATOM 1839 CA ASP A 123 -15.014 7.887 17.998 1.00 12.31 C ATOM 1840 C ASP A 123 -15.399 8.257 16.569 1.00 34.01 C ATOM 1841 O ASP A 123 -16.453 8.846 16.332 1.00 73.40 O ATOM 1842 CB ASP A 123 -16.267 7.801 18.871 1.00 0.32 C ATOM 1843 CG ASP A 123 -16.201 6.661 19.868 1.00 22.00 C ATOM 1844 OD1 ASP A 123 -15.077 6.233 20.206 1.00 34.52 O ATOM 1845 OD2 ASP A 123 -17.272 6.198 20.311 1.00 74.54 O ATOM 0 H ASP A 123 -13.184 8.462 18.845 1.00 10.21 H new ATOM 0 HA ASP A 123 -14.524 6.914 17.983 1.00 12.31 H new ATOM 0 HB2 ASP A 123 -16.398 8.741 19.407 1.00 0.32 H new ATOM 0 HB3 ASP A 123 -17.142 7.672 18.234 1.00 0.32 H new ATOM 1850 N GLY A 124 -14.536 7.908 15.620 1.00 74.14 N ATOM 1851 CA GLY A 124 -14.804 8.212 14.226 1.00 4.20 C ATOM 1852 C GLY A 124 -15.493 9.550 14.047 1.00 50.24 C ATOM 1853 O GLY A 124 -16.439 9.671 13.268 1.00 61.43 O ATOM 0 H GLY A 124 -13.657 7.420 15.791 1.00 74.14 H new ATOM 0 HA2 GLY A 124 -13.866 8.213 13.671 1.00 4.20 H new ATOM 0 HA3 GLY A 124 -15.427 7.426 13.799 1.00 4.20 H new ATOM 1857 N LYS A 125 -15.020 10.559 14.770 1.00 13.23 N ATOM 1858 CA LYS A 125 -15.597 11.896 14.689 1.00 61.03 C ATOM 1859 C LYS A 125 -15.052 12.651 13.480 1.00 22.24 C ATOM 1860 O LYS A 125 -15.620 13.658 13.057 1.00 74.55 O ATOM 1861 CB LYS A 125 -15.301 12.680 15.969 1.00 14.31 C ATOM 1862 CG LYS A 125 -16.536 13.299 16.602 1.00 63.00 C ATOM 1863 CD LYS A 125 -17.252 14.227 15.635 1.00 35.33 C ATOM 1864 CE LYS A 125 -18.611 14.650 16.173 1.00 70.14 C ATOM 1865 NZ LYS A 125 -18.527 15.124 17.582 1.00 41.33 N ATOM 0 H LYS A 125 -14.238 10.476 15.419 1.00 13.23 H new ATOM 0 HA LYS A 125 -16.676 11.793 14.575 1.00 61.03 H new ATOM 0 HB2 LYS A 125 -14.827 12.015 16.691 1.00 14.31 H new ATOM 0 HB3 LYS A 125 -14.584 13.469 15.744 1.00 14.31 H new ATOM 0 HG2 LYS A 125 -17.216 12.510 16.922 1.00 63.00 H new ATOM 0 HG3 LYS A 125 -16.249 13.854 17.495 1.00 63.00 H new ATOM 0 HD2 LYS A 125 -16.639 15.110 15.455 1.00 35.33 H new ATOM 0 HD3 LYS A 125 -17.379 13.727 14.675 1.00 35.33 H new ATOM 0 HE2 LYS A 125 -19.018 15.444 15.547 1.00 70.14 H new ATOM 0 HE3 LYS A 125 -19.303 13.810 16.113 1.00 70.14 H new ATOM 0 HZ1 LYS A 125 -19.413 15.604 17.840 1.00 41.33 H new ATOM 0 HZ2 LYS A 125 -18.377 14.311 18.213 1.00 41.33 H new ATOM 0 HZ3 LYS A 125 -17.732 15.788 17.678 1.00 41.33 H new ATOM 1879 N HIS A 126 -13.947 12.157 12.929 1.00 55.51 N ATOM 1880 CA HIS A 126 -13.327 12.785 11.767 1.00 31.24 C ATOM 1881 C HIS A 126 -12.723 11.734 10.841 1.00 41.35 C ATOM 1882 O HIS A 126 -12.971 10.538 10.996 1.00 44.43 O ATOM 1883 CB HIS A 126 -12.247 13.772 12.211 1.00 52.33 C ATOM 1884 CG HIS A 126 -12.586 14.504 13.473 1.00 31.30 C ATOM 1885 ND1 HIS A 126 -13.559 15.478 13.540 1.00 12.30 N ATOM 1886 CD2 HIS A 126 -12.076 14.397 14.722 1.00 33.33 C ATOM 1887 CE1 HIS A 126 -13.632 15.941 14.775 1.00 30.54 C ATOM 1888 NE2 HIS A 126 -12.743 15.300 15.513 1.00 42.21 N ATOM 0 H HIS A 126 -13.463 11.325 13.268 1.00 55.51 H new ATOM 0 HA HIS A 126 -14.100 13.325 11.220 1.00 31.24 H new ATOM 0 HB2 HIS A 126 -11.310 13.233 12.354 1.00 52.33 H new ATOM 0 HB3 HIS A 126 -12.079 14.497 11.414 1.00 52.33 H new ATOM 0 HD1 HIS A 126 -14.133 15.792 12.758 1.00 12.30 H new ATOM 0 HD2 HIS A 126 -11.291 13.726 15.038 1.00 33.33 H new ATOM 0 HE1 HIS A 126 -14.304 16.712 15.122 1.00 30.54 H new ATOM 1896 N VAL A 127 -11.930 12.189 9.876 1.00 44.22 N ATOM 1897 CA VAL A 127 -11.290 11.289 8.924 1.00 62.11 C ATOM 1898 C VAL A 127 -9.772 11.417 8.982 1.00 62.34 C ATOM 1899 O VAL A 127 -9.220 12.495 8.760 1.00 23.44 O ATOM 1900 CB VAL A 127 -11.763 11.566 7.485 1.00 60.55 C ATOM 1901 CG1 VAL A 127 -10.917 10.791 6.486 1.00 64.11 C ATOM 1902 CG2 VAL A 127 -13.236 11.216 7.332 1.00 43.32 C ATOM 0 H VAL A 127 -11.715 13.176 9.733 1.00 44.22 H new ATOM 0 HA VAL A 127 -11.577 10.275 9.204 1.00 62.11 H new ATOM 0 HB VAL A 127 -11.642 12.630 7.280 1.00 60.55 H new ATOM 0 HG11 VAL A 127 -11.266 10.999 5.475 1.00 64.11 H new ATOM 0 HG12 VAL A 127 -9.874 11.094 6.580 1.00 64.11 H new ATOM 0 HG13 VAL A 127 -11.004 9.723 6.687 1.00 64.11 H new ATOM 0 HG21 VAL A 127 -13.554 11.418 6.309 1.00 43.32 H new ATOM 0 HG22 VAL A 127 -13.384 10.160 7.556 1.00 43.32 H new ATOM 0 HG23 VAL A 127 -13.827 11.819 8.021 1.00 43.32 H new ATOM 1912 N VAL A 128 -9.101 10.309 9.280 1.00 20.52 N ATOM 1913 CA VAL A 128 -7.646 10.295 9.366 1.00 45.55 C ATOM 1914 C VAL A 128 -7.021 9.887 8.036 1.00 3.31 C ATOM 1915 O VAL A 128 -7.475 8.945 7.388 1.00 74.35 O ATOM 1916 CB VAL A 128 -7.156 9.336 10.466 1.00 35.53 C ATOM 1917 CG1 VAL A 128 -5.684 9.007 10.273 1.00 1.21 C ATOM 1918 CG2 VAL A 128 -7.401 9.935 11.843 1.00 54.02 C ATOM 0 H VAL A 128 -9.543 9.409 9.466 1.00 20.52 H new ATOM 0 HA VAL A 128 -7.335 11.309 9.615 1.00 45.55 H new ATOM 0 HB VAL A 128 -7.723 8.408 10.392 1.00 35.53 H new ATOM 0 HG11 VAL A 128 -5.357 8.328 11.060 1.00 1.21 H new ATOM 0 HG12 VAL A 128 -5.542 8.532 9.302 1.00 1.21 H new ATOM 0 HG13 VAL A 128 -5.097 9.924 10.318 1.00 1.21 H new ATOM 0 HG21 VAL A 128 -7.049 9.244 12.608 1.00 54.02 H new ATOM 0 HG22 VAL A 128 -6.862 10.879 11.930 1.00 54.02 H new ATOM 0 HG23 VAL A 128 -8.468 10.113 11.978 1.00 54.02 H new ATOM 1928 N PHE A 129 -5.975 10.603 7.636 1.00 70.03 N ATOM 1929 CA PHE A 129 -5.287 10.316 6.382 1.00 21.25 C ATOM 1930 C PHE A 129 -3.851 10.831 6.420 1.00 20.41 C ATOM 1931 O PHE A 129 -3.331 11.325 5.421 1.00 43.00 O ATOM 1932 CB PHE A 129 -6.037 10.948 5.208 1.00 44.10 C ATOM 1933 CG PHE A 129 -5.899 12.442 5.144 1.00 51.44 C ATOM 1934 CD1 PHE A 129 -6.542 13.251 6.067 1.00 72.10 C ATOM 1935 CD2 PHE A 129 -5.127 13.039 4.159 1.00 33.54 C ATOM 1936 CE1 PHE A 129 -6.417 14.626 6.011 1.00 55.31 C ATOM 1937 CE2 PHE A 129 -4.999 14.413 4.099 1.00 44.24 C ATOM 1938 CZ PHE A 129 -5.645 15.208 5.025 1.00 54.24 C ATOM 0 H PHE A 129 -5.585 11.386 8.161 1.00 70.03 H new ATOM 0 HA PHE A 129 -5.263 9.234 6.248 1.00 21.25 H new ATOM 0 HB2 PHE A 129 -5.668 10.517 4.277 1.00 44.10 H new ATOM 0 HB3 PHE A 129 -7.094 10.691 5.282 1.00 44.10 H new ATOM 0 HD1 PHE A 129 -7.148 12.801 6.840 1.00 72.10 H new ATOM 0 HD2 PHE A 129 -4.620 12.423 3.431 1.00 33.54 H new ATOM 0 HE1 PHE A 129 -6.923 15.245 6.738 1.00 55.31 H new ATOM 0 HE2 PHE A 129 -4.394 14.866 3.328 1.00 44.24 H new ATOM 0 HZ PHE A 129 -5.547 16.282 4.978 1.00 54.24 H new ATOM 1948 N GLY A 130 -3.216 10.711 7.582 1.00 22.31 N ATOM 1949 CA GLY A 130 -1.847 11.168 7.730 1.00 44.42 C ATOM 1950 C GLY A 130 -1.287 10.887 9.110 1.00 1.21 C ATOM 1951 O GLY A 130 -2.003 10.419 9.996 1.00 50.24 O ATOM 0 H GLY A 130 -3.626 10.305 8.423 1.00 22.31 H new ATOM 0 HA2 GLY A 130 -1.222 10.681 6.982 1.00 44.42 H new ATOM 0 HA3 GLY A 130 -1.802 12.239 7.534 1.00 44.42 H new ATOM 1955 N LYS A 131 -0.002 11.171 9.295 1.00 51.30 N ATOM 1956 CA LYS A 131 0.655 10.946 10.577 1.00 50.10 C ATOM 1957 C LYS A 131 2.071 11.514 10.570 1.00 73.01 C ATOM 1958 O LYS A 131 2.835 11.292 9.631 1.00 72.24 O ATOM 1959 CB LYS A 131 0.696 9.450 10.897 1.00 52.13 C ATOM 1960 CG LYS A 131 1.479 8.633 9.884 1.00 24.11 C ATOM 1961 CD LYS A 131 1.671 7.200 10.352 1.00 1.13 C ATOM 1962 CE LYS A 131 3.042 6.666 9.966 1.00 52.12 C ATOM 1963 NZ LYS A 131 4.137 7.390 10.668 1.00 44.20 N ATOM 0 H LYS A 131 0.605 11.558 8.573 1.00 51.30 H new ATOM 0 HA LYS A 131 0.080 11.460 11.347 1.00 50.10 H new ATOM 0 HB2 LYS A 131 1.138 9.310 11.884 1.00 52.13 H new ATOM 0 HB3 LYS A 131 -0.324 9.070 10.948 1.00 52.13 H new ATOM 0 HG2 LYS A 131 0.955 8.637 8.928 1.00 24.11 H new ATOM 0 HG3 LYS A 131 2.452 9.095 9.716 1.00 24.11 H new ATOM 0 HD2 LYS A 131 1.552 7.151 11.434 1.00 1.13 H new ATOM 0 HD3 LYS A 131 0.897 6.567 9.917 1.00 1.13 H new ATOM 0 HE2 LYS A 131 3.098 5.604 10.204 1.00 52.12 H new ATOM 0 HE3 LYS A 131 3.178 6.759 8.888 1.00 52.12 H new ATOM 0 HZ1 LYS A 131 4.968 6.770 10.747 1.00 44.20 H new ATOM 0 HZ2 LYS A 131 4.390 8.243 10.129 1.00 44.20 H new ATOM 0 HZ3 LYS A 131 3.818 7.664 11.619 1.00 44.20 H new ATOM 1977 N VAL A 132 2.415 12.247 11.624 1.00 13.11 N ATOM 1978 CA VAL A 132 3.740 12.844 11.740 1.00 14.53 C ATOM 1979 C VAL A 132 4.810 11.923 11.167 1.00 42.03 C ATOM 1980 O VAL A 132 5.145 10.897 11.760 1.00 45.52 O ATOM 1981 CB VAL A 132 4.085 13.164 13.207 1.00 33.30 C ATOM 1982 CG1 VAL A 132 5.571 13.453 13.355 1.00 14.33 C ATOM 1983 CG2 VAL A 132 3.252 14.335 13.707 1.00 24.30 C ATOM 0 H VAL A 132 1.794 12.442 12.410 1.00 13.11 H new ATOM 0 HA VAL A 132 3.720 13.772 11.168 1.00 14.53 H new ATOM 0 HB VAL A 132 3.847 12.293 13.817 1.00 33.30 H new ATOM 0 HG11 VAL A 132 5.796 13.677 14.398 1.00 14.33 H new ATOM 0 HG12 VAL A 132 6.144 12.581 13.039 1.00 14.33 H new ATOM 0 HG13 VAL A 132 5.839 14.308 12.734 1.00 14.33 H new ATOM 0 HG21 VAL A 132 3.509 14.547 14.745 1.00 24.30 H new ATOM 0 HG22 VAL A 132 3.456 15.214 13.096 1.00 24.30 H new ATOM 0 HG23 VAL A 132 2.194 14.084 13.639 1.00 24.30 H new ATOM 1993 N LYS A 133 5.345 12.295 10.009 1.00 53.24 N ATOM 1994 CA LYS A 133 6.380 11.504 9.354 1.00 54.14 C ATOM 1995 C LYS A 133 7.706 11.619 10.099 1.00 54.25 C ATOM 1996 O LYS A 133 8.262 10.619 10.551 1.00 13.33 O ATOM 1997 CB LYS A 133 6.556 11.958 7.903 1.00 42.51 C ATOM 1998 CG LYS A 133 6.538 10.817 6.901 1.00 21.34 C ATOM 1999 CD LYS A 133 7.397 9.653 7.367 1.00 34.31 C ATOM 2000 CE LYS A 133 6.545 8.504 7.885 1.00 13.13 C ATOM 2001 NZ LYS A 133 7.224 7.761 8.983 1.00 70.15 N ATOM 0 H LYS A 133 5.078 13.140 9.504 1.00 53.24 H new ATOM 0 HA LYS A 133 6.067 10.460 9.366 1.00 