USER MOD reduce.3.24.130724 H: found=0, std=0, add=807, rem=0, adj=22 USER MOD reduce.3.24.130724 removed 806 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 7 THR OG1 : rot -110:sc= 0.728 USER MOD Set 1.2: A 9 GLN : amide:sc= 0.831 K(o=1.6,f=1) USER MOD Single : A 1 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 1 MET N :NH3+ 170:sc= 2.31 (180deg=2.18) USER MOD Single : A 5 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 10 SER OG : rot 180:sc= 0 USER MOD Single : A 12 SER OG : rot 180:sc= 0.0508 USER MOD Single : A 15 THR OG1 : rot -87:sc= 1.3 USER MOD Single : A 16 SER OG : rot 63:sc= 1.29 USER MOD Single : A 33 LYS NZ :NH3+ 163:sc= 2.04 (180deg=1.5) USER MOD Single : A 34 MET CE :methyl -160:sc= -0.0945 (180deg=-0.382) USER MOD Single : A 44 GLN : amide:sc= 0.174 X(o=0.17,f=0) USER MOD Single : A 46 MET CE :methyl -163:sc= -0.21 (180deg=-0.717) USER MOD Single : A 49 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 51 LYS NZ :NH3+ 180:sc= 3.65 (180deg=3.65) USER MOD Single : A 54 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 60 ASN : amide:sc= 0.796 K(o=0.8,f=-4.9!) USER MOD Single : A 61 GLN : amide:sc= 1.1 K(o=1.1,f=-0.059) USER MOD Single : A 63 THR OG1 : rot -55:sc= 1.21 USER MOD Single : A 66 LYS NZ :NH3+ -149:sc= 1.26 (180deg=0.683) USER MOD Single : A 67 TYR OH : rot -147:sc= 0.242 USER MOD Single : A 70 MET CE :methyl 177:sc= 0 (180deg=-0.0109) USER MOD Single : A 71 SER OG : rot 180:sc= 0 USER MOD Single : A 74 THR OG1 : rot 134:sc= 1.29 USER MOD Single : A 79 LYS NZ :NH3+ -179:sc= 1.21 (180deg=1.2) USER MOD Single : A 86 THR OG1 : rot 180:sc=-0.00891 USER MOD Single : A 87 SER OG : rot -160:sc= 0 USER MOD Single : A 91 LYS NZ :NH3+ -138:sc= 2.21 (180deg=0.301) USER MOD Single : A 93 LYS NZ :NH3+ -167:sc= 1.24 (180deg=1.07) USER MOD Single : A 97 GLN : amide:sc= 0.737 K(o=0.74,f=0) USER MOD Single : A 101 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 102 LYS NZ :NH3+ -168:sc= 1.22 (180deg=1.14) USER MOD Single : A 103 HIS : no HE2:sc= -0.128 K(o=-0.13,f=-2.1) USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 0.553 -1.515 1.290 1.00 0.00 N ATOM 2 CA MET A 1 0.438 -0.066 1.021 1.00 0.00 C ATOM 3 C MET A 1 1.641 0.404 0.191 1.00 0.00 C ATOM 4 O MET A 1 1.619 0.264 -1.033 1.00 0.00 O ATOM 5 CB MET A 1 0.212 0.780 2.298 1.00 0.00 C ATOM 6 CG MET A 1 -1.096 0.472 3.041 1.00 0.00 C ATOM 7 SD MET A 1 -1.098 -1.070 4.002 1.00 0.00 S ATOM 8 CE MET A 1 -2.787 -1.016 4.659 1.00 0.00 C ATOM 0 H1 MET A 1 -0.165 -1.797 1.988 1.00 0.00 H new ATOM 0 H2 MET A 1 0.404 -2.045 0.407 1.00 0.00 H new ATOM 0 H3 MET A 1 1.500 -1.724 1.664 1.00 0.00 H new ATOM 0 HA MET A 1 -0.465 0.095 0.433 1.00 0.00 H new ATOM 0 HB2 MET A 1 1.048 0.619 2.978 1.00 0.00 H new ATOM 0 HB3 MET A 1 0.221 1.835 2.026 1.00 0.00 H new ATOM 0 HG2 MET A 1 -1.316 1.301 3.714 1.00 0.00 H new ATOM 0 HG3 MET A 1 -1.906 0.428 2.313 1.00 0.00 H new ATOM 0 HE1 MET A 1 -2.965 -1.895 5.279 1.00 0.00 H new ATOM 0 HE2 MET A 1 -2.915 -0.116 5.260 1.00 0.00 H new ATOM 0 HE3 MET A 1 -3.498 -1.005 3.833 1.00 0.00 H new ATOM 20 N ALA A 2 2.679 0.973 0.822 1.00 0.00 N ATOM 21 CA ALA A 2 3.878 1.517 0.190 1.00 0.00 C ATOM 22 C ALA A 2 4.960 1.652 1.273 1.00 0.00 C ATOM 23 O ALA A 2 4.738 1.249 2.422 1.00 0.00 O ATOM 24 CB ALA A 2 3.553 2.897 -0.407 1.00 0.00 C ATOM 0 H ALA A 2 2.700 1.068 1.837 1.00 0.00 H new ATOM 0 HA ALA A 2 4.228 0.864 -0.609 1.00 0.00 H new ATOM 0 HB1 ALA A 2 4.445 3.308 -0.880 1.00 0.00 H new ATOM 0 HB2 ALA A 2 2.762 2.795 -1.150 1.00 0.00 H new ATOM 0 HB3 ALA A 2 3.221 3.567 0.386 1.00 0.00 H new ATOM 30 N ILE A 3 6.119 2.224 0.932 1.00 0.00 N ATOM 31 CA ILE A 3 7.082 2.667 1.936 1.00 0.00 C ATOM 32 C ILE A 3 6.523 3.973 2.524 1.00 0.00 C ATOM 33 O ILE A 3 5.929 4.787 1.809 1.00 0.00 O ATOM 34 CB ILE A 3 8.478 2.854 1.304 1.00 0.00 C ATOM 35 CG1 ILE A 3 9.017 1.521 0.730 1.00 0.00 C ATOM 36 CG2 ILE A 3 9.510 3.405 2.309 1.00 0.00 C ATOM 37 CD1 ILE A 3 9.682 1.738 -0.627 1.00 0.00 C ATOM 0 H ILE A 3 6.410 2.389 -0.032 1.00 0.00 H new ATOM 0 HA ILE A 3 7.214 1.929 2.727 1.00 0.00 H new ATOM 0 HB ILE A 3 8.347 3.580 0.502 1.00 0.00 H new ATOM 0 HG12 ILE A 3 9.735 1.086 1.425 1.00 0.00 H new ATOM 0 HG13 ILE A 3 8.199 0.808 0.628 1.00 0.00 H new ATOM 0 HG21 ILE A 3 10.475 3.518 1.815 1.00 0.00 H new ATOM 0 HG22 ILE A 3 9.176 4.374 2.679 1.00 0.00 H new ATOM 0 HG23 ILE A 3 9.610 2.712 3.145 1.00 0.00 H new ATOM 0 HD11 ILE A 3 10.052 0.786 -1.007 1.00 0.00 H new ATOM 0 HD12 ILE A 3 8.955 2.151 -1.327 1.00 0.00 H new ATOM 0 HD13 ILE A 3 10.515 2.433 -0.517 1.00 0.00 H new ATOM 49 N VAL A 4 6.735 4.183 3.820 1.00 0.00 N ATOM 50 CA VAL A 4 6.213 5.291 4.611 1.00 0.00 C ATOM 51 C VAL A 4 7.365 5.791 5.496 1.00 0.00 C ATOM 52 O VAL A 4 8.356 5.086 5.711 1.00 0.00 O ATOM 53 CB VAL A 4 4.985 4.800 5.428 1.00 0.00 C ATOM 54 CG1 VAL A 4 4.239 5.922 6.170 1.00 0.00 C ATOM 55 CG2 VAL A 4 3.945 4.067 4.560 1.00 0.00 C ATOM 0 H VAL A 4 7.308 3.549 4.377 1.00 0.00 H new ATOM 0 HA VAL A 4 5.862 6.119 3.994 1.00 0.00 H new ATOM 0 HB VAL A 4 5.428 4.119 6.154 1.00 0.00 H new ATOM 0 HG11 VAL A 4 3.396 5.499 6.716 1.00 0.00 H new ATOM 0 HG12 VAL A 4 4.918 6.409 6.870 1.00 0.00 H new ATOM 0 HG13 VAL A 4 3.874 6.654 5.450 1.00 0.00 H new ATOM 0 HG21 VAL A 4 3.111 3.747 5.184 1.00 0.00 H new ATOM 0 HG22 VAL A 4 3.581 4.739 3.783 1.00 0.00 H new ATOM 0 HG23 VAL A 4 4.407 3.195 4.097 1.00 0.00 H new ATOM 65 N LYS A 5 7.221 6.999 6.035 1.00 0.00 N ATOM 66 CA LYS A 5 8.126 7.617 7.001 1.00 0.00 C ATOM 67 C LYS A 5 7.272 7.882 8.232 1.00 0.00 C ATOM 68 O LYS A 5 6.170 8.419 8.102 1.00 0.00 O ATOM 69 CB LYS A 5 8.720 8.911 6.406 1.00 0.00 C ATOM 70 CG LYS A 5 10.257 8.984 6.451 1.00 0.00 C ATOM 71 CD LYS A 5 10.908 8.886 7.843 1.00 0.00 C ATOM 72 CE LYS A 5 10.233 9.742 8.922 1.00 0.00 C ATOM 73 NZ LYS A 5 10.419 11.204 8.714 1.00 0.00 N ATOM 0 H LYS A 5 6.433 7.602 5.799 1.00 0.00 H new ATOM 0 HA LYS A 5 8.978 6.986 7.255 1.00 0.00 H new ATOM 0 HB2 LYS A 5 8.394 9.003 5.370 1.00 0.00 H new ATOM 0 HB3 LYS A 5 8.312 9.765 6.946 1.00 0.00 H new ATOM 0 HG2 LYS A 5 10.655 8.181 5.831 1.00 0.00 H new ATOM 0 HG3 LYS A 5 10.568 9.924 5.994 1.00 0.00 H new ATOM 0 HD2 LYS A 5 10.896 7.844 8.163 1.00 0.00 H new ATOM 0 HD3 LYS A 5 11.954 9.183 7.763 1.00 0.00 H new ATOM 0 HE2 LYS A 5 9.167 9.517 8.940 1.00 0.00 H new ATOM 0 HE3 LYS A 5 10.633 9.467 9.898 1.00 0.00 H new ATOM 0 HZ1 LYS A 5 9.940 11.727 9.475 1.00 0.00 H new ATOM 0 HZ2 LYS A 5 11.434 11.430 8.725 1.00 0.00 H new ATOM 0 HZ3 LYS A 5 10.013 11.479 7.797 1.00 0.00 H new ATOM 87 N ALA A 6 7.773 7.517 9.409 1.00 0.00 N ATOM 88 CA ALA A 6 7.045 7.654 10.668 1.00 0.00 C ATOM 89 C ALA A 6 7.951 8.207 11.766 1.00 0.00 C ATOM 90 O ALA A 6 9.172 8.277 11.611 1.00 0.00 O ATOM 91 CB ALA A 6 6.461 6.293 11.075 1.00 0.00 C ATOM 0 H ALA A 6 8.704 7.114 9.517 1.00 0.00 H new ATOM 0 HA ALA A 6 6.229 8.363 10.528 1.00 0.00 H new ATOM 0 HB1 ALA A 6 5.918 6.396 12.014 1.00 0.00 H new ATOM 0 HB2 ALA A 6 5.780 5.942 10.299 1.00 0.00 H new ATOM 0 HB3 ALA A 6 7.270 5.573 11.201 1.00 0.00 H new ATOM 97 N THR A 7 7.327 8.567 12.886 1.00 0.00 N ATOM 98 CA THR A 7 7.974 8.918 14.140 1.00 0.00 C ATOM 99 C THR A 7 7.205 8.226 15.263 1.00 0.00 C ATOM 100 O THR A 7 6.106 7.709 15.037 1.00 0.00 O ATOM 101 CB THR A 7 7.983 10.443 14.349 1.00 0.00 C ATOM 102 OG1 THR A 7 6.695 11.004 14.162 1.00 0.00 O ATOM 103 CG2 THR A 7 8.956 11.169 13.422 1.00 0.00 C ATOM 0 H THR A 7 6.310 8.623 12.942 1.00 0.00 H new ATOM 0 HA THR A 7 9.014 8.591 14.130 1.00 0.00 H new ATOM 0 HB THR A 7 8.310 10.584 15.379 1.00 0.00 H new ATOM 0 HG1 THR A 7 6.686 11.537 13.339 1.00 0.00 H new ATOM 0 HG21 THR A 7 8.915 12.240 13.619 1.00 0.00 H new ATOM 0 HG22 THR A 7 9.968 10.806 13.600 1.00 0.00 H new ATOM 0 HG23 THR A 7 8.680 10.980 12.385 1.00 0.00 H new ATOM 111 N ASP A 8 7.727 8.280 16.488 1.00 0.00 N ATOM 112 CA ASP A 8 7.102 7.707 17.682 1.00 0.00 C ATOM 113 C ASP A 8 5.645 8.154 17.868 1.00 0.00 C ATOM 114 O ASP A 8 4.829 7.426 18.432 1.00 0.00 O ATOM 115 CB ASP A 8 7.898 8.104 18.930 1.00 0.00 C ATOM 116 CG ASP A 8 7.517 7.211 20.120 1.00 0.00 C ATOM 117 OD1 ASP A 8 7.865 6.006 20.093 1.00 0.00 O ATOM 118 OD2 ASP A 8 6.894 7.711 21.084 1.00 0.00 O ATOM 0 H ASP A 8 8.619 8.735 16.684 1.00 0.00 H new ATOM 0 HA ASP A 8 7.105 6.626 17.544 1.00 0.00 H new ATOM 0 HB2 ASP A 8 8.966 8.017 18.730 1.00 0.00 H new ATOM 0 HB3 ASP A 8 7.704 9.148 19.175 1.00 0.00 H new ATOM 123 N GLN A 9 5.324 9.347 17.355 1.00 0.00 N ATOM 124 CA GLN A 9 4.007 9.972 17.384 1.00 0.00 C ATOM 125 C GLN A 9 2.924 9.110 16.718 1.00 0.00 C ATOM 126 O GLN A 9 1.769 9.149 17.150 1.00 0.00 O ATOM 127 CB GLN A 9 4.076 11.330 16.659 1.00 0.00 C ATOM 128 CG GLN A 9 5.132 12.297 17.224 1.00 0.00 C ATOM 129 CD GLN A 9 5.187 13.592 16.414 1.00 0.00 C ATOM 130 OE1 GLN A 9 4.719 14.643 16.850 1.00 0.00 O ATOM 131 NE2 GLN A 9 5.750 13.552 15.217 1.00 0.00 N ATOM 0 H GLN A 9 6.017 9.929 16.884 1.00 0.00 H new ATOM 0 HA GLN A 9 3.732 10.095 18.431 1.00 0.00 H new ATOM 0 HB2 GLN A 9 4.288 11.155 15.604 1.00 0.00 H new ATOM 0 HB3 GLN A 9 3.098 11.807 16.713 1.00 0.00 H new ATOM 0 HG2 GLN A 9 4.900 12.525 18.264 1.00 0.00 H new ATOM 0 HG3 GLN A 9 6.111 11.817 17.214 1.00 0.00 H new ATOM 0 HE21 GLN A 9 6.135 12.676 14.864 1.00 0.00 H new ATOM 0 HE22 GLN A 9 5.799 14.397 14.648 1.00 0.00 H new ATOM 140 N SER A 10 3.289 8.338 15.687 1.00 0.00 N ATOM 141 CA SER A 10 2.338 7.644 14.814 1.00 0.00 C ATOM 142 C SER A 10 2.800 6.240 14.405 1.00 0.00 C ATOM 143 O SER A 10 2.050 5.527 13.741 1.00 0.00 O ATOM 144 CB SER A 10 2.081 8.499 13.562 1.00 0.00 C ATOM 145 OG SER A 10 1.731 9.836 13.894 1.00 0.00 O ATOM 0 H SER A 10 4.264 8.177 15.434 1.00 0.00 H new ATOM 0 HA SER A 10 1.419 7.510 15.384 1.00 0.00 H new ATOM 0 HB2 SER A 10 2.973 8.502 12.936 1.00 0.00 H new ATOM 0 HB3 SER A 10 1.281 8.050 12.974 1.00 0.00 H new ATOM 0 HG SER A 10 1.577 10.348 13.072 1.00 0.00 H new ATOM 151 N PHE A 11 4.007 5.821 14.796 1.00 0.00 N ATOM 152 CA PHE A 11 4.580 4.527 14.441 1.00 0.00 C ATOM 153 C PHE A 11 3.639 3.375 14.802 1.00 0.00 C ATOM 154 O PHE A 11 3.456 2.451 14.009 1.00 0.00 O ATOM 155 CB PHE A 11 5.934 4.385 15.150 1.00 0.00 C ATOM 156 CG PHE A 11 6.664 3.098 14.838 1.00 0.00 C ATOM 157 CD1 PHE A 11 7.460 3.013 13.683 1.00 0.00 C ATOM 158 CD2 PHE A 11 6.549 1.987 15.696 1.00 0.00 C ATOM 159 CE1 PHE A 11 8.149 1.827 13.390 1.00 0.00 C ATOM 160 CE2 PHE A 11 7.233 0.798 15.397 1.00 0.00 C ATOM 161 CZ PHE A 11 8.036 0.718 14.247 1.00 0.00 C ATOM 0 H PHE A 11 4.623 6.386 15.380 1.00 0.00 H new ATOM 0 HA PHE A 11 4.724 4.479 13.362 1.00 0.00 H new ATOM 0 HB2 PHE A 11 6.568 5.226 14.870 1.00 0.00 H new ATOM 0 HB3 PHE A 11 5.776 4.449 16.227 1.00 0.00 H new ATOM 0 HD1 PHE A 11 7.541 3.862 13.020 1.00 0.00 H new ATOM 0 HD2 PHE A 11 5.936 2.050 16.583 1.00 0.00 H new ATOM 0 HE1 PHE A 11 8.766 1.766 12.506 1.00 0.00 H new ATOM 0 HE2 PHE A 11 7.142 -0.056 16.052 1.00 0.00 H new ATOM 0 HZ PHE A 11 8.566 -0.195 14.021 1.00 0.00 H new ATOM 171 N SER A 12 3.001 3.441 15.972 1.00 0.00 N ATOM 172 CA SER A 12 2.042 2.449 16.434 1.00 0.00 C ATOM 173 C SER A 12 0.844 2.337 15.492 1.00 0.00 C ATOM 174 O SER A 12 0.445 1.233 15.119 1.00 0.00 O ATOM 175 CB SER A 12 1.617 2.814 17.865 1.00 0.00 C ATOM 176 OG SER A 12 1.453 4.221 18.008 1.00 0.00 O ATOM 0 H SER A 12 3.143 4.203 16.635 1.00 0.00 H new ATOM 0 HA SER A 12 2.509 1.464 16.437 1.00 0.00 H new ATOM 0 HB2 SER A 12 0.683 2.309 18.110 1.00 0.00 H new ATOM 0 HB3 SER A 12 2.366 2.458 18.572 1.00 0.00 H new ATOM 0 HG SER A 12 1.181 4.427 18.927 1.00 0.00 H new ATOM 182 N ALA A 13 0.289 3.473 15.068 1.00 0.00 N ATOM 183 CA ALA A 13 -0.830 3.503 14.140 1.00 0.00 C ATOM 184 C ALA A 13 -0.415 2.919 12.791 1.00 0.00 C ATOM 185 O ALA A 13 -1.143 2.110 12.217 1.00 0.00 O ATOM 186 CB ALA A 13 -1.356 4.935 13.987 1.00 0.00 C ATOM 0 H ALA A 13 0.607 4.397 15.362 1.00 0.00 H new ATOM 0 HA ALA A 13 -1.637 2.889 14.539 1.00 0.00 H new ATOM 0 HB1 ALA A 13 -2.194 4.942 13.289 1.00 0.00 H new ATOM 0 HB2 ALA A 13 -1.688 5.306 14.957 1.00 0.00 H new ATOM 0 HB3 ALA A 13 -0.561 5.576 13.606 1.00 0.00 H new ATOM 192 N GLU A 14 0.772 3.291 12.305 1.00 0.00 N ATOM 193 CA GLU A 14 1.274 2.814 11.024 1.00 0.00 C ATOM 194 C GLU A 14 1.480 1.299 11.047 1.00 0.00 C ATOM 195 O GLU A 14 1.182 0.633 10.055 1.00 0.00 O ATOM 196 CB GLU A 14 2.578 3.532 10.620 1.00 0.00 C ATOM 197 CG GLU A 14 2.375 4.986 10.155 1.00 0.00 C ATOM 198 CD GLU A 14 1.403 5.139 8.968 1.00 0.00 C ATOM 199 OE1 GLU A 14 1.221 4.176 8.188 1.00 0.00 O ATOM 200 OE2 GLU A 14 0.813 6.233 8.814 1.00 0.00 O ATOM 0 H GLU A 14 1.405 3.928 12.789 1.00 0.00 H new ATOM 0 HA GLU A 14 0.520 3.049 10.273 1.00 0.00 H new ATOM 0 HB2 GLU A 14 3.262 3.525 11.468 1.00 0.00 H new ATOM 0 HB3 GLU A 14 3.057 2.969 9.819 1.00 0.00 H new ATOM 0 HG2 GLU A 14 2.003 5.575 10.993 1.00 0.00 H new ATOM 0 HG3 GLU A 14 3.342 5.405 9.875 1.00 0.00 H new ATOM 207 N THR A 15 1.935 0.743 12.169 1.00 0.00 N ATOM 208 CA THR A 15 2.232 -0.672 12.318 1.00 0.00 C ATOM 209 C THR A 15 0.998 -1.518 12.659 1.00 0.00 C ATOM 210 O THR A 15 1.117 -2.735 12.813 1.00 0.00 O ATOM 211 CB THR A 15 3.400 -0.848 13.303 1.00 0.00 C ATOM 212 OG1 THR A 15 3.194 -0.164 14.518 1.00 0.00 O ATOM 213 CG2 THR A 15 4.715 -0.344 12.694 1.00 0.00 C ATOM 0 H THR A 15 2.110 1.281 13.018 1.00 0.00 H new ATOM 0 HA THR A 15 2.549 -1.063 11.351 1.00 0.00 H new ATOM 0 HB THR A 15 3.456 -1.918 13.505 1.00 0.00 H new ATOM 0 HG1 THR A 15 3.513 0.759 14.432 1.00 0.00 H new ATOM 0 HG21 THR A 15 5.524 -0.480 13.412 1.00 0.00 H new ATOM 0 HG22 THR A 15 4.935 -0.907 11.787 1.00 0.00 H new ATOM 0 HG23 THR A 15 4.621 0.714 12.450 1.00 0.00 H new ATOM 221 N SER A 16 -0.192 -0.911 12.716 1.00 0.00 N ATOM 222 CA SER A 16 -1.438 -1.578 13.073 1.00 0.00 C ATOM 223 C SER A 16 -2.310 -1.839 11.836 1.00 0.00 C ATOM 224 O SER A 16 -3.538 -1.835 11.919 1.00 0.00 O ATOM 225 CB SER A 16 -2.160 -0.777 14.167 1.00 0.00 C ATOM 226 OG SER A 16 -1.368 -0.693 15.337 1.00 0.00 O ATOM 0 H SER A 