54.14 H new ATOM 0 HB2 LYS A 133 5.762 12.662 7.653 1.00 42.51 H new ATOM 0 HB3 LYS A 133 7.500 12.496 7.812 1.00 42.51 H new ATOM 0 HG2 LYS A 133 5.513 10.478 6.753 1.00 21.34 H new ATOM 0 HG3 LYS A 133 6.898 11.173 5.936 1.00 21.34 H new ATOM 0 HD2 LYS A 133 8.017 9.304 6.542 1.00 34.31 H new ATOM 0 HD3 LYS A 133 8.073 9.990 8.153 1.00 34.31 H new ATOM 0 HE2 LYS A 133 5.592 8.892 8.244 1.00 13.13 H new ATOM 0 HE3 LYS A 133 6.322 7.819 7.067 1.00 13.13 H new ATOM 0 HZ1 LYS A 133 6.611 6.986 9.309 1.00 70.15 H new ATOM 0 HZ2 LYS A 133 8.122 7.369 8.634 1.00 70.15 H new ATOM 0 HZ3 LYS A 133 7.414 8.408 9.775 1.00 70.15 H new ATOM 2015 N GLU A 134 8.205 12.845 10.222 1.00 23.15 N ATOM 2016 CA GLU A 134 9.466 13.089 10.914 1.00 72.14 C ATOM 2017 C GLU A 134 9.531 14.521 11.437 1.00 30.21 C ATOM 2018 O GLU A 134 8.875 15.417 10.909 1.00 55.04 O ATOM 2019 CB GLU A 134 10.646 12.822 9.977 1.00 3.43 C ATOM 2020 CG GLU A 134 10.978 11.348 9.820 1.00 30.15 C ATOM 2021 CD GLU A 134 12.431 11.112 9.457 1.00 2.25 C ATOM 2022 OE1 GLU A 134 13.309 11.447 10.280 1.00 43.20 O ATOM 2023 OE2 GLU A 134 12.691 10.593 8.352 1.00 54.43 O ATOM 0 H GLU A 134 7.757 13.683 9.852 1.00 23.15 H new ATOM 0 HA GLU A 134 9.524 12.408 11.763 1.00 72.14 H new ATOM 0 HB2 GLU A 134 10.422 13.242 8.996 1.00 3.43 H new ATOM 0 HB3 GLU A 134 11.524 13.345 10.355 1.00 3.43 H new ATOM 0 HG2 GLU A 134 10.751 10.827 10.750 1.00 30.15 H new ATOM 0 HG3 GLU A 134 10.340 10.916 9.049 1.00 30.15 H new ATOM 2030 N GLY A 135 10.328 14.727 12.481 1.00 2.50 N ATOM 2031 CA GLY A 135 10.464 16.051 13.060 1.00 45.33 C ATOM 2032 C GLY A 135 9.502 16.284 14.208 1.00 42.24 C ATOM 2033 O GLY A 135 9.093 17.416 14.463 1.00 4.34 O ATOM 0 H GLY A 135 10.882 14.001 12.936 1.00 2.50 H new ATOM 0 HA2 GLY A 135 11.486 16.186 13.414 1.00 45.33 H new ATOM 0 HA3 GLY A 135 10.292 16.801 12.288 1.00 45.33 H new ATOM 2037 N MET A 136 9.138 15.210 14.900 1.00 63.42 N ATOM 2038 CA MET A 136 8.217 15.303 16.027 1.00 62.24 C ATOM 2039 C MET A 136 8.749 16.263 17.086 1.00 50.35 C ATOM 2040 O MET A 136 7.984 16.820 17.872 1.00 50.34 O ATOM 2041 CB MET A 136 7.990 13.921 16.643 1.00 50.03 C ATOM 2042 CG MET A 136 6.526 13.602 16.896 1.00 35.01 C ATOM 2043 SD MET A 136 5.758 14.742 18.063 1.00 22.15 S ATOM 2044 CE MET A 136 4.701 13.625 18.982 1.00 1.20 C ATOM 0 H MET A 136 9.466 14.265 14.700 1.00 63.42 H new ATOM 0 HA MET A 136 7.267 15.688 15.657 1.00 62.24 H new ATOM 0 HB2 MET A 136 8.409 13.164 15.981 1.00 50.03 H new ATOM 0 HB3 MET A 136 8.535 13.858 17.585 1.00 50.03 H new ATOM 0 HG2 MET A 136 5.983 13.634 15.952 1.00 35.01 H new ATOM 0 HG3 MET A 136 6.441 12.585 17.278 1.00 35.01 H new ATOM 0 HE1 MET A 136 4.157 14.183 19.744 1.00 1.20 H new ATOM 0 HE2 MET A 136 3.991 13.154 18.302 1.00 1.20 H new ATOM 0 HE3 MET A 136 5.310 12.858 19.459 1.00 1.20 H new ATOM 2054 N ASN A 137 10.065 16.452 17.100 1.00 75.01 N ATOM 2055 CA ASN A 137 10.698 17.345 18.063 1.00 22.23 C ATOM 2056 C ASN A 137 10.136 18.758 17.947 1.00 53.21 C ATOM 2057 O ASN A 137 9.966 19.454 18.949 1.00 71.23 O ATOM 2058 CB ASN A 137 12.213 17.368 17.849 1.00 20.54 C ATOM 2059 CG ASN A 137 12.732 16.073 17.253 1.00 2.34 C ATOM 2060 OD1 ASN A 137 12.328 14.984 17.660 1.00 62.21 O ATOM 2061 ND2 ASN A 137 13.633 16.188 16.284 1.00 30.24 N ATOM 0 H ASN A 137 10.713 15.999 16.456 1.00 75.01 H new ATOM 0 HA ASN A 137 10.484 16.969 19.064 1.00 22.23 H new ATOM 0 HB2 ASN A 137 12.472 18.197 17.191 1.00 20.54 H new ATOM 0 HB3 ASN A 137 12.709 17.551 18.802 1.00 20.54 H new ATOM 0 HD21 ASN A 137 14.019 15.352 15.845 1.00 30.24 H new ATOM 0 HD22 ASN A 137 13.939 17.112 15.979 1.00 30.24 H new ATOM 2068 N ILE A 138 9.848 19.175 16.719 1.00 43.34 N ATOM 2069 CA ILE A 138 9.303 20.505 16.472 1.00 63.53 C ATOM 2070 C ILE A 138 7.892 20.633 17.035 1.00 42.40 C ATOM 2071 O ILE A 138 7.527 21.669 17.592 1.00 34.41 O ATOM 2072 CB ILE A 138 9.275 20.831 14.967 1.00 60.32 C ATOM 2073 CG1 ILE A 138 10.625 20.502 14.326 1.00 41.30 C ATOM 2074 CG2 ILE A 138 8.921 22.294 14.749 1.00 41.24 C ATOM 2075 CD1 ILE A 138 11.784 21.260 14.935 1.00 15.43 C ATOM 0 H ILE A 138 9.983 18.612 15.879 1.00 43.34 H new ATOM 0 HA ILE A 138 9.959 21.214 16.977 1.00 63.53 H new ATOM 0 HB ILE A 138 8.510 20.218 14.491 1.00 60.32 H new ATOM 0 HG12 ILE A 138 10.812 19.432 14.420 1.00 41.30 H new ATOM 0 HG13 ILE A 138 10.576 20.725 13.260 1.00 41.30 H new ATOM 0 HG21 ILE A 138 8.905 22.509 13.681 1.00 41.24 H new ATOM 0 HG22 ILE A 138 7.939 22.498 15.175 1.00 41.24 H new ATOM 0 HG23 ILE A 138 9.665 22.925 15.235 1.00 41.24 H new ATOM 0 HD11 ILE A 138 12.708 20.977 14.432 1.00 15.43 H new ATOM 0 HD12 ILE A 138 11.620 22.331 14.817 1.00 15.43 H new ATOM 0 HD13 ILE A 138 11.860 21.019 