16 -0.313 0.081 12.510 1.00 0.00 H new ATOM 0 HA SER A 16 -1.215 -2.562 13.484 1.00 0.00 H new ATOM 0 HB2 SER A 16 -2.384 0.225 13.802 1.00 0.00 H new ATOM 0 HB3 SER A 16 -3.113 -1.251 14.401 1.00 0.00 H new ATOM 0 HG SER A 16 -0.538 -0.213 15.136 1.00 0.00 H new ATOM 232 N GLU A 17 -1.678 -2.064 10.679 1.00 0.00 N ATOM 233 CA GLU A 17 -2.353 -2.277 9.399 1.00 0.00 C ATOM 234 C GLU A 17 -1.729 -3.470 8.662 1.00 0.00 C ATOM 235 O GLU A 17 -1.128 -3.321 7.596 1.00 0.00 O ATOM 236 CB GLU A 17 -2.377 -0.982 8.563 1.00 0.00 C ATOM 237 CG GLU A 17 -3.198 0.140 9.218 1.00 0.00 C ATOM 238 CD GLU A 17 -3.466 1.300 8.245 1.00 0.00 C ATOM 239 OE1 GLU A 17 -2.494 1.875 7.706 1.00 0.00 O ATOM 240 OE2 GLU A 17 -4.647 1.652 8.024 1.00 0.00 O ATOM 0 H GLU A 17 -0.661 -2.103 10.607 1.00 0.00 H new ATOM 0 HA GLU A 17 -3.397 -2.532 9.580 1.00 0.00 H new ATOM 0 HB2 GLU A 17 -1.355 -0.635 8.411 1.00 0.00 H new ATOM 0 HB3 GLU A 17 -2.790 -1.199 7.578 1.00 0.00 H new ATOM 0 HG2 GLU A 17 -4.147 -0.264 9.571 1.00 0.00 H new ATOM 0 HG3 GLU A 17 -2.666 0.515 10.092 1.00 0.00 H new ATOM 247 N GLY A 18 -1.850 -4.664 9.251 1.00 0.00 N ATOM 248 CA GLY A 18 -1.362 -5.906 8.661 1.00 0.00 C ATOM 249 C GLY A 18 0.083 -6.141 9.075 1.00 0.00 C ATOM 250 O GLY A 18 0.520 -5.624 10.108 1.00 0.00 O ATOM 0 H GLY A 18 -2.295 -4.792 10.160 1.00 0.00 H new ATOM 0 HA2 GLY A 18 -1.983 -6.741 8.984 1.00 0.00 H new ATOM 0 HA3 GLY A 18 -1.435 -5.856 7.575 1.00 0.00 H new ATOM 254 N VAL A 19 0.811 -6.951 8.304 1.00 0.00 N ATOM 255 CA VAL A 19 2.259 -7.063 8.461 1.00 0.00 C ATOM 256 C VAL A 19 2.866 -5.746 7.980 1.00 0.00 C ATOM 257 O VAL A 19 2.509 -5.232 6.915 1.00 0.00 O ATOM 258 CB VAL A 19 2.847 -8.268 7.697 1.00 0.00 C ATOM 259 CG1 VAL A 19 4.377 -8.371 7.884 1.00 0.00 C ATOM 260 CG2 VAL A 19 2.220 -9.579 8.196 1.00 0.00 C ATOM 0 H VAL A 19 0.421 -7.537 7.566 1.00 0.00 H new ATOM 0 HA VAL A 19 2.502 -7.243 9.508 1.00 0.00 H new ATOM 0 HB VAL A 19 2.621 -8.112 6.642 1.00 0.00 H new ATOM 0 HG11 VAL A 19 4.754 -9.231 7.331 1.00 0.00 H new ATOM 0 HG12 VAL A 19 4.851 -7.463 7.510 1.00 0.00 H new ATOM 0 HG13 VAL A 19 4.607 -8.491 8.943 1.00 0.00 H new ATOM 0 HG21 VAL A 19 2.646 -10.418 7.646 1.00 0.00 H new ATOM 0 HG22 VAL A 19 2.426 -9.699 9.260 1.00 0.00 H new ATOM 0 HG23 VAL A 19 1.142 -9.551 8.037 1.00 0.00 H new ATOM 270 N VAL A 20 3.815 -5.229 8.749 1.00 0.00 N ATOM 271 CA VAL A 20 4.534 -4.002 8.478 1.00 0.00 C ATOM 272 C VAL A 20 5.994 -4.296 8.807 1.00 0.00 C ATOM 273 O VAL A 20 6.287 -4.982 9.788 1.00 0.00 O ATOM 274 CB VAL A 20 3.935 -2.859 9.327 1.00 0.00 C ATOM 275 CG1 VAL A 20 4.619 -1.522 9.007 1.00 0.00 C ATOM 276 CG2 VAL A 20 2.417 -2.709 9.082 1.00 0.00 C ATOM 0 H VAL A 20 4.114 -5.677 9.615 1.00 0.00 H new ATOM 0 HA VAL A 20 4.455 -3.675 7.441 1.00 0.00 H new ATOM 0 HB VAL A 20 4.105 -3.119 10.372 1.00 0.00 H new ATOM 0 HG11 VAL A 20 4.180 -0.733 9.618 1.00 0.00 H new ATOM 0 HG12 VAL A 20 5.685 -1.597 9.224 1.00 0.00 H new ATOM 0 HG13 VAL A 20 4.479 -1.285 7.952 1.00 0.00 H new ATOM 0 HG21 VAL A 20 2.028 -1.896 9.695 1.00 0.00 H new ATOM 0 HG22 VAL A 20 2.238 -2.487 8.030 1.00 0.00 H new ATOM 0 HG23 VAL A 20 1.912 -3.638 9.348 1.00 0.00 H new ATOM 286 N LEU A 21 6.918 -3.790 7.993 1.00 0.00 N ATOM 287 CA LEU A 21 8.346 -4.004 8.160 1.00 0.00 C ATOM 288 C LEU A 21 8.971 -2.631 8.366 1.00 0.00 C ATOM 289 O LEU A 21 9.127 -1.848 7.427 1.00 0.00 O ATOM 290 CB LEU A 21 8.897 -4.777 6.954 1.00 0.00 C ATOM 291 CG LEU A 21 10.422 -4.993 7.035 1.00 0.00 C ATOM 292 CD1 LEU A 21 10.824 -5.945 8.154 1.00 0.00 C ATOM 293 CD2 LEU A 21 10.948 -5.526 5.702 1.00 0.00 C ATOM 0 H LEU A 21 6.687 -3.210 7.186 1.00 0.00 H new ATOM 0 HA LEU A 21 8.587 -4.621 9.026 1.00 0.00 H new ATOM 0 HB2 LEU A 21 8.400 -5.745 6.889 1.00 0.00 H new ATOM 0 HB3 LEU A 21 8.659 -4.234 6.039 1.00 0.00 H new ATOM 0 HG LEU A 21 10.866 -4.022 7.256 1.00 0.00 H new ATOM 0 HD11 LEU A 21 11.908 -6.059 8.163 1.00 0.00 H new ATOM 0 HD12 LEU A 21 10.494 -5.542 9.111 1.00 0.00 H new ATOM 0 HD13 LEU A 21 10.358 -6.917 7.990 1.00 0.00 H new ATOM 0 HD21 LEU A 21 12.026 -5.675 5.770 1.00 0.00 H new ATOM 0 HD22 LEU A 21 10.464 -6.475 5.473 1.00 0.00 H new ATOM 0 HD23 LEU A 21 10.730 -4.808 4.912 1.00 0.00 H new ATOM 305 N ALA A 22 9.237 -2.296 9.621 1.00 0.00 N ATOM 306 CA ALA A 22 9.867 -1.048 9.978 1.00 0.00 C ATOM 307 C ALA A 22 11.371 -1.158 9.747 1.00 0.00 C ATOM 308 O ALA A 22 11.952 -2.228 9.940 1.00 0.00 O ATOM 309 CB ALA A 22 9.577 -0.738 11.438 1.00 0.00 C ATOM 0 H ALA A 22 9.017 -2.891 10.420 1.00 0.00 H new ATOM 0 HA ALA A 22 9.473 -0.241 9.360 1.00 0.00 H new ATOM 0 HB1 ALA A 22 10.052 0.204 11.711 1.00 0.00 H new ATOM 0 HB2 ALA A 22 8.500 -0.658 11.586 1.00 0.00 H new ATOM 0 HB3 ALA A 22 9.971 -1.538 12.065 1.00 0.00 H new ATOM 315 N ASP A 23 11.990 -0.029 9.412 1.00 0.00 N ATOM 316 CA ASP A 23 13.399 0.121 9.081 1.00 0.00 C ATOM 317 C ASP A 23 13.945 1.282 9.905 1.00 0.00 C ATOM 318 O ASP A 23 13.781 2.458 9.566 1.00 0.00 O ATOM 319 CB ASP A 23 13.587 0.341 7.575 1.00 0.00 C ATOM 320 CG ASP A 23 15.048 0.693 7.240 1.00 0.00 C ATOM 321 OD1 ASP A 23 15.966 0.027 7.768 1.00 0.00 O ATOM 322 OD2 ASP A 23 15.269 1.606 6.413 1.00 0.00 O ATOM 0 H ASP A 23 11.488 0.858 9.362 1.00 0.00 H new ATOM 0 HA ASP A 23 13.951 -0.787 9.324 1.00 0.00 H new ATOM 0 HB2 ASP A 23 13.294 -0.559 7.034 1.00 0.00 H new ATOM 0 HB3 ASP A 23 12.931 1.143 7.238 1.00 0.00 H new ATOM 327 N PHE A 24 14.508 0.928 11.054 1.00 0.00 N ATOM 328 CA PHE A 24 15.185 1.825 11.969 1.00 0.00 C ATOM 329 C PHE A 24 16.524 2.147 11.320 1.00 0.00 C ATOM 330 O PHE A 24 17.359 1.252 11.126 1.00 0.00 O ATOM 331 CB PHE A 24 15.328 1.160 13.349 1.00 0.00 C ATOM 332 CG PHE A 24 14.014 1.084 14.113 1.00 0.00 C ATOM 333 CD1 PHE A 24 12.977 0.238 13.672 1.00 0.00 C ATOM 334 CD2 PHE A 24 13.796 1.913 15.231 1.00 0.00 C ATOM 335 CE1 PHE A 24 11.722 0.270 14.299 1.00 0.00 C ATOM 336 CE2 PHE A 24 12.537 1.948 15.854 1.00 0.00 C ATOM 337 CZ PHE A 24 11.492 1.145 15.370 1.00 0.00 C ATOM 0 H PHE A 24 14.502 -0.037 11.384 1.00 0.00 H new ATOM 0 HA PHE A 24 14.630 2.747 12.145 1.00 0.00 H new ATOM 0 HB2 PHE A 24 15.726 0.153 13.221 1.00 0.00 H new ATOM 0 HB3 PHE A 24 16.054 1.717 13.941 1.00 0.00 H new ATOM 0 HD1 PHE A 24 13.149 -0.438 12.848 1.00 0.00 H new ATOM 0 HD2 PHE A 24 14.601 2.525 15.611 1.00 0.00 H new ATOM 0 HE1 PHE A 24 10.931 -0.381 13.956 1.00 0.00 H new ATOM 0 HE2 PHE A 24 12.373 2.592 16.705 1.00 0.00 H new ATOM 0 HZ PHE A 24 10.513 1.201 15.822 1.00 0.00 H new ATOM 347 N TRP A 25 16.692 3.414 10.942 1.00 0.00 N ATOM 348 CA TRP A 25 17.818 3.902 10.165 1.00 0.00 C ATOM 349 C TRP A 25 18.079 5.362 10.553 1.00 0.00 C ATOM 350 O TRP A 25 17.441 5.874 11.470 1.00 0.00 O ATOM 351 CB TRP A 25 17.538 3.679 8.657 1.00 0.00 C ATOM 352 CG TRP A 25 17.403 4.879 7.762 1.00 0.00 C ATOM 353 CD1 TRP A 25 18.323 5.296 6.863 1.00 0.00 C ATOM 354 CD2 TRP A 25 16.354 5.897 7.741 1.00 0.00 C ATOM 355 NE1 TRP A 25 17.878 6.442 6.240 1.00 0.00 N ATOM 356 CE2 TRP A 25 16.714 6.905 6.799 