15.995 1.00 15.43 H new ATOM 2087 N VAL A 139 7.103 19.574 16.888 1.00 51.04 N ATOM 2088 CA VAL A 139 5.732 19.567 17.384 1.00 21.12 C ATOM 2089 C VAL A 139 5.697 19.711 18.901 1.00 15.45 C ATOM 2090 O VAL A 139 4.742 20.251 19.461 1.00 65.13 O ATOM 2091 CB VAL A 139 4.997 18.273 16.985 1.00 3.43 C ATOM 2092 CG1 VAL A 139 3.634 18.205 17.656 1.00 11.01 C ATOM 2093 CG2 VAL A 139 4.862 18.183 15.473 1.00 54.12 C ATOM 0 H VAL A 139 7.390 18.709 16.429 1.00 51.04 H new ATOM 0 HA VAL A 139 5.226 20.418 16.929 1.00 21.12 H new ATOM 0 HB VAL A 139 5.585 17.421 17.326 1.00 3.43 H new ATOM 0 HG11 VAL A 139 3.129 17.284 17.363 1.00 11.01 H new ATOM 0 HG12 VAL A 139 3.760 18.220 18.739 1.00 11.01 H new ATOM 0 HG13 VAL A 139 3.034 19.061 17.349 1.00 11.01 H new ATOM 0 HG21 VAL A 139 4.341 17.263 15.208 1.00 54.12 H new ATOM 0 HG22 VAL A 139 4.296 19.039 15.107 1.00 54.12 H new ATOM 0 HG23 VAL A 139 5.853 18.182 15.019 1.00 54.12 H new ATOM 2103 N GLU A 140 6.743 19.226 19.561 1.00 23.35 N ATOM 2104 CA GLU A 140 6.831 19.301 21.015 1.00 30.21 C ATOM 2105 C GLU A 140 7.159 20.721 21.468 1.00 63.33 C ATOM 2106 O GLU A 140 6.755 21.148 22.549 1.00 65.13 O ATOM 2107 CB GLU A 140 7.893 18.330 21.535 1.00 31.41 C ATOM 2108 CG GLU A 140 7.375 16.917 21.745 1.00 71.30 C ATOM 2109 CD GLU A 140 6.856 16.688 23.151 1.00 10.54 C ATOM 2110 OE1 GLU A 140 6.736 17.675 23.907 1.00 30.15 O ATOM 2111 OE2 GLU A 140 6.570 15.522 23.495 1.00 14.54 O ATOM 0 H GLU A 140 7.542 18.777 19.113 1.00 23.35 H new ATOM 0 HA GLU A 140 5.861 19.022 21.427 1.00 30.21 H new ATOM 0 HB2 GLU A 140 8.724 18.302 20.830 1.00 31.41 H new ATOM 0 HB3 GLU A 140 8.287 18.707 22.478 1.00 31.41 H new ATOM 0 HG2 GLU A 140 6.577 16.717 21.030 1.00 71.30 H new ATOM 0 HG3 GLU A 140 8.175 16.206 21.537 1.00 71.30 H new ATOM 2118 N ALA A 141 7.895 21.446 20.632 1.00 4.32 N ATOM 2119 CA ALA A 141 8.277 22.818 20.945 1.00 62.12 C ATOM 2120 C ALA A 141 7.079 23.756 20.851 1.00 50.32 C ATOM 2121 O ALA A 141 6.939 24.681 21.651 1.00 35.41 O ATOM 2122 CB ALA A 141 9.388 23.282 20.014 1.00 73.22 C ATOM 0 H ALA A 141 8.238 21.107 19.734 1.00 4.32 H new ATOM 0 HA ALA A 141 8.644 22.842 21.971 1.00 62.12 H new ATOM 0 HB1 ALA A 141 9.663 24.308 20.259 1.00 73.22 H new ATOM 0 HB2 ALA A 141 10.257 22.635 20.133 1.00 73.22 H new ATOM 0 HB3 ALA A 141 9.041 23.236 18.982 1.00 73.22 H new ATOM 2128 N MET A 142 6.218 23.513 19.868 1.00 62.20 N ATOM 2129 CA MET A 142 5.031 24.337 19.670 1.00 23.25 C ATOM 2130 C MET A 142 4.148 24.325 20.914 1.00 71.51 C ATOM 2131 O MET A 142 3.791 25.377 21.442 1.00 32.23 O ATOM 2132 CB MET A 142 4.236 23.842 18.461 1.00 62.12 C ATOM 2133 CG MET A 142 5.091 23.610 17.225 1.00 12.23 C ATOM 2134 SD MET A 142 4.143 23.715 15.695 1.00 13.02 S ATOM 2135 CE MET A 142 2.820 22.557 16.037 1.00 54.12 C ATOM 0 H MET A 142 6.320 22.752 19.196 1.00 62.20 H new ATOM 0 HA MET A 142 5.356 25.361 19.487 1.00 23.25 H new ATOM 0 HB2 MET A 142 3.732 22.912 18.724 1.00 62.12 H new ATOM 0 HB3 MET A 142 3.460 24.569 18.224 1.00 62.12 H new ATOM 0 HG2 MET A 142 5.895 24.346 17.201 1.00 12.23 H new ATOM 0 HG3 MET A 142 5.559 22.628 17.291 1.00 12.23 H new ATOM 0 HE1 MET A 142 2.306 22.307 15.109 1.00 54.12 H new ATOM 0 HE2 MET A 142 3.235 21.650 16.478 1.00 54.12 H new ATOM 0 HE3 MET A 142 2.113 23.008 16.733 1.00 54.12 H new ATOM 2145 N GLU A 143 3.799 23.127 21.375 1.00 2.41 N ATOM 2146 CA GLU A 143 2.956 22.980 22.556 1.00 44.21 C ATOM 2147 C GLU A 143 3.553 23.725 23.746 1.00 11.54 C ATOM 2148 O GLU A 143 2.835 24.135 24.659 1.00 50.33 O ATOM 2149 CB GLU A 143 2.780 21.500 22.903 1.00 44.32 C ATOM 2150 CG GLU A 143 1.883 20.750 21.933 1.00 43.34 C ATOM 2151 CD GLU A 143 0.860 21.651 21.269 1.00 41.25 C ATOM 2152 OE1 GLU A 143 1.244 22.418 20.361 1.00 2.11 O ATOM 2153 OE2 GLU A 143 -0.325 21.589 21.657 1.00 73.52 O ATOM 0 H GLU A 143 4.087 22.246 20.949 1.00 2.41 H new ATOM 0 HA GLU A 143 1.981 23.412 22.331 1.00 44.21 H new ATOM 0 HB2 GLU A 143 3.759 21.021 22.924 1.00 44.32 H new ATOM 0 HB3 GLU A 143 2.364 21.418 23.907 1.00 44.32 H new ATOM 0 HG2 GLU A 143 2.498 20.278 21.167 1.00 43.34 H new ATOM 0 HG3 GLU A 143 1.367 19.951 22.465 1.00 43.34 H new ATOM 2160 N ARG A 144 4.871 23.896 23.730 1.00 52.50 N ATOM 2161 CA ARG A 144 5.565 24.590 24.808 1.00 13.32 C ATOM 2162 C ARG A 144 5.237 26.080 24.796 1.00 54.54 C ATOM 2163 O ARG A 144 5.343 26.759 25.817 1.00 31.04 O ATOM 2164 CB ARG A 144 7.076 24.389 24.683 1.00 20.14 C ATOM 2165 CG ARG A 144 7.831 25.656 24.317 1.00 41.12 C ATOM 2166 CD ARG A 144 8.186 26.470 25.551 1.00 15.23 C ATOM 2167 NE ARG A 144 9.607 26.804 25.597 1.00 34.05 N ATOM 2168 CZ ARG A 144 10.556 25.932 25.917 1.00 63.11 C ATOM 2169 NH1 ARG A 144 10.238 24.680 26.216 1.00 10.13 N ATOM 2170 NH2 ARG A 144 11.828 26.311 25.937 1.00 53.32 N ATOM 0 H ARG A 144 5.480 23.563 22.982 1.00 52.50 H new ATOM 0 HA ARG A 144 5.226 24.169 25.754 1.00 13.32 H new ATOM 0 HB2 ARG A 144 7.462 24.006 25.628 1.00 20.14 H new ATOM 0 HB3 ARG A 144 7.271 23.629 23.927 1.00 20.14 H new ATOM 0 HG2 ARG A 144 8.742 25.395 23.778 1.00 41.12 H new ATOM 0 HG3 ARG A 144 7.224 26.261 23.643 1.00 41.12 H new ATOM 0 HD2 ARG A 144 7.598 27.387 25.561 1.00 15.23 H new ATOM 0 HD3 ARG A 144 7.917 25.908 26.445 1.00 15.23 H new ATOM 0 HE ARG A 144 9.886 27.759 25.371 1.00 34.05 H new ATOM 0 HH11 ARG A 144 9.262 24.384 26.201 1.00 10.13 H new ATOM 0 HH12 ARG A 144 10.969 24.013 26.461 1.00 10.13 H new ATOM 0 HH21 ARG A 144 12.077 27.273 25.706 1.00 53.32 H new ATOM 0 HH22 ARG A 144 12.556 25.640 26.183 1.00 53.32 H new ATOM 2184 N PHE A 145 4.838 26.583 23.632 1.00 52.41 N ATOM 2185 CA PHE A 145 4.496 27.993 23.486 1.00 54.35 C ATOM 2186 C PHE A 145 2.992 28.171 23.298 1.00 13.43 C ATOM 2187 O PHE A 145 2.531 29.220 22.849 1.00 72.33 O ATOM 2188 CB PHE A 145 5.244 28.601 22.298 1.00 43.05 C ATOM 2189 CG PHE A 145 6.731 28.392 22.355 1.00 34.22 C ATOM 2190 CD1 PHE A 145 7.508 29.096 23.260 1.00 41.30 C ATOM 2191 CD2 PHE A 145 7.350 27.491 21.504 1.00 61.00 C ATOM 2192 CE1 PHE A 145 8.876 28.906 23.316 1.00 60.11 C ATOM 2193 CE2 PHE A 145 8.717 27.296 21.556 1.00 44.14 C ATOM 2194 CZ PHE A 145 9.481 28.005 22.462 1.00 45.33 C ATOM 0 H PHE A 145 4.744 26.035 22.777 1.00 52.41 H new ATOM 0 HA PHE A 145 4.795 28.510 24.398 1.00 54.35 H new ATOM 0 HB2 PHE A 145 4.859 28.166 21.376 1.00 43.05 H new ATOM 0 HB3 PHE A 145 5.037 29.670 22.257 1.00 43.05 H new ATOM 0 HD1 PHE A 145 7.039 29.802 23.930 1.00 41.30 H new ATOM 0 HD2 PHE A 145 6.758 26.935 20.792 1.00 61.00 H new ATOM 0 HE1 PHE A 145 9.471 29.461 24.026 1.00 60.11 H new ATOM 0 HE2 PHE A 145 9.188 26.589 20.888 1.00 44.14 H new ATOM 0 HZ PHE A 145 10.550 27.855 22.503 1.00 45.33 H new ATOM 2204 N GLY A 146 2.231 27.138 23.646 1.00 24.44 N ATOM 2205 CA GLY A 146 0.788 27.199 23.509 1.00 30.21 C ATOM 2206 C GLY A 146 0.083 27.316 24.846 1.00 72.32 C ATOM 2207 O GLY A 146 0.705 27.174 25.898 1.00 24.02 O ATOM 0 H GLY A 146 2.589 26.259 24.021 1.00 24.44 H new ATOM 0 HA2 GLY A 146 0.521 28.052 22.885 1.00 30.21 H new ATOM 0 HA3 GLY A 146 0.437 26.305 22.994 1.00 30.21 H new ATOM 2211 N SER A 147 -1.220 27.577 24.805 1.00 21.21 N ATOM 2212 CA SER A 147 -2.009 27.718 26.023 1.00 55.42 C ATOM 2213 C SER A 147 -3.320 26.945 25.913 1.00 13.53 C ATOM 2214 O SER A 147 -3.937 26.895 24.849 1.00 41.41 O ATOM 2215 CB SER A 147 -2.297 29.195 26.301 1.00 42.24 C ATOM 2216 OG SER A 147 -2.570 29.412 27.674 1.00 21.01 O ATOM 0 H SER A 147 -1.751 27.695 23.942 1.00 21.21 H new ATOM 0 HA SER A 147 -1.432 27.305 26.850 1.00 55.42 H new ATOM 0 HB2 SER A 147 -1.442 29.799 25.997 1.00 42.24 H new ATOM 0 HB3 SER A 147 -3.147 29.522 25.702 1.00 42.24 H new ATOM 0 HG SER A 147 -3.538 29.493 27.806 1.00 21.01 H new ATOM 2222 N ARG A 148 -3.740 26.344 27.022 1.00 44.12 N ATOM 2223 CA ARG A 148 -4.976 25.572 27.051 1.00 11.32 C ATOM 2224 C ARG A 148 -6.190 26.485 26.906 1.00 73.14 C ATOM 2225 O ARG A 148 -6.816 26.864 27.895 1.00 51.15 O ATOM 2226 CB ARG A 148 -5.075 24.778 28.355 1.00 74.33 C ATOM 2227 CG ARG A 148 -3.857 23.913 28.635 1.00 74.41 C ATOM 2228 CD ARG A 148 -3.868 22.647 27.793 1.00 63.53 C ATOM 2229 NE ARG A 148 -5.082 21.862 27.999 1.00 52.03 N ATOM 2230 CZ ARG A 148 -5.269 21.056 29.038 1.00 61.44 C ATOM 2231 NH1 ARG A 148 -4.325 20.928 29.960 1.00 13.42 N ATOM 2232 NH2 ARG A 148 -6.402 20.375 29.155 1.00 24.43 N ATOM 0 H ARG A 148 -3.242 26.377 27.912 1.00 44.12 H new ATOM 0 HA ARG A 148 -4.962 24.878 26.211 1.00 11.32 H new ATOM 0 HB2 ARG A 148 -5.215 25.472 29.184 1.00 74.33 H new ATOM 0 HB3 ARG A 148 -5.960 24.143 28.318 1.00 74.33 H new ATOM 0 HG2 ARG A 148 -2.950 24.481 28.428 1.00 74.41 H new ATOM 0 HG3 ARG A 148 -3.833 23.648 29.692 1.00 74.41 H new ATOM 0 HD2 ARG A 148 -3.782 22.912 26.739 1.00 63.53 H new ATOM 0 HD3 ARG A 148 -2.997 22.040 28.041 1.00 63.53 H new ATOM 0 HE ARG A 148 -5.827 21.937 27.307 1.00 52.03 H new ATOM 0 HH11 ARG A 148 -3.453 21.449 29.872 1.00 13.42 H new ATOM 0 HH12 ARG A 148 -4.471 20.308 30.757 1.00 13.42 H new ATOM 0 HH21 ARG A 148 -7.130 20.470 28.447 1.00 24.43 H new ATOM 0 HH22 ARG A 148 -6.545 19.756 29.953 1.00 24.43 H new ATOM 2246 N ASN A 149 -6.517 26.834 25.665 1.00 25.23 N ATOM 2247 CA ASN A 149 -7.655 27.703 25.390 1.00 21.12 C ATOM 2248 C ASN A 149 -7.816 27.930 23.890 1.00 32.31 C ATOM 2249 O ASN A 149 -8.932 28.054 23.387 1.00 61.52 O ATOM 2250 CB ASN A 149 -7.483 29.045 26.105 1.00 70.13 C ATOM 2251 CG ASN A 149 -6.065 29.575 26.007 