1.00 0.00 C ATOM 357 CE3 TRP A 25 15.164 6.103 8.463 1.00 0.00 C ATOM 358 CZ2 TRP A 25 15.954 8.067 6.605 1.00 0.00 C ATOM 359 CZ3 TRP A 25 14.388 7.264 8.278 1.00 0.00 C ATOM 360 CH2 TRP A 25 14.789 8.252 7.361 1.00 0.00 C ATOM 0 H TRP A 25 16.024 4.148 11.178 1.00 0.00 H new ATOM 0 HA TRP A 25 18.734 3.351 10.381 1.00 0.00 H new ATOM 0 HB2 TRP A 25 18.342 3.059 8.260 1.00 0.00 H new ATOM 0 HB3 TRP A 25 16.618 3.100 8.574 1.00 0.00 H new ATOM 0 HD1 TRP A 25 19.264 4.805 6.663 1.00 0.00 H new ATOM 0 HE1 TRP A 25 18.356 6.891 5.459 1.00 0.00 H new ATOM 0 HE3 TRP A 25 14.839 5.357 9.173 1.00 0.00 H new ATOM 0 HZ2 TRP A 25 16.262 8.809 5.883 1.00 0.00 H new ATOM 0 HZ3 TRP A 25 13.478 7.396 8.845 1.00 0.00 H new ATOM 0 HH2 TRP A 25 14.201 9.150 7.240 1.00 0.00 H new ATOM 371 N ALA A 26 19.023 6.031 9.892 1.00 0.00 N ATOM 372 CA ALA A 26 19.208 7.473 9.952 1.00 0.00 C ATOM 373 C ALA A 26 19.831 7.865 8.611 1.00 0.00 C ATOM 374 O ALA A 26 20.613 7.077 8.075 1.00 0.00 O ATOM 375 CB ALA A 26 20.132 7.853 11.115 1.00 0.00 C ATOM 0 H ALA A 26 19.698 5.567 9.283 1.00 0.00 H new ATOM 0 HA ALA A 26 18.265 7.993 10.122 1.00 0.00 H new ATOM 0 HB1 ALA A 26 20.257 8.935 11.142 1.00 0.00 H new ATOM 0 HB2 ALA A 26 19.693 7.515 12.054 1.00 0.00 H new ATOM 0 HB3 ALA A 26 21.104 7.379 10.977 1.00 0.00 H new ATOM 381 N PRO A 27 19.571 9.053 8.048 1.00 0.00 N ATOM 382 CA PRO A 27 20.146 9.426 6.759 1.00 0.00 C ATOM 383 C PRO A 27 21.669 9.608 6.809 1.00 0.00 C ATOM 384 O PRO A 27 22.310 9.630 5.760 1.00 0.00 O ATOM 385 CB PRO A 27 19.403 10.684 6.318 1.00 0.00 C ATOM 386 CG PRO A 27 18.901 11.294 7.630 1.00 0.00 C ATOM 387 CD PRO A 27 18.675 10.086 8.541 1.00 0.00 C ATOM 0 HA PRO A 27 20.016 8.626 6.030 1.00 0.00 H new ATOM 0 HB2 PRO A 27 20.061 11.370 5.784 1.00 0.00 H new ATOM 0 HB3 PRO A 27 18.578 10.446 5.647 1.00 0.00 H new ATOM 0 HG2 PRO A 27 19.632 11.982 8.055 1.00 0.00 H new ATOM 0 HG3 PRO A 27 17.981 11.858 7.481 1.00 0.00 H new ATOM 0 HD2 PRO A 27 18.894 10.332 9.580 1.00 0.00 H new ATOM 0 HD3 PRO A 27 17.637 9.755 8.504 1.00 0.00 H new ATOM 395 N TRP A 28 22.271 9.681 7.999 1.00 0.00 N ATOM 396 CA TRP A 28 23.720 9.707 8.177 1.00 0.00 C ATOM 397 C TRP A 28 24.348 8.310 7.991 1.00 0.00 C ATOM 398 O TRP A 28 25.572 8.195 7.896 1.00 0.00 O ATOM 399 CB TRP A 28 24.071 10.298 9.552 1.00 0.00 C ATOM 400 CG TRP A 28 23.015 11.187 10.139 1.00 0.00 C ATOM 401 CD1 TRP A 28 22.208 10.825 11.153 1.00 0.00 C ATOM 402 CD2 TRP A 28 22.535 12.496 9.700 1.00 0.00 C ATOM 403 NE1 TRP A 28 21.253 11.793 11.371 1.00 0.00 N ATOM 404 CE2 TRP A 28 21.405 12.852 10.500 1.00 0.00 C ATOM 405 CE3 TRP A 28 22.913 13.401 8.685 1.00 0.00 C ATOM 406 CZ2 TRP A 28 20.697 14.048 10.305 1.00 0.00 C ATOM 407 CZ3 TRP A 28 22.210 14.605 8.484 1.00 0.00 C ATOM 408 CH2 TRP A 28 21.105 14.930 9.291 1.00 0.00 C ATOM 0 H TRP A 28 21.755 9.724 8.878 1.00 0.00 H new ATOM 0 HA TRP A 28 24.144 10.347 7.403 1.00 0.00 H new ATOM 0 HB2 TRP A 28 24.265 9.480 10.246 1.00 0.00 H new ATOM 0 HB3 TRP A 28 24.997 10.866 9.463 1.00 0.00 H new ATOM 0 HD1 TRP A 28 22.296 9.907 11.715 1.00 0.00 H new ATOM 0 HE1 TRP A 28 20.527 11.734 12.085 1.00 0.00 H new ATOM 0 HE3 TRP A 28 23.756 13.166 8.052 1.00 0.00 H new ATOM 0 HZ2 TRP A 28 19.848 14.287 10.928 1.00 0.00 H new ATOM 0 HZ3 TRP A 28 22.522 15.284 7.704 1.00 0.00 H new ATOM 0 HH2 TRP A 28 20.572 15.855 9.131 1.00 0.00 H new ATOM 419 N CYS A 29 23.525 7.254 7.979 1.00 0.00 N ATOM 420 CA CYS A 29 23.941 5.861 7.879 1.00 0.00 C ATOM 421 C CYS A 29 24.630 5.586 6.536 1.00 0.00 C ATOM 422 O CYS A 29 24.317 6.229 5.528 1.00 0.00 O ATOM 423 CB CYS A 29 22.699 4.973 8.031 1.00 0.00 C ATOM 424 SG CYS A 29 22.991 3.197 8.215 1.00 0.00 S ATOM 0 H CYS A 29 22.512 7.357 8.041 1.00 0.00 H new ATOM 0 HA CYS A 29 24.661 5.640 8.667 1.00 0.00 H new ATOM 0 HB2 CYS A 29 22.138 5.318 8.899 1.00 0.00 H new ATOM 0 HB3 CYS A 29 22.063 5.125 7.159 1.00 0.00 H new ATOM 429 N GLY A 30 25.498 4.571 6.507 1.00 0.00 N ATOM 430 CA GLY A 30 26.124 4.058 5.290 1.00 0.00 C ATOM 431 C GLY A 30 25.487 2.730 4.876 1.00 0.00 C ATOM 432 O GLY A 30 24.801 2.705 3.856 1.00 0.00 O ATOM 0 H GLY A 30 25.790 4.074 7.348 1.00 0.00 H new ATOM 0 HA2 GLY A 30 26.017 4.785 4.485 1.00 0.00 H new ATOM 0 HA3 GLY A 30 27.193 3.919 5.455 1.00 0.00 H new ATOM 436 N PRO A 31 25.617 1.640 5.661 1.00 0.00 N ATOM 437 CA PRO A 31 25.038 0.334 5.331 1.00 0.00 C ATOM 438 C PRO A 31 23.536 0.360 5.024 1.00 0.00 C ATOM 439 O PRO A 31 23.072 -0.395 4.171 1.00 0.00 O ATOM 440 CB PRO A 31 25.355 -0.568 6.528 1.00 0.00 C ATOM 441 CG PRO A 31 26.647 0.030 7.079 1.00 0.00 C ATOM 442 CD PRO A 31 26.458 1.528 6.847 1.00 0.00 C ATOM 0 HA PRO A 31 25.473 -0.034 4.402 1.00 0.00 H new ATOM 0 HB2 PRO A 31 24.555 -0.551 7.268 1.00 0.00 H new ATOM 0 HB3 PRO A 31 25.488 -1.607 6.226 1.00 0.00 H new ATOM 0 HG2 PRO A 31 26.780 -0.201 8.136 1.00 0.00 H new ATOM 0 HG3 PRO A 31 27.524 -0.352 6.556 1.00 0.00 H new ATOM 0 HD2 PRO A 31 25.986 2.001 7.708 1.00 0.00 H new ATOM 0 HD3 PRO A 31 27.416 2.025 6.696 1.00 0.00 H new ATOM 450 N CYS A 32 22.771 1.259 5.655 1.00 0.00 N ATOM 451 CA CYS A 32 21.343 1.423 5.387 1.00 0.00 C ATOM 452 C CYS A 32 21.076 1.750 3.912 1.00 0.00 C ATOM 453 O CYS A 32 20.082 1.307 3.341 1.00 0.00 O ATOM 454 CB CYS A 32 20.758 2.536 6.263 1.00 0.00 C ATOM 455 SG CYS A 32 21.108 2.453 8.045 1.00 0.00 S ATOM 0 H CYS A 32 23.130 1.894 6.368 1.00 0.00 H new ATOM 0 HA CYS A 32 20.861 0.475 5.624 1.00 0.00 H new ATOM 0 HB2 CYS A 32 21.128 3.491 5.889 1.00 0.00 H new ATOM 0 HB3 CYS A 32 19.676 2.539 6.130 1.00 0.00 H new ATOM 460 N LYS A 33 21.976 2.500 3.267 1.00 0.00 N ATOM 461 CA LYS A 33 21.841 2.880 1.867 1.00 0.00 C ATOM 462 C LYS A 33 21.975 1.662 0.951 1.00 0.00 C ATOM 463 O LYS A 33 21.462 1.699 -0.166 1.00 0.00 O ATOM 464 CB LYS A 33 22.879 3.959 1.499 1.00 0.00 C ATOM 465 CG LYS A 33 22.943 5.163 2.462 1.00 0.00 C ATOM 466 CD LYS A 33 21.676 6.039 2.471 1.00 0.00 C ATOM 467 CE LYS A 33 21.666 7.071 3.615 1.00 0.00 C ATOM 468 NZ LYS A 33 22.914 7.869 3.693 1.00 0.00 N ATOM 0 H LYS A 33 22.822 2.860 3.709 1.00 0.00 H new ATOM 0 HA LYS A 33 20.844 3.297 1.723 1.00 0.00 H new ATOM 0 HB2 LYS A 33 23.864 3.494 1.458 1.00 0.00 H new ATOM 0 HB3 LYS A 33 22.658 4.327 0.497 1.00 0.00 H new ATOM 0 HG2 LYS A 33 23.123 4.795 3.472 1.00 0.00 H new ATOM 0 HG3 LYS A 33 23.797 5.784 2.192 1.00 0.00 H new ATOM 0 HD2 LYS A 33 21.595 6.561 1.518 1.00 0.00 H new ATOM 0 HD3 LYS A 33 20.799 5.398 2.559 1.00 0.00 H new ATOM 0 HE2 LYS A 33 20.820 7.744 3.481 1.00 0.00 H new ATOM 0 HE3 LYS A 33 21.514 6.553 4.562 1.00 0.00 H new ATOM 0 HZ1 LYS A 33 22.748 8.718 4.271 1.00 0.00 H new ATOM 0 HZ2 LYS A 33 23.666 7.296 4.127 1.00 0.00 H new ATOM 0 HZ3 LYS A 33 23.205 8.153 2.736 1.00 0.00 H new ATOM 482 N MET A 34 22.631 0.585 1.402 1.00 0.00 N ATOM 483 CA MET A 34 22.740 -0.652 0.641 1.00 0.00 C ATOM 484 C MET A 34 21.391 -1.364 0.589 1.00 0.00 C ATOM 485 O MET A 34 21.002 -1.854 -0.468 1.00 0.00 O ATOM 486 CB MET A 34 23.794 -1.599 1.239 