1.00 74.43 C ATOM 2252 OD1 ASN A 149 -5.269 29.422 26.933 1.00 44.13 O ATOM 2253 ND2 ASN A 149 -5.745 30.201 24.881 1.00 44.42 N ATOM 0 H ASN A 149 -6.010 26.528 24.835 1.00 25.23 H new ATOM 0 HA ASN A 149 -8.554 27.212 25.764 1.00 21.12 H new ATOM 0 HB2 ASN A 149 -8.171 29.773 25.675 1.00 70.13 H new ATOM 0 HB3 ASN A 149 -7.754 28.932 27.155 1.00 70.13 H new ATOM 0 HD21 ASN A 149 -4.806 30.579 24.757 1.00 44.42 H new ATOM 0 HD22 ASN A 149 -6.438 30.304 24.140 1.00 44.42 H new ATOM 2260 N GLY A 150 -6.693 27.982 23.181 1.00 43.42 N ATOM 2261 CA GLY A 150 -6.731 28.194 21.746 1.00 61.45 C ATOM 2262 C GLY A 150 -5.506 28.926 21.235 1.00 53.44 C ATOM 2263 O GLY A 150 -4.546 28.305 20.780 1.00 23.31 O ATOM 0 H GLY A 150 -5.757 27.881 23.575 1.00 43.42 H new ATOM 0 HA2 GLY A 150 -6.812 27.231 21.242 1.00 61.45 H new ATOM 0 HA3 GLY A 150 -7.624 28.764 21.490 1.00 61.45 H new ATOM 2267 N LYS A 151 -5.539 30.253 21.307 1.00 74.31 N ATOM 2268 CA LYS A 151 -4.424 31.073 20.848 1.00 75.41 C ATOM 2269 C LYS A 151 -3.120 30.636 21.508 1.00 14.52 C ATOM 2270 O LYS A 151 -3.114 29.765 22.378 1.00 25.30 O ATOM 2271 CB LYS A 151 -4.692 32.549 21.149 1.00 33.12 C ATOM 2272 CG LYS A 151 -4.169 33.492 20.080 1.00 12.51 C ATOM 2273 CD LYS A 151 -3.053 34.375 20.613 1.00 14.51 C ATOM 2274 CE LYS A 151 -3.542 35.791 20.878 1.00 4.45 C ATOM 2275 NZ LYS A 151 -3.843 36.520 19.615 1.00 10.02 N ATOM 0 H LYS A 151 -6.327 30.783 21.679 1.00 74.31 H new ATOM 0 HA LYS A 151 -4.327 30.941 19.770 1.00 75.41 H new ATOM 0 HB2 LYS A 151 -5.766 32.699 21.260 1.00 33.12 H new ATOM 0 HB3 LYS A 151 -4.233 32.806 22.104 1.00 33.12 H new ATOM 0 HG2 LYS A 151 -3.803 32.914 19.231 1.00 12.51 H new ATOM 0 HG3 LYS A 151 -4.984 34.116 19.713 1.00 12.51 H new ATOM 0 HD2 LYS A 151 -2.657 33.947 21.534 1.00 14.51 H new ATOM 0 HD3 LYS A 151 -2.233 34.400 19.895 1.00 14.51 H new ATOM 0 HE2 LYS A 151 -4.437 35.756 21.499 1.00 4.45 H new ATOM 0 HE3 LYS A 151 -2.785 36.337 21.441 1.00 4.45 H new ATOM 0 HZ1 LYS A 151 -3.858 37.543 19.800 1.00 10.02 H new ATOM 0 HZ2 LYS A 151 -3.111 36.307 18.908 1.00 10.02 H new ATOM 0 HZ3 LYS A 151 -4.771 36.220 19.254 1.00 10.02 H new ATOM 2289 N THR A 152 -2.017 31.249 21.091 1.00 41.35 N ATOM 2290 CA THR A 152 -0.707 30.925 21.641 1.00 33.44 C ATOM 2291 C THR A 152 0.165 32.170 21.757 1.00 72.45 C ATOM 2292 O THR A 152 -0.174 33.228 21.227 1.00 34.20 O ATOM 2293 CB THR A 152 0.022 29.879 20.777 1.00 21.22 C ATOM 2294 OG1 THR A 152 0.542 30.497 19.595 1.00 72.13 O ATOM 2295 CG2 THR A 152 -0.916 28.745 20.392 1.00 14.15 C ATOM 0 H THR A 152 -2.005 31.974 20.373 1.00 41.35 H new ATOM 0 HA THR A 152 -0.876 30.510 22.635 1.00 33.44 H new ATOM 0 HB THR A 152 0.844 29.466 21.362 1.00 21.22 H new ATOM 0 HG1 THR A 152 1.408 30.909 19.795 1.00 72.13 H new ATOM 0 HG21 THR A 152 -0.378 28.019 19.782 1.00 14.15 H new ATOM 0 HG22 THR A 152 -1.287 28.258 21.294 1.00 14.15 H new ATOM 0 HG23 THR A 152 -1.756 29.145 19.824 1.00 14.15 H new ATOM 2303 N SER A 153 1.290 32.036 22.451 1.00 2.01 N ATOM 2304 CA SER A 153 2.210 33.152 22.638 1.00 20.10 C ATOM 2305 C SER A 153 2.972 33.449 21.350 1.00 2.33 C ATOM 2306 O SER A 153 3.066 34.600 20.922 1.00 63.32 O ATOM 2307 CB SER A 153 3.195 32.845 23.768 1.00 70.33 C ATOM 2308 OG SER A 153 3.481 34.008 24.525 1.00 64.31 O ATOM 0 H SER A 153 1.587 31.166 22.893 1.00 2.01 H new ATOM 0 HA SER A 153 1.625 34.032 22.905 1.00 20.10 H new ATOM 0 HB2 SER A 153 2.778 32.077 24.419 1.00 70.33 H new ATOM 0 HB3 SER A 153 4.118 32.443 23.351 1.00 70.33 H new ATOM 0 HG SER A 153 4.111 33.785 25.242 1.00 64.31 H new ATOM 2314 N LYS A 154 3.515 32.403 20.737 1.00 44.41 N ATOM 2315 CA LYS A 154 4.269 32.549 19.497 1.00 10.22 C ATOM 2316 C LYS A 154 3.362 32.365 18.284 1.00 2.35 C ATOM 2317 O LYS A 154 2.161 32.132 18.424 1.00 44.14 O ATOM 2318 CB LYS A 154 5.414 31.535 19.450 1.00 71.22 C ATOM 2319 CG LYS A 154 6.746 32.099 19.913 1.00 32.25 C ATOM 2320 CD LYS A 154 7.541 31.073 20.703 1.00 62.20 C ATOM 2321 CE LYS A 154 9.037 31.230 20.474 1.00 54.41 C ATOM 2322 NZ LYS A 154 9.735 31.725 21.692 1.00 24.45 N ATOM 0 H LYS A 154 3.447 31.444 21.079 1.00 44.41 H new ATOM 0 HA LYS A 154 4.683 33.557 19.469 1.00 10.22 H new ATOM 0 HB2 LYS A 154 5.155 30.679 20.073 1.00 71.22 H new ATOM 0 HB3 LYS A 154 5.520 31.167 18.430 1.00 71.22 H new ATOM 0 HG2 LYS A 154 7.326 32.423 19.048 1.00 32.25 H new ATOM 0 HG3 LYS A 154 6.574 32.981 20.530 1.00 32.25 H new ATOM 0 HD2 LYS A 154 7.321 31.180 21.765 1.00 62.20 H new ATOM 0 HD3 LYS A 154 7.231 30.069 20.413 1.00 62.20 H new ATOM 0 HE2 LYS A 154 9.462 30.271 20.177 1.00 54.41 H new ATOM 0 HE3 LYS A 154 9.208 31.923 19.650 1.00 54.41 H new ATOM 0 HZ1 LYS A 154 10.740 31.883 21.476 1.00 24.45 H new