1.00 0.00 C ATOM 487 CG MET A 34 25.175 -0.957 1.424 1.00 0.00 C ATOM 488 SD MET A 34 26.499 -2.102 1.921 1.00 0.00 S ATOM 489 CE MET A 34 25.719 -2.990 3.302 1.00 0.00 C ATOM 0 H MET A 34 23.100 0.554 2.307 1.00 0.00 H new ATOM 0 HA MET A 34 23.054 -0.384 -0.368 1.00 0.00 H new ATOM 0 HB2 MET A 34 23.439 -1.958 2.205 1.00 0.00 H new ATOM 0 HB3 MET A 34 23.893 -2.471 0.592 1.00 0.00 H new ATOM 0 HG2 MET A 34 25.463 -0.477 0.489 1.00 0.00 H new ATOM 0 HG3 MET A 34 25.095 -0.171 2.175 1.00 0.00 H new ATOM 0 HE1 MET A 34 26.490 -3.450 3.920 1.00 0.00 H new ATOM 0 HE2 MET A 34 25.140 -2.290 3.904 1.00 0.00 H new ATOM 0 HE3 MET A 34 25.058 -3.764 2.910 1.00 0.00 H new ATOM 499 N ILE A 35 20.673 -1.431 1.720 1.00 0.00 N ATOM 500 CA ILE A 35 19.406 -2.151 1.813 1.00 0.00 C ATOM 501 C ILE A 35 18.227 -1.293 1.323 1.00 0.00 C ATOM 502 O ILE A 35 17.224 -1.856 0.900 1.00 0.00 O ATOM 503 CB ILE A 35 19.211 -2.765 3.224 1.00 0.00 C ATOM 504 CG1 ILE A 35 18.045 -3.782 3.234 1.00 0.00 C ATOM 505 CG2 ILE A 35 19.055 -1.690 4.308 1.00 0.00 C ATOM 506 CD1 ILE A 35 17.884 -4.557 4.545 1.00 0.00 C ATOM 0 H ILE A 35 20.959 -0.986 2.592 1.00 0.00 H new ATOM 0 HA ILE A 35 19.438 -3.000 1.130 1.00 0.00 H new ATOM 0 HB ILE A 35 20.121 -3.313 3.470 1.00 0.00 H new ATOM 0 HG12 ILE A 35 17.116 -3.251 3.025 1.00 0.00 H new ATOM 0 HG13 ILE A 35 18.195 -4.494 2.423 1.00 0.00 H new ATOM 0 HG21 ILE A 35 18.921 -2.168 5.278 1.00 0.00 H new ATOM 0 HG22 ILE A 35 19.948 -1.065 4.332 1.00 0.00 H new ATOM 0 HG23 ILE A 35 18.185 -1.072 4.085 1.00 0.00 H new ATOM 0 HD11 ILE A 35 17.043 -5.245 4.460 1.00 0.00 H new ATOM 0 HD12 ILE A 35 18.795 -5.120 4.749 1.00 0.00 H new ATOM 0 HD13 ILE A 35 17.699 -3.858 5.361 1.00 0.00 H new ATOM 518 N ALA A 36 18.328 0.042 1.314 1.00 0.00 N ATOM 519 CA ALA A 36 17.262 0.926 0.831 1.00 0.00 C ATOM 520 C ALA A 36 16.691 0.528 -0.551 1.00 0.00 C ATOM 521 O ALA A 36 15.474 0.347 -0.645 1.00 0.00 O ATOM 522 CB ALA A 36 17.734 2.385 0.872 1.00 0.00 C ATOM 0 H ALA A 36 19.155 0.540 1.643 1.00 0.00 H new ATOM 0 HA ALA A 36 16.419 0.810 1.512 1.00 0.00 H new ATOM 0 HB1 ALA A 36 16.937 3.036 0.512 1.00 0.00 H new ATOM 0 HB2 ALA A 36 17.989 2.656 1.896 1.00 0.00 H new ATOM 0 HB3 ALA A 36 18.612 2.501 0.237 1.00 0.00 H new ATOM 528 N PRO A 37 17.493 0.309 -1.616 1.00 0.00 N ATOM 529 CA PRO A 37 16.951 -0.136 -2.898 1.00 0.00 C ATOM 530 C PRO A 37 16.386 -1.560 -2.830 1.00 0.00 C ATOM 531 O PRO A 37 15.497 -1.902 -3.605 1.00 0.00 O ATOM 532 CB PRO A 37 18.099 -0.022 -3.907 1.00 0.00 C ATOM 533 CG PRO A 37 19.350 -0.130 -3.039 1.00 0.00 C ATOM 534 CD PRO A 37 18.922 0.553 -1.743 1.00 0.00 C ATOM 0 HA PRO A 37 16.104 0.483 -3.195 1.00 0.00 H new ATOM 0 HB2 PRO A 37 18.058 -0.816 -4.652 1.00 0.00 H new ATOM 0 HB3 PRO A 37 18.066 0.924 -4.447 1.00 0.00 H new ATOM 0 HG2 PRO A 37 19.639 -1.168 -2.873 1.00 0.00 H new ATOM 0 HG3 PRO A 37 20.204 0.369 -3.496 1.00 0.00 H new ATOM 0 HD2 PRO A 37 19.465 0.147 -0.890 1.00 0.00 H new ATOM 0 HD3 PRO A 37 19.134 1.622 -1.776 1.00 0.00 H new ATOM 542 N VAL A 38 16.860 -2.392 -1.903 1.00 0.00 N ATOM 543 CA VAL A 38 16.326 -3.727 -1.686 1.00 0.00 C ATOM 544 C VAL A 38 14.944 -3.628 -1.022 1.00 0.00 C ATOM 545 O VAL A 38 14.061 -4.413 -1.351 1.00 0.00 O ATOM 546 CB VAL A 38 17.313 -4.587 -0.870 1.00 0.00 C ATOM 547 CG1 VAL A 38 16.943 -6.070 -0.962 1.00 0.00 C ATOM 548 CG2 VAL A 38 18.762 -4.464 -1.371 1.00 0.00 C ATOM 0 H VAL A 38 17.631 -2.152 -1.280 1.00 0.00 H new ATOM 0 HA VAL A 38 16.199 -4.229 -2.645 1.00 0.00 H new ATOM 0 HB VAL A 38 17.245 -4.217 0.153 1.00 0.00 H new ATOM 0 HG11 VAL A 38 17.652 -6.659 -0.380 1.00 0.00 H new ATOM 0 HG12 VAL A 38 15.938 -6.219 -0.568 1.00 0.00 H new ATOM 0 HG13 VAL A 38 16.976 -6.389 -2.004 1.00 0.00 H new ATOM 0 HG21 VAL A 38 19.412 -5.090 -0.760 1.00 0.00 H new ATOM 0 HG22 VAL A 38 18.817 -4.789 -2.410 1.00 0.00 H new ATOM 0 HG23 VAL A 38 19.085 -3.426 -1.298 1.00 0.00 H new ATOM 558 N LEU A 39 14.710 -2.651 -0.138 1.00 0.00 N ATOM 559 CA LEU A 39 13.380 -2.367 0.393 1.00 0.00 C ATOM 560 C LEU A 39 12.463 -1.812 -0.694 1.00 0.00 C ATOM 561 O LEU A 39 11.283 -2.149 -0.712 1.00 0.00 O ATOM 562 CB LEU A 39 13.449 -1.400 1.585 1.00 0.00 C ATOM 563 CG LEU A 39 14.078 -2.047 2.832 1.00 0.00 C ATOM 564 CD1 LEU A 39 14.441 -0.968 3.854 1.00 0.00 C ATOM 565 CD2 LEU A 39 13.147 -3.078 3.488 1.00 0.00 C ATOM 0 H LEU A 39 15.439 -2.038 0.226 1.00 0.00 H new ATOM 0 HA LEU A 39 12.961 -3.309 0.747 1.00 0.00 H new ATOM 0 HB2 LEU A 39 14.030 -0.522 1.303 1.00 0.00 H new ATOM 0 HB3 LEU A 39 12.444 -1.054 1.827 1.00 0.00 H new ATOM 0 HG LEU A 39 14.975 -2.572 2.503 1.00 0.00 H new ATOM 0 HD11 LEU A 39 14.885 -1.434 4.733 1.00 0.00 H new ATOM 0 HD12 LEU A 39 15.155 -0.273 3.412 1.00 0.00 H new ATOM 0 HD13 LEU A 39 13.541 -0.426 4.146 1.00 0.00 H new ATOM 0 HD21 LEU A 39 13.637 -3.506 4.363 1.00 0.00 H new ATOM 0 HD22 LEU A 39 12.221 -2.590 3.792 1.00 0.00 H new ATOM 0 HD23 LEU A 39 12.922 -3.871 2.775 1.00 0.00 H new ATOM 577 N GLU A 40 12.976 -1.004 -1.625 1.00 0.00 N ATOM 578 CA GLU A 40 12.195 -0.604 -2.796 1.00 0.00 C ATOM 579 C GLU A 40 11.827 -1.825 -3.649 1.00 0.00 C ATOM 580 O GLU A 40 10.691 -1.945 -4.117 1.00 0.00 O ATOM 581 CB GLU A 40 12.918 0.469 -3.625 1.00 0.00 C ATOM 582 CG GLU A 40 12.984 1.817 -2.894 1.00 0.00 C ATOM 583 CD GLU A 40 13.641 2.901 -3.765 1.00 0.00 C ATOM 584 OE1 GLU A 40 12.936 3.547 -4.575 1.00 0.00 O ATOM 585 OE2 GLU A 40 14.864 3.139 -3.640 1.00 0.00 O ATOM 0 H GLU A 40 13.919 -0.618 -1.591 1.00 0.00 H new ATOM 0 HA GLU A 40 11.269 -0.154 -2.438 1.00 0.00 H new ATOM 0 HB2 GLU A 40 13.929 0.131 -3.852 1.00 0.00 H new ATOM 0 HB3 GLU A 40 12.404 0.598 -4.577 1.00 0.00 H new ATOM 0 HG2 GLU A 40 11.978 2.132 -2.618 1.00 0.00 H new ATOM 0 HG3 GLU A 40 13.547 1.702 -1.968 1.00 0.00 H new ATOM 592 N GLU A 41 12.754 -2.760 -3.842 1.00 0.00 N ATOM 593 CA GLU A 41 12.466 -4.011 -4.530 1.00 0.00 C ATOM 594 C GLU A 41 11.411 -4.808 -3.761 1.00 0.00 C ATOM 595 O GLU A 41 10.482 -5.326 -4.370 1.00 0.00 O ATOM 596 CB GLU A 41 13.743 -4.838 -4.730 1.00 0.00 C ATOM 597 CG GLU A 41 14.609 -4.357 -5.900 1.00 0.00 C ATOM 598 CD GLU A 41 14.025 -4.786 -7.257 1.00 0.00 C ATOM 599 OE1 GLU A 41 14.200 -5.967 -7.635 1.00 0.00 O ATOM 600 OE2 GLU A 41 13.415 -3.948 -7.959 1.00 0.00 O ATOM 0 H GLU A 41 13.720 -2.671 -3.527 1.00 0.00 H new ATOM 0 HA GLU A 41 12.068 -3.776 -5.517 1.00 0.00 H new ATOM 0 HB2 GLU A 41 14.334 -4.806 -3.814 1.00 0.00 H new ATOM 0 HB3 GLU A 41 13.469 -5.880 -4.896 1.00 0.00 H new ATOM 0 HG2 GLU A 41 14.693 -3.271 -5.868 1.00 0.00 H new ATOM 0 HG3 GLU A 41 15.617 -4.758 -5.795 1.00 0.00 H new ATOM 607 N LEU A 42 11.510 -4.868 -2.433 1.00 0.00 N ATOM 608 CA LEU A 42 10.559 -5.566 -1.575 1.00 0.00 C ATOM 609 C LEU A 42 9.162 -4.953 -1.707 1.00 0.00 C ATOM 610 O LEU A 42 8.171 -5.682 -1.784 1.00 0.00 O ATOM 611 CB LEU A 42 11.047 -5.518 -0.117 1.00 0.00 C ATOM 612 CG LEU A 42 10.164 -6.310 0.860 1.00 0.00 C ATOM 613 CD1 LEU A 42 10.207 -7.814 0.577 1.00 0.00 C ATOM 614 CD2 LEU A 42 10.639 -6.037 2.287 1.00 0.00 C ATOM 0 H LEU A 42 12.269 -4.424 -1.916 1.00 0.00 H new ATOM 0 HA LEU A 42 10.494 -6.608 -1.888 1.00 0.00 H new ATOM 0 HB2 LEU A 42 12.064 -5.908 -0.071 1.00 0.00 H new ATOM 0 HB3 LEU A 42 11.090 -4.478 0.208 1.00 0.00 H new ATOM 0 HG LEU A 42 9.132 -5.984 0.732 1.00 0.00 H new ATOM 0 HD11 LEU A 42 9.569 -8.337 1.290 1.00 0.00 H new ATOM 0 HD12 LEU A 42 9.851 -8.004 -0.436 1.00 0.00 H new ATOM 0 HD13 LEU A 42 11.231 -8.173 0.675 1.00 0.00 H new ATOM 0 HD21 LEU A 42 10.019 -6.594 2.990 1.00 0.00 H new ATOM 0 HD22 LEU A 42 11.678 -6.351 2.391 1.00 0.00 H new ATOM 0 HD23 LEU A 42 10.559 -4.971 2.499 1.00 0.00 H new ATOM 626 N ASP A 43 9.076 -3.624 -1.779 1.00 0.00 N ATOM 627 CA ASP A 43 7.823 -2.919 -2.021 1.00 0.00 C ATOM 628 C ASP A 43 7.231 -3.314 -3.367 1.00 0.00 C ATOM 629 O ASP A 43 6.032 -3.555 -3.487 1.00 0.00 O ATOM 630 CB ASP A 43 8.034 -1.404 -2.007 1.00 0.00 C ATOM 631 CG ASP A 43 6.677 -0.694 -2.086 1.00 0.00 C ATOM 632 OD1 ASP A 43 5.895 -0.811 -1.120 1.00 0.00 O ATOM 633 OD2 ASP A 43 6.406 -0.008 -3.098 1.00 0.00 O ATOM 0 H ASP A 43 9.880 -3.006 -1.670 1.00 0.00 H new ATOM 0 HA ASP A 43 7.137 -3.198 -1.222 1.00 0.00 H new ATOM 0 HB2 ASP A 43 8.558 -1.108 -1.098 1.00 0.00 H new ATOM 0 HB3 ASP A 43 8.661 -1.106 -2.848 1.00 0.00 H new ATOM 638 N GLN A 44 8.083 -3.432 -4.382 1.00 0.00 N ATOM 639 CA GLN A 44 7.672 -3.827 -5.720 1.00 0.00 C ATOM 640 C GLN A 44 7.376 -5.337 -5.821 1.00 0.00 C ATOM 641 O GLN A 44 6.800 -5.775 -6.819 1.00 0.00 O ATOM 642 CB GLN A 44 8.732 -3.353 -6.724 1.00 0.00 C ATOM 643 CG GLN A 44 8.765 -1.814 -6.795 1.00 0.00 C ATOM 644 CD GLN A 44 9.991 -1.324 -7.561 1.00 0.00 C ATOM 645 OE1 GLN A 44 9.948 -1.077 -8.764 1.00 0.00 O ATOM 646 NE2 GLN A 44 11.110 -1.181 -6.873 1.00 0.00 N ATOM 0 H GLN A 44 9.084 -3.254 -4.295 1.00 0.00 H new ATOM 0 HA GLN A 44 6.726 -3.344 -5.963 1.00 0.00 H new ATOM 0 HB2 GLN A 44 9.712 -3.730 -6.431 1.00 0.00 H new ATOM 0 HB3 GLN A 44 8.515 -3.763 -7.710 1.00 0.00 H new ATOM 0 HG2 GLN A 44 7.860 -1.450 -7.281 1.00 0.00 H new ATOM 0 HG3 GLN A 44 8.774 -1.401 -5.786 1.00 0.00 H new ATOM 0 HE21 GLN A 44 11.125 -1.391 -5.875 1.00 0.00 H new ATOM 0 HE22 GLN A 44 11.958 -0.860 -7.340 1.00 0.00 H new ATOM 655 N GLU A 45 7.727 -6.134 -4.806 1.00 0.00 N ATOM 656 CA GLU A 45 7.476 -7.568 -4.746 1.00 0.00 C ATOM 657 C GLU A 45 6.138 -7.826 -4.060 1.00 0.00 C ATOM 658 O GLU A 45 5.307 -8.544 -4.618 1.00 0.00 O ATOM 659 CB GLU A 45 8.633 -8.284 -4.026 1.00 0.00 C ATOM 660 CG GLU A 45 9.898 -8.414 -4.891 1.00 0.00 C ATOM 661 CD GLU A 45 9.909 -9.669 -5.784 1.00 0.00 C ATOM 662 OE1 GLU A 45 9.017 -9.823 -6.649 1.00 0.00 O ATOM 663 OE2 GLU A 45 10.841 -10.498 -5.650 1.00 0.00 O ATOM 0 H GLU A 45 8.209 -5.782 -3.979 1.00 0.00 H new ATOM 0 HA GLU A 45 7.422 -7.972 -5.757 1.00 0.00 H new ATOM 0 HB2 GLU A 45 8.878 -7.738 -3.115 1.00 0.00 H new ATOM 0 HB3 GLU A 45 8.304 -9.278 -3.723 1.00 0.00 H new ATOM 0 HG2 GLU A 45 9.989 -7.529 -5.521 1.00 0.00 H new ATOM 0 HG3 GLU A 45 10.772 -8.434 -4.240 1.00 0.00 H new ATOM 670 N MET A 46 5.906 -7.232 -2.880 1.00 0.00 N ATOM 671 CA MET A 46 4.748 -7.561 -2.046 1.00 0.00 C ATOM 672 C MET A 46 4.120 -6.341 -1.379 1.00 0.00 C ATOM 673 O MET A 46 3.399 -6.507 -0.401 1.00 0.00 O ATOM 674 CB MET A 46 5.114 -8.609 -0.982 1.00 0.00 C ATOM 675 CG MET A 46 5.813 -9.837 -1.576 1.00 0.00 C ATOM 676 SD MET A 46 5.886 -11.306 -0.517 1.00 0.00 S ATOM 677 CE MET A 46 6.483 -10.526 0.994 1.00 0.00 C ATOM 0 H MET A 46 6.513 -6.515 -2.482 1.00 0.00 H new ATOM 0 HA MET A 46 4.001 -7.976 -2.723 1.00 0.00 H new ATOM 0 HB2 MET A 46 5.764 -8.152 -0.236 1.00 0.00 H new ATOM 0 HB3 MET A 46 4.209 -8.926 -0.464 1.00 0.00 H new ATOM 0 HG2 MET A 46 5.304 -10.107 -2.501 1.00 0.00 H new ATOM 0 HG3 MET A 46 6.832 -9.556 -1.843 1.00 0.00 H new ATOM 0 HE1 MET A 46 6.877 -11.289 1.666 1.00 0.00 H new ATOM 0 HE2 MET A 46 7.272 -9.815 0.749 1.00 0.00 H new ATOM 0 HE3 MET A 46 5.661 -10.002 1.482 1.00 0.00 H new ATOM 687 N GLY A 47 4.326 -5.122 -1.880 1.00 0.00 N ATOM 688 CA GLY A 47 3.658 -3.919 -1.370 1.00 0.00 C ATOM 689 C GLY A 47 2.122 -3.988 -1.378 1.00 0.00 C ATOM 690 O GLY A 47 1.466 -3.154 -0.760 1.00 0.00 O ATOM 0 H GLY A 47 4.964 -4.938 -2.655 1.00 0.00 H new ATOM 0 HA2 GLY A 47 3.995 -3.737 -0.350 1.00 0.00 H new ATOM 0 HA3 GLY A 47 3.973 -3.063 -1.967 1.00 0.00 H new ATOM 694 N ASP A 48 1.529 -4.982 -2.041 1.00 0.00 N ATOM 695 CA ASP A 48 0.097 -5.273 -1.986 1.00 0.00 C ATOM 696 C ASP A 48 -0.306 -5.894 -0.639 1.00 0.00 C ATOM 697 O ASP A 48 -1.430 -5.704 -0.173 1.00 0.00 O ATOM 698 CB ASP A 48 -0.280 -6.227 -3.124 1.00 0.00 C ATOM 699 CG ASP A 48 -1.782 -6.555 -3.110 1.00 0.00 C ATOM 700 OD1 ASP A 48 -2.603 -5.662 -3.422 1.00 0.00 O ATOM 701 OD2 ASP A 48 -2.149 -7.717 -2.830 1.00 0.00 O ATOM 0 H ASP A 48 2.044 -5.622 -2.645 1.00 0.00 H new ATOM 0 HA ASP A 48 -0.439 -4.330 -2.095 1.00 0.00 H new ATOM 0 HB2 ASP A 48 -0.014 -5.777 -4.080 1.00 0.00 H new ATOM 0 HB3 ASP A 48 0.296 -7.148 -3.034 1.00 0.00 H new ATOM 706 N LYS A 49 0.625 -6.607 0.006 1.00 0.00 N ATOM 707 CA LYS A 49 0.449 -7.287 1.290 1.00 0.00 C ATOM 708 C LYS A 49 1.204 -6.567 2.408 1.00 0.00 C ATOM 709 O LYS A 49 0.827 -6.700 3.572 1.00 0.00 O ATOM 710 CB LYS A 49 0.988 -8.731 1.190 1.00 0.00 C ATOM 711 CG LYS A 49 0.336 -9.605 0.102 1.00 0.00 C ATOM 712 CD LYS A 49 -1.192 -9.753 0.211 1.00 0.00 C ATOM 713 CE LYS A 49 -1.622 -10.394 1.540 1.00 0.00 C ATOM 714 NZ LYS A 49 -3.092 -10.594 1.615 1.00 0.00 N ATOM 0 H LYS A 49 1.564 -6.730 -0.373 1.00 0.00 H new ATOM 0 HA LYS A 49 -0.616 -7.288 1.523 1.00 0.00 H new ATOM 0 HB2 LYS A 49 2.061 -8.688 1.003 1.00 0.00 H new ATOM 0 HB3 LYS A 49 0.852 -9.219 2.155 1.00 0.00 H new ATOM 0 HG2 LYS A 49 0.576 -9.182 -0.874 1.00 0.00 H new ATOM 0 HG3 LYS A 49 0.785 -10.598 0.138 1.00 0.00 H new ATOM 0 HD2 LYS A 49 -1.658 -8.772 0.116 1.00 0.00 H new ATOM 0 HD3 LYS A 49 -1.556 -10.360 -0.618 1.00 0.00 H new ATOM 0 HE2 LYS A 49 -1.120 -11.354 1.658 1.00 0.00 H new ATOM 0 HE3 LYS A 49 -1.300 -9.762 2.368 1.00 0.00 H new ATOM 0 HZ1 LYS A 49 -3.337 -11.028 2.528 1.00 0.00 H new ATOM 0 HZ2 LYS A 49 -3.572 -9.676 1.529 1.00 0.00 H new ATOM 0 HZ3 LYS A 49 -3.397 -11.218 0.841 1.00 0.00 H new ATOM 728 N LEU A 50 2.257 -5.822 2.068 1.00 0.00 N ATOM 729 CA LEU A 50 3.216 -5.269 3.014 1.00 0.00 C ATOM 730 C LEU A 50 3.156 -3.741 3.037 1.00 0.00 C ATOM 731 O LEU A 50 2.746 -3.102 2.068 1.00 0.00 O ATOM 732 CB LEU A 50 4.614 -5.770 2.584 1.00 0.00 C ATOM 733 CG LEU A 50 5.784 -5.381 3.508 1.00 0.00 C ATOM 734 CD1 LEU A 50 5.603 -5.927 4.929 1.00 0.00 C ATOM 735 CD2 LEU A 50 7.089 -5.899 2.907 1.00 0.00 C ATOM 0 H LEU A 50 2.468 -5.582 1.099 1.00 0.00 H new ATOM 0 HA LEU A 50 2.987 -5.597 4.028 1.00 0.00 H new ATOM 0 HB2 LEU A 50 4.582 -6.857 2.510 1.00 0.00 H new ATOM 0 HB3 LEU A 50 4.824 -5.388 1.585 1.00 0.00 H new ATOM 0 HG LEU A 50 5.810 -4.294 3.584 1.00 0.00 H new ATOM 0 HD11 LEU A 50 6.451 -5.628 5.544 1.00 0.00 H new ATOM 0 HD12 LEU A 50 4.684 -5.527 