ATOM 0 HZ2 LYS A 154 9.302 32.619 22.001 1.00 24.45 H new ATOM 0 HZ3 LYS A 154 9.651 31.019 22.451 1.00 24.45 H new ATOM 2336 N LYS A 155 3.945 32.470 17.095 1.00 55.22 N ATOM 2337 CA LYS A 155 3.190 32.313 15.857 1.00 65.22 C ATOM 2338 C LYS A 155 3.808 31.230 14.978 1.00 74.23 C ATOM 2339 O LYS A 155 4.878 31.421 14.401 1.00 43.55 O ATOM 2340 CB LYS A 155 3.142 33.638 15.093 1.00 12.11 C ATOM 2341 CG LYS A 155 2.894 33.473 13.604 1.00 54.13 C ATOM 2342 CD LYS A 155 1.615 32.698 13.334 1.00 62.50 C ATOM 2343 CE LYS A 155 0.384 33.494 13.739 1.00 42.04 C ATOM 2344 NZ LYS A 155 0.078 34.576 12.763 1.00 44.45 N ATOM 0 H LYS A 155 4.938 32.663 16.962 1.00 55.22 H new ATOM 0 HA LYS A 155 2.175 32.013 16.115 1.00 65.22 H new ATOM 0 HB2 LYS A 155 2.356 34.264 15.516 1.00 12.11 H new ATOM 0 HB3 LYS A 155 4.084 34.167 15.240 1.00 12.11 H new ATOM 0 HG2 LYS A 155 2.832 34.454 13.134 1.00 54.13 H new ATOM 0 HG3 LYS A 155 3.738 32.954 13.149 1.00 54.13 H new ATOM 0 HD2 LYS A 155 1.556 32.449 12.274 1.00 62.50 H new ATOM 0 HD3 LYS A 155 1.637 31.756 13.882 1.00 62.50 H new ATOM 0 HE2 LYS A 155 -0.472 32.824 13.819 1.00 42.04 H new ATOM 0 HE3 LYS A 155 0.541 33.929 14.726 1.00 42.04 H new ATOM 0 HZ1 LYS A 155 -0.839 35.007 12.998 1.00 44.45 H new ATOM 0 HZ2 LYS A 155 0.822 35.301 12.804 1.00 44.45 H new ATOM 0 HZ3 LYS A 155 0.037 34.177 11.804 1.00 44.45 H new ATOM 2358 N ILE A 156 3.125 30.094 14.880 1.00 65.23 N ATOM 2359 CA ILE A 156 3.606 28.982 14.069 1.00 42.23 C ATOM 2360 C ILE A 156 2.999 29.019 12.670 1.00 32.34 C ATOM 2361 O ILE A 156 1.807 28.763 12.491 1.00 5.15 O ATOM 2362 CB ILE A 156 3.281 27.626 14.722 1.00 14.24 C ATOM 2363 CG1 ILE A 156 3.962 27.517 16.088 1.00 61.11 C ATOM 2364 CG2 ILE A 156 3.713 26.484 13.816 1.00 71.34 C ATOM 2365 CD1 ILE A 156 3.175 28.158 17.209 1.00 12.12 C ATOM 0 H ILE A 156 2.238 29.920 15.352 1.00 65.23 H new ATOM 0 HA ILE A 156 4.688 29.090 13.996 1.00 42.23 H new ATOM 0 HB ILE A 156 2.203 27.559 14.868 1.00 14.24 H new ATOM 0 HG12 ILE A 156 4.121 26.464 16.322 1.00 61.11 H new ATOM 0 HG13 ILE A 156 4.946 27.983 16.033 1.00 61.11 H new ATOM 0 HG21 ILE A 156 3.476 25.532 14.292 1.00 71.34 H new ATOM 0 HG22 ILE A 156 3.186 26.555 12.865 1.00 71.34 H new ATOM 0 HG23 ILE A 156 4.787 26.545 13.641 1.00 71.34 H new ATOM 0 HD11 ILE A 156 3.718 28.042 18.147 1.00 12.12 H new ATOM 0 HD12 ILE A 156 3.038 29.218 16.997 1.00 12.12 H new ATOM 0 HD13 ILE A 156 2.201 27.676 17.292 1.00 12.12 H new ATOM 2377 N THR A 157 3.826 29.337 11.680 1.00 63.23 N ATOM 2378 CA THR A 157 3.372 29.406 10.297 1.00 52.23 C ATOM 2379 C THR A 157 4.170 28.459 9.408 1.00 53.45 C ATOM 2380 O THR A 157 5.257 28.015 9.777 1.00 43.34 O ATOM 2381 CB THR A 157 3.488 30.837 9.738 1.00 0.02 C ATOM 2382 OG1 THR A 157 4.217 31.662 10.654 1.00 51.54 O ATOM 2383 CG2 THR A 157 2.111 31.436 9.493 1.00 23.13 C ATOM 0 H THR A 157 4.815 29.551 11.810 1.00 63.23 H new ATOM 0 HA THR A 157 2.324 29.106 10.293 1.00 52.23 H new ATOM 0 HB THR A 157 4.020 30.791 8.788 1.00 0.02 H new ATOM 0 HG1 THR A 157 4.288 32.570 10.291 1.00 51.54 H new ATOM 0 HG21 THR A 157 2.219 32.446 9.099 1.00 23.13 H new ATOM 0 HG22 THR A 157 1.570 30.821 8.774 1.00 23.13 H new ATOM 0 HG23 THR A 157 1.557 31.470 10.431 1.00 23.13 H new ATOM 2391 N ILE A 158 3.623 28.155 8.235 1.00 4.02 N ATOM 2392 CA ILE A 158 4.286 27.262 7.293 1.00 43.00 C ATOM 2393 C ILE A 158 5.137 28.045 6.299 1.00 53.25 C ATOM 2394 O ILE A 158 4.627 28.884 5.556 1.00 60.53 O ATOM 2395 CB ILE A 158 3.268 26.405 6.518 1.00 41.34 C ATOM 2396 CG1 ILE A 158 2.164 25.913 7.456 1.00 63.54 C ATOM 2397 CG2 ILE A 158 3.965 25.231 5.848 1.00 63.40 C ATOM 2398 CD1 ILE A 158 2.687 25.321 8.746 1.00 42.20 C ATOM 0 H ILE A 158 2.723 28.514 7.915 1.00 4.02 H new ATOM 0 HA ILE A 158 4.929 26.606 7.879 1.00 43.00 H new ATOM 0 HB ILE A 158 2.812 27.021 5.743 1.00 41.34 H new ATOM 0 HG12 ILE A 158 1.500 26.745 7.690 1.00 63.54 H new ATOM 0 HG13 ILE A 158 1.565 25.164 6.938 1.00 63.54 H new ATOM 0 HG21 ILE A 158 3.232 24.635 5.304 1.00 63.40 H new ATOM 0 HG22 ILE A 158 4.718 25.603 5.153 1.00 63.40 H new ATOM 0 HG23 ILE A 158 4.445 24.612 6.606 1.00 63.40 H new ATOM 0 HD11 ILE A 158 1.849 24.993 9.362 1.00 42.20 H new ATOM 0 HD12 ILE A 158 3.328 24.468 8.522 1.00 42.20 H new ATOM 0 HD13 ILE A 158 3.261 26.074 9.286 1.00 42.20 H new ATOM 2410 N ALA A 159 6.436 27.765 6.289 1.00 34.52 N ATOM 2411 CA ALA A 159 7.357 28.440 5.383 1.00 34.33 C ATOM 2412 C ALA A 159 7.407 27.740 4.030 1.00 61.44 C ATOM 2413 O ALA A 159 7.149 28.352 2.993 1.00 1.23 O ATOM 2414 CB ALA A 159 8.747 28.506 5.997 1.00 1.34 C ATOM 0 H ALA A 159 6.875 27.075 6.899 1.00 34.52 H new ATOM 0 HA ALA A 159 6.993 29.455 5.224 1.00 34.33 H new ATOM 0 HB1 ALA A 159 9.425 29.013 5.310 1.00 1.34 H new ATOM 0 HB2 ALA A 159 8.704 29.057 6.936 1.00 1.34 H new ATOM 0 HB3 ALA A 159 9.110 27.496 6.185 1.00 1.34 H new ATOM 2420 N ASP A 160 7.741 26.454 4.046 1.00 44.12 N ATOM 2421 CA ASP A 160 7.825 25.670 2.819 1.00 44.32 C ATOM 2422 C ASP A 160 7.206 24.290 3.012 1.00 21.35 C ATOM 2423 O ASP A 160 7.099 23.799 4.137 1.00 62.41 O ATOM 2424 CB ASP A 160 9.283 25.532 2.376 1.00 73.23 C ATOM 2425 CG ASP A 160 9.412 24.927 0.991 1.00 12.14 C ATOM 2426 OD1 ASP A 160 8.454 25.048 0.200 1.00 51.22 O ATOM 2427 OD2 ASP A 160 10.471 24.332 0.700 1.00 74.10 O ATOM 0 H ASP A 160 7.958 25.932 4.895 1.00 44.12 H new ATOM 0 HA ASP A 160 7.266 26.193 2.044 1.00 44.32 H new ATOM 0 HB2 ASP A 160 9.757 26.513 2.386 1.00 73.23 H new ATOM 0 HB3 ASP A 160 9.820 24.911 3.092 1.00 73.23 H new ATOM 2432 N CYS A 161 6.799 23.670 1.910 1.00 23.34 N ATOM 2433 CA CYS A 161 6.189 22.346 1.959 1.00 75.00 C ATOM 2434 C CYS A 161 6.133 21.721 0.569 1.00 41.54 C ATOM 2435 O CYS A 161 5.977 22.421 -0.431 1.00 64.25 O ATOM 2436 CB CYS A 161 4.780 22.433 2.549 1.00 62.40 C ATOM 2437 SG CYS A 161 3.982 24.039 2.322 1.00 42.12 S ATOM 0 H CYS A 161 6.880 24.063 0.972 1.00 23.34 H new ATOM 0 HA CYS A 161 6.805 21.713 2.598 1.00 75.00 H new ATOM 0 HB2 CYS A 161 4.158 21.663 2.092 1.00 62.40 H new ATOM 0 HB3 CYS A 161 4.830 22.212 3.615 1.00 62.40 H new ATOM 0 HG CYS A 161 2.795 24.013 2.852 1.00 42.12 H new ATOM 2443 N GLY A 162 6.263 20.399 0.514 1.00 44.34 N ATOM 2444 CA GLY A 162 6.227 19.703 -0.759 1.00 63.30 C ATOM 2445 C GLY A 162 6.371 18.202 -0.603 1.00 21.23 C ATOM 2446 O GLY A 162 6.637 17.709 0.493 1.00 64.10 O ATOM 0 H GLY A 162 6.393 19.798 1.328 1.00 44.34 H new ATOM 0 HA2 GLY A 162 5.287 19.924 -1.264 1.00 63.30 H new ATOM 0 HA3 GLY A 162 7.027 20.077 -1.397 1.00 63.30 H new ATOM 2450 N GLN A 163 6.193 17.474 -1.701 1.00 12.34 N ATOM 2451 CA GLN A 163 6.302 16.020 -1.679 1.00 41.51 C ATOM 2452 C GLN A 163 7.732 15.587 -1.375 1.00 62.51 C ATOM 2453 O GLN A 163 8.690 16.153 -1.903 1.00 51.24 O ATOM 2454 CB GLN A 163 5.853 15.434 -3.019 1.00 15.34 C ATOM 2455 CG GLN A 163 4.480 14.784 -2.968 1.00 35.21 C ATOM 2456 CD GLN A 163 4.119 14.081 -4.262 1.00 33.35 C ATOM 2457 OE1 GLN A 163 3.701 14.715 -5.231 1.00 2.12 O ATOM 2458 NE2 GLN A 163 4.278 12.763 -4.284 1.00 22.43 N ATOM 0 H GLN A 163 5.973 17.867 -2.616 1.00 12.34 H new ATOM 0 HA GLN A 163 5.652 15.643 -0.890 1.00 41.51 H new ATOM 0 HB2 GLN A 163 5.843 16.226 -3.768 1.00 15.34 H new ATOM 0 HB3 GLN A 163 6.584 14.695 -3.346 1.00 15.34 H new ATOM 0 HG2 GLN A 163 4.452 14.066 -2.149 1.00 35.21 H new ATOM 0 HG3 GLN A 163 3.730 15.544 -2.751 1.00 35.21 H new ATOM 0 HE21 GLN A 163 4.627 12.278 -3.458 1.00 22.43 H new ATOM 0 HE22 GLN A 163 4.051 12.236 -5.127 1.00 22.43 H new ATOM 2467 N LEU A 164 7.870 14.579 -0.521 1.00 23.24 N ATOM 2468 CA LEU A 164 9.184 14.068 -0.145 1.00 44.44 C ATOM 2469 C LEU A 164 9.638 12.974 -1.106 1.00 60.11 C ATOM 2470 O LEU A 164 10.684 13.090 -1.744 1.00 30.42 O ATOM 2471 CB LEU A 164 9.154 13.527 1.285 1.00 73.22 C ATOM 2472 CG LEU A 164 9.114 14.574 2.398 1.00 12.13 C ATOM 2473 CD1 LEU A 164 10.503 15.141 2.648 1.00 73.10 C ATOM 2474 CD2 LEU A 164 8.136 15.687 2.049 1.00 24.11 C ATOM 0 H LEU A 164 7.088 14.099 -0.076 1.00 23.24 H new ATOM 0 HA LEU A 164 9.896 14.892 -0.199 1.00 44.44 H new ATOM 0 HB2 LEU A 164 8.282 12.881 1.390 1.00 73.22 H new ATOM 0 HB3 LEU A 164 10.034 12.901 1.434 1.00 73.22 H new ATOM 0 HG LEU A 164 8.771 14.091 3.313 1.00 12.13 H new ATOM 0 HD11 LEU A 164 10.455 15.885 3.443 1.00 73.10 H new ATOM 0 HD12 LEU A 164 11.177 14.337 2.944 1.00 73.10 H new ATOM 0 HD13 LEU A 164 10.875 15.609 1.736 1.00 73.10 H new ATOM 0 HD21 LEU A 164 8.121 16.423 2.853 1.00 24.11 H new ATOM 0 HD22 LEU A 164 8.448 16.168 1.122 1.00 24.11 H new ATOM 0 HD23 LEU A 164 7.138 15.268 1.922 1.00 24.11 H new ATOM 2486 N GLU A 165 8.843 11.913 -1.205 1.00 55.31 N ATOM 2487 CA GLU A 165 9.163 10.799 -2.090 1.00 14.15 C ATOM 2488 C GLU A 165 9.486 11.296 -3.496 1.00 15.03 C ATOM 2489 O GLU A 165 8.565 11.560 -4.268 1.00 62.20 O ATOM 2490 CB GLU A 165 7.997 9.809 -2.142 1.00 10.23 C ATOM 2491 CG GLU A 165 8.357 8.419 -1.647 1.00 32.54 C ATOM 2492 CD GLU A 165 9.723 7.965 -2.123 1.00 3.34 C ATOM 2493 OE1 GLU A 165 9.944 7.940 -3.352 1.00 23.44 O ATOM 2494 OE2 GLU A 165 10.571 7.636 -1.267 1.00 42.21 O ATOM 0 H GLU A 165 7.973 11.802 -0.684 1.00 55.31 H new ATOM 0 HA GLU A 165 10.042 10.293 -1.692 1.00 14.15 H new ATOM 0 HB2 GLU A 165 7.174 10.198 -1.542 1.00 10.23 H new ATOM 0 HB3 GLU A 165 7.637 9.738 -3.168 1.00 10.23 H new ATOM 0 HG2 GLU A 165 8.334 8.408 -0.557 1.00 32.54 H new ATOM 0 HG3 GLU A 165 7.603 7.709 -1.988 1.00 32.54 H new