5.358 1.00 0.00 H new ATOM 0 HD13 LEU A 50 5.544 -7.015 4.896 1.00 0.00 H new ATOM 0 HD21 LEU A 50 7.922 -5.627 3.556 1.00 0.00 H new ATOM 0 HD22 LEU A 50 7.041 -6.984 2.813 1.00 0.00 H new ATOM 0 HD23 LEU A 50 7.237 -5.456 1.922 1.00 0.00 H new ATOM 747 N LYS A 51 3.614 -3.146 4.137 1.00 0.00 N ATOM 748 CA LYS A 51 3.905 -1.723 4.282 1.00 0.00 C ATOM 749 C LYS A 51 5.321 -1.686 4.844 1.00 0.00 C ATOM 750 O LYS A 51 5.664 -2.539 5.667 1.00 0.00 O ATOM 751 CB LYS A 51 2.890 -1.069 5.239 1.00 0.00 C ATOM 752 CG LYS A 51 3.154 0.435 5.455 1.00 0.00 C ATOM 753 CD LYS A 51 2.400 1.018 6.656 1.00 0.00 C ATOM 754 CE LYS A 51 0.880 1.029 6.466 1.00 0.00 C ATOM 755 NZ LYS A 51 0.225 1.685 7.615 1.00 0.00 N ATOM 0 H LYS A 51 3.801 -3.670 4.992 1.00 0.00 H new ATOM 0 HA LYS A 51 3.830 -1.170 3.346 1.00 0.00 H new ATOM 0 HB2 LYS A 51 1.884 -1.203 4.841 1.00 0.00 H new ATOM 0 HB3 LYS A 51 2.923 -1.581 6.201 1.00 0.00 H new ATOM 0 HG2 LYS A 51 4.223 0.592 5.595 1.00 0.00 H new ATOM 0 HG3 LYS A 51 2.867 0.980 4.556 1.00 0.00 H new ATOM 0 HD2 LYS A 51 2.644 0.439 7.546 1.00 0.00 H new ATOM 0 HD3 LYS A 51 2.745 2.037 6.834 1.00 0.00 H new ATOM 0 HE2 LYS A 51 0.626 1.554 5.545 1.00 0.00 H new ATOM 0 HE3 LYS A 51 0.512 0.008 6.363 1.00 0.00 H new ATOM 0 HZ1 LYS A 51 -0.805 1.686 7.473 1.00 0.00 H new ATOM 0 HZ2 LYS A 51 0.454 1.167 8.487 1.00 0.00 H new ATOM 0 HZ3 LYS A 51 0.564 2.665 7.695 1.00 0.00 H new ATOM 769 N ILE A 52 6.134 -0.718 4.436 1.00 0.00 N ATOM 770 CA ILE A 52 7.496 -0.561 4.934 1.00 0.00 C ATOM 771 C ILE A 52 7.518 0.798 5.631 1.00 0.00 C ATOM 772 O ILE A 52 6.916 1.742 5.125 1.00 0.00 O ATOM 773 CB ILE A 52 8.512 -0.716 3.775 1.00 0.00 C ATOM 774 CG1 ILE A 52 8.401 -2.125 3.138 1.00 0.00 C ATOM 775 CG2 ILE A 52 9.952 -0.444 4.250 1.00 0.00 C ATOM 776 CD1 ILE A 52 9.289 -2.340 1.907 1.00 0.00 C ATOM 0 H ILE A 52 5.865 -0.016 3.746 1.00 0.00 H new ATOM 0 HA ILE A 52 7.793 -1.330 5.648 1.00 0.00 H new ATOM 0 HB ILE A 52 8.268 0.027 3.016 1.00 0.00 H new ATOM 0 HG12 ILE A 52 8.658 -2.871 3.890 1.00 0.00 H new ATOM 0 HG13 ILE A 52 7.363 -2.301 2.856 1.00 0.00 H new ATOM 0 HG21 ILE A 52 10.640 -0.561 3.412 1.00 0.00 H new ATOM 0 HG22 ILE A 52 10.022 0.573 4.637 1.00 0.00 H new ATOM 0 HG23 ILE A 52 10.215 -1.151 5.037 1.00 0.00 H new ATOM 0 HD11 ILE A 52 9.147 -3.352 1.528 1.00 0.00 H new ATOM 0 HD12 ILE A 52 9.019 -1.621 1.133 1.00 0.00 H new ATOM 0 HD13 ILE A 52 10.334 -2.200 2.183 1.00 0.00 H new ATOM 788 N VAL A 53 8.166 0.918 6.790 1.00 0.00 N ATOM 789 CA VAL A 53 8.077 2.125 7.619 1.00 0.00 C ATOM 790 C VAL A 53 9.487 2.535 8.042 1.00 0.00 C ATOM 791 O VAL A 53 10.049 1.977 8.983 1.00 0.00 O ATOM 792 CB VAL A 53 7.103 1.887 8.801 1.00 0.00 C ATOM 793 CG1 VAL A 53 7.044 3.094 9.749 1.00 0.00 C ATOM 794 CG2 VAL A 53 5.670 1.634 8.307 1.00 0.00 C ATOM 0 H VAL A 53 8.763 0.189 7.180 1.00 0.00 H new ATOM 0 HA VAL A 53 7.658 2.961 7.059 1.00 0.00 H new ATOM 0 HB VAL A 53 7.489 1.014 9.327 1.00 0.00 H new ATOM 0 HG11 VAL A 53 6.350 2.884 10.563 1.00 0.00 H new ATOM 0 HG12 VAL A 53 8.036 3.284 10.159 1.00 0.00 H new ATOM 0 HG13 VAL A 53 6.704 3.972 9.200 1.00 0.00 H new ATOM 0 HG21 VAL A 53 5.014 1.471 9.162 1.00 0.00 H new ATOM 0 HG22 VAL A 53 5.322 2.499 7.742 1.00 0.00 H new ATOM 0 HG23 VAL A 53 5.656 0.752 7.666 1.00 0.00 H new ATOM 804 N LYS A 54 10.083 3.505 7.346 1.00 0.00 N ATOM 805 CA LYS A 54 11.367 4.065 7.759 1.00 0.00 C ATOM 806 C LYS A 54 11.132 4.895 9.020 1.00 0.00 C ATOM 807 O LYS A 54 10.128 5.612 9.102 1.00 0.00 O ATOM 808 CB LYS A 54 11.979 4.925 6.639 1.00 0.00 C ATOM 809 CG LYS A 54 12.166 4.136 5.331 1.00 0.00 C ATOM 810 CD LYS A 54 12.965 4.907 4.269 1.00 0.00 C ATOM 811 CE LYS A 54 12.243 6.185 3.811 1.00 0.00 C ATOM 812 NZ LYS A 54 12.977 6.885 2.727 1.00 0.00 N ATOM 0 H LYS A 54 9.697 3.917 6.496 1.00 0.00 H new ATOM 0 HA LYS A 54 12.076 3.263 7.966 1.00 0.00 H new ATOM 0 HB2 LYS A 54 11.336 5.785 6.453 1.00 0.00 H new ATOM 0 HB3 LYS A 54 12.943 5.313 6.968 1.00 0.00 H new ATOM 0 HG2 LYS A 54 12.676 3.198 5.550 1.00 0.00 H new ATOM 0 HG3 LYS A 54 11.187 3.880 4.925 1.00 0.00 H new ATOM 0 HD2 LYS A 54 13.943 5.169 4.673 1.00 0.00 H new ATOM 0 HD3 LYS A 54 13.138 4.262 3.408 1.00 0.00 H new ATOM 0 HE2 LYS A 54 11.242 5.930 3.464 1.00 0.00 H new ATOM 0 HE3 LYS A 54 12.124 6.858 4.660 1.00 0.00 H new ATOM 0 HZ1 LYS A 54 12.454 7.740 2.450 1.00 0.00 H new ATOM 0 HZ2 LYS A 54 13.924 7.152 3.065 1.00 0.00 H new ATOM 0 HZ3 LYS A 54 13.068 6.254 1.906 1.00 0.00 H new ATOM 826 N ILE A 55 12.060 4.851 9.973 1.00 0.00 N ATOM 827 CA ILE A 55 12.020 5.685 11.168 1.00 0.00 C ATOM 828 C ILE A 55 13.458 6.077 11.533 1.00 0.00 C ATOM 829 O ILE A 55 14.351 5.227 11.628 1.00 0.00 O ATOM 830 CB ILE A 55 11.202 4.995 12.290 1.00 0.00 C ATOM 831 CG1 ILE A 55 11.135 5.907 13.535 1.00 0.00 C ATOM 832 CG2 ILE A 55 11.697 3.580 12.643 1.00 0.00 C ATOM 833 CD1 ILE A 55 10.054 5.494 14.542 1.00 0.00 C ATOM 0 H ILE A 55 12.868 4.229 9.936 1.00 0.00 H new ATOM 0 HA ILE A 55 11.485 6.618 10.994 1.00 0.00 H new ATOM 0 HB ILE A 55 10.195 4.849 11.900 1.00 0.00 H new ATOM 0 HG12 ILE A 55 12.105 5.900 14.033 1.00 0.00 H new ATOM 0 HG13 ILE A 55 10.948 6.932 13.214 1.00 0.00 H new ATOM 0 HG21 ILE A 55 11.075 3.164 13.435 1.00 0.00 H new ATOM 0 HG22 ILE A 55 11.636 2.943 11.761 1.00 0.00 H new ATOM 0 HG23 ILE A 55 12.731 3.631 12.983 1.00 0.00 H new ATOM 0 HD11 ILE A 55 10.066 6.179 15.390 1.00 0.00 H new ATOM 0 HD12 ILE A 55 9.076 5.528 14.061 1.00 0.00 H new ATOM 0 HD13 ILE A 55 10.251 4.481 14.892 1.00 0.00 H new ATOM 845 N ASP A 56 13.678 7.392 11.650 1.00 0.00 N ATOM 846 CA ASP A 56 14.994 7.993 11.855 1.00 0.00 C ATOM 847 C ASP A 56 15.320 7.955 13.343 1.00 0.00 C ATOM 848 O ASP A 56 14.730 8.709 14.122 1.00 0.00 O ATOM 849 CB ASP A 56 15.034 9.435 11.330 1.00 0.00 C ATOM 850 CG ASP A 56 16.382 10.141 11.590 1.00 0.00 C ATOM 851 OD1 ASP A 56 17.339 9.511 12.097 1.00 0.00 O ATOM 852 OD2 ASP A 56 16.478 11.342 11.251 1.00 0.00 O ATOM 0 H ASP A 56 12.927 8.080 11.603 1.00 0.00 H new ATOM 0 HA ASP A 56 15.739 7.426 11.298 1.00 0.00 H new ATOM 0 HB2 ASP A 56 14.835 9.430 10.258 1.00 0.00 H new ATOM 0 HB3 ASP A 56 14.235 10.008 11.800 1.00 0.00 H new ATOM 857 N VAL A 57 16.217 7.063 13.758 1.00 0.00 N ATOM 858 CA VAL A 57 16.538 6.853 15.162 1.00 0.00 C ATOM 859 C VAL A 57 17.062 8.129 15.826 1.00 0.00 C ATOM 860 O VAL A 57 16.870 8.286 17.032 1.00 0.00 O ATOM 861 CB VAL A 57 17.500 5.658 15.347 1.00 0.00 C ATOM 862 CG1 VAL A 57 16.874 4.373 14.789 1.00 0.00 C ATOM 863 CG2 VAL A 57 18.887 5.855 14.716 1.00 0.00 C ATOM 0 H VAL A 57 16.743 6.463 13.123 1.00 0.00 H new ATOM 0 HA VAL A 57 15.610 6.598 15.674 1.00 0.00 H new ATOM 0 HB VAL A 57 17.654 5.581 16.423 1.00 0.00 H new ATOM 0 HG11 VAL A 57 17.565 3.542 14.928 1.00 0.00 H new ATOM 0 HG12 VAL A 57 15.943 4.163 15.316 1.00 0.00 H new ATOM 0 HG13 VAL A 57 16.668 4.500 13.726 1.00 0.00 H new ATOM 0 HG21 VAL A 57 19.497 4.969 14.893 1.00 0.00 H new ATOM 0 HG22 VAL A 57 18.779 6.012 13.643 1.00 0.00 H new ATOM 0 HG23 VAL A 57 19.370 6.723 15.164 1.00 0.00 H new ATOM 873 N ASP A 58 17.664 9.060 15.078 1.00 0.00 N ATOM 874 CA ASP A 58 18.242 10.283 15.645 1.00 0.00 C ATOM 875 C ASP A 58 17.174 11.197 16.261 1.00 0.00 C ATOM 876 O ASP A 58 17.488 12.037 17.104 1.00 0.00 O ATOM 877 CB ASP A 58 19.038 11.044 14.580 1.00 0.00 C ATOM 878 CG ASP A 58 19.763 12.261 15.179 1.00 0.00 C ATOM 879 OD1 ASP A 58 20.688 12.074 16.003 1.00 0.00 O ATOM 880 OD2 ASP A 58 19.454 13.409 14.789 1.00 0.00 O ATOM 0 H ASP A 58 17.764 8.987 14.066 1.00 0.00 H new ATOM 0 HA ASP A 58 18.914 9.978 16.447 1.00 0.00 H new ATOM 0 HB2 ASP A 58 19.766 10.375 14.122 1.00 0.00 H new ATOM 0 HB3 ASP A 58 18.365 11.374 13.788 1.00 0.00 H new ATOM 885 N GLU A 59 15.903 10.996 15.896 1.00 0.00 N ATOM 886 CA GLU A 59 14.757 11.742 16.411 1.00 0.00 C ATOM 887 C GLU A 59 13.756 10.807 17.112 1.00 0.00 C ATOM 888 O GLU A 59 12.692 11.253 17.543 1.00 0.00 O ATOM 889 CB GLU A 59 14.083 12.505 15.259 1.00 0.00 C ATOM 890 CG GLU A 59 14.992 13.574 14.634 1.00 0.00 C ATOM 891 CD GLU A 59 14.205 14.509 13.697 1.00 0.00 C ATOM 892 OE1 GLU A 59 13.885 14.120 12.552 1.00 0.00 O ATOM 893 OE2 GLU A 59 13.906 15.660 14.094 1.00 0.00 O ATOM 0 H GLU A 59 15.639 10.287 15.212 1.00 0.00 H new ATOM 0 HA GLU A 59 15.108 12.458 17.155 1.00 0.00 H new ATOM 0 HB2 GLU A 59 13.782 11.796 14.488 1.00 0.00 H new ATOM 0 HB3 GLU A 59 13.174 12.980 15.628 1.00 0.00 H new ATOM 0 HG2 GLU A 59 15.462 14.160 15.424 1.00 0.00 H new ATOM 0 HG3 GLU A 59 15.794 13.090 14.077 1.00 0.00 H new ATOM 900 N ASN A 60 14.078 9.512 17.230 1.00 0.00 N ATOM 901 CA ASN A 60 13.156 8.466 17.687 1.00 0.00 C ATOM 902 C ASN A 60 13.891 7.498 18.613 1.00 0.00 C ATOM 903 O ASN A 60 13.698 6.281 18.552 1.00 0.00 O ATOM 904 CB ASN A 60 12.490 7.759 16.495 1.00 0.00 C ATOM 905 CG ASN A 60 11.578 8.704 15.726 1.00 0.00 C ATOM 906 OD1 ASN A 60 10.459 8.988 16.142 1.00 0.00 O ATOM 907 ND2 ASN A 60 12.032 9.223 14.598 1.00 0.00 N ATOM 0 H ASN A 60 15.007 9.156 17.005 1.00 0.00 H new ATOM 0 HA ASN A 60 12.348 8.920 18.261 1.00 0.00 H new ATOM 0 HB2 ASN A 60 13.258 7.368 15.827 1.00 0.00 H new ATOM 0 HB3 ASN A 60 11.914 6.906 16.852 1.00 0.00 H new ATOM 0 HD21 ASN A 60 11.450 9.868 14.063 1.00 0.00 H new ATOM 0 HD22 ASN A 60 12.964 8.979 14.263 1.00 0.00 H new ATOM 914 N GLN A 61 14.757 8.049 19.470 1.00 0.00 N ATOM 915 CA GLN A 61 15.491 7.293 20.479 1.00 0.00 C ATOM 916 C GLN A 61 14.536 6.502 21.378 1.00 0.00 C ATOM 917 O GLN A 61 14.883 5.406 21.810 1.00 0.00 O ATOM 918 CB GLN A 61 16.355 8.244 21.328 1.00 0.00 C ATOM 919 CG GLN A 61 17.527 8.857 20.548 1.00 0.00 C ATOM 920 CD GLN A 61 18.603 7.822 20.215 1.00 0.00 C ATOM 921 OE1 GLN A 61 19.411 7.441 21.058 1.00 0.00 O ATOM 922 NE2 GLN A 61 18.633 7.337 18.985 1.00 0.00 N ATOM 0 H GLN A 61 14.968 9.047 19.479 1.00 0.00 H new ATOM 0 HA GLN A 61 16.140 6.583 19.967 1.00 0.00 H new ATOM 0 HB2 GLN A 61 15.727 9.046 21.716 1.00 0.00 H new ATOM 0 HB3 GLN A 61 16.745 7.700 22.188 1.00 0.00 H new ATOM 0 HG2 GLN A 61 17.154 9.301 19.625 1.00 0.00 H new ATOM 0 HG3 GLN A 61 17.969 9.663 21.134 1.00 0.00 H new ATOM 0 HE21 GLN A 61 17.957 7.660 18.293 1.00 0.00 H new ATOM 0 HE22 GLN A 61 19.332 6.640 18.729 1.00 0.00 H new ATOM 931 N GLU A 62 13.330 7.021 21.637 1.00 0.00 N ATOM 932 CA GLU A 62 12.341 6.340 22.460 1.00 0.00 C ATOM 933 C GLU A 62 11.868 5.058 21.771 1.00 0.00 C ATOM 934 O GLU A 62 11.857 4.001 22.399 1.00 0.00 O ATOM 935 CB GLU A 62 11.149 7.270 22.751 1.00 0.00 C ATOM 936 CG GLU A 62 11.517 8.515 23.573 1.00 0.00 C ATOM 937 CD GLU A 62 12.057 8.167 24.973 1.00 0.00 C ATOM 938 OE1 GLU A 62 11.257 7.818 25.870 1.00 0.00 O ATOM 939 OE2 GLU A 62 13.284 8.262 25.201 1.00 0.00 O ATOM 0 H GLU A 62 13.019 7.924 21.279 1.00 0.00 H new ATOM 0 HA GLU A 62 12.805 6.071 23.409 1.00 0.00 H new ATOM 0 HB2 GLU A 62 10.709 7.588 21.806 1.00 0.00 H new ATOM 0 HB3 GLU A 62 10.384 6.707 23.285 1.00 0.00 H new ATOM 0 HG2 GLU A 62 12.267 9.093 23.033 1.00 0.00 H new ATOM 0 HG3 GLU A 62 10.637 9.150 23.675 1.00 0.00 H new ATOM 946 N THR A 63 11.520 5.116 20.484 1.00 0.00 N ATOM 947 CA THR A 63 11.036 3.961 19.739 1.00 0.00 C ATOM 948 C THR A 63 12.163 2.936 19.571 1.00 0.00 C ATOM 949 O THR A 63 11.938 1.742 19.729 1.00 0.00 O ATOM 950 CB THR A 63 10.479 4.409 18.378 1.00 0.00 C ATOM 951 OG1 THR A 63 9.986 5.730 18.432 1.00 0.00 O ATOM 952 CG2 THR A 63 9.360 3.510 17.851 1.00 0.00 C ATOM 0 H THR A 63 11.568 5.971 19.930 1.00 0.00 H new ATOM 0 HA THR A 63 10.227 3.485 20.294 1.00 0.00 H new ATOM 0 HB THR A 63 11.326 4.342 17.696 1.00 0.00 H new ATOM 0 HG1 THR A 63 9.319 5.801 19.147 1.00 0.00 H new ATOM 0 HG21 THR A 63 9.015 3.885 16.888 1.00 0.00 H new ATOM 0 HG22 THR A 63 9.736 2.494 17.731 1.00 0.00 H new ATOM 0 HG23 THR A 63 8.531 3.509 18.558 1.00 0.00 H new ATOM 960 N ALA A 64 13.391 3.388 19.312 1.00 0.00 N ATOM 961 CA ALA A 64 14.565 2.525 19.268 1.00 0.00 C ATOM 962 C ALA A 64 14.763 1.821 20.615 1.00 0.00 C ATOM 963 O ALA A 64 14.875 0.595 20.662 1.00 0.00 O ATOM 964 CB ALA A 64 15.788 3.370 18.877 1.00 0.00 C ATOM 0 H ALA A 64 13.597 4.370 19.126 1.00 0.00 H new ATOM 0 HA ALA A 64 14.428 1.745 18.519 1.00 0.00 H new ATOM 0 HB1 ALA A 64 16.673 2.734 18.841 1.00 0.00 H new ATOM 0 HB2 ALA A 64 15.623 3.818 17.897 1.00 0.00 H new ATOM 0 HB3 ALA A 64 15.937 4.158 19.615 1.00 0.00 H new ATOM 970 N GLY A 65 14.730 2.575 21.717 1.00 0.00 N ATOM 971 CA GLY A 65 14.868 2.043 23.067 1.00 0.00 C ATOM 972 C GLY A 65 13.748 1.062 23.417 1.00 0.00 C ATOM 973 O GLY A 65 13.977 0.114 24.170 1.00 0.00 O ATOM 0 H GLY A 65 14.605 3.587 21.691 1.00 0.00 H new ATOM 0 HA2 GLY A 65 15.831 1.541 23.162 1.00 0.00 H new ATOM 0 HA3 GLY A 65 14.865 2.866 23.782 1.00 0.00 H new ATOM 977 N LYS A 66 12.565 1.233 22.817 1.00 0.00 N ATOM 978 CA LYS A 66 11.388 0.385 22.992 1.00 0.00 C ATOM 979 C LYS A 66 11.692 -1.085 22.699 1.00 0.00 C ATOM 980 O LYS A 66 11.085 -1.956 23.323 1.00 0.00 O ATOM 981 CB LYS A 66 10.252 0.917 22.112 1.00 0.00 C ATOM 982 CG LYS A 66 8.912 0.794 22.850 1.00 0.00 C ATOM 983 CD LYS A 66 7.775 1.481 22.094 1.00 0.00 C ATOM 984 CE LYS A 66 7.918 3.015 22.069 1.00 0.00 C ATOM 985 NZ LYS A 66 6.887 3.675 21.232 1.00 0.00 N ATOM 0 H LYS A 66 12.398 2.002 22.168 1.00 0.00 H new ATOM 0 HA LYS A 66 11.078 0.425 24.036 1.00 0.00 H new ATOM 0 HB2 LYS A 66 10.439 1.959 21.853 1.00 0.00 H new ATOM 0 HB3 LYS A 66 10.214 0.358 21.177 1.00 0.00 H new ATOM 0 HG2 LYS A 66 8.670 -0.260 22.989 1.00 0.00 H new ATOM 0 HG3 LYS A 66 9.004 1.233 23.843 1.00 0.00 H new ATOM 0 HD2 LYS A 66 7.746 1.106 21.071 1.00 0.00 H new ATOM 0 HD3 LYS A 66 6.824 1.216 22.557 1.00 0.00 H new ATOM 0 HE2 LYS A 66 7.852 3.398 23.087 1.00 0.00 H new ATOM 0 HE3 LYS A 66 8.907 3.277 21.693 1.00 0.00 H new ATOM 0 HZ1 LYS A 66 7.280 4.545 20.819 1.00 0.00 H new ATOM 0 HZ2 LYS A 66 6.594 3.031 20.470 1.00 0.00 H new ATOM 0 HZ3 LYS A 66 6.063 3.913 21.820 1.00 0.00 H new ATOM 999 N TYR A 67 12.653 -1.358 21.807 1.00 0.00 N ATOM 1000 CA TYR A 67 13.068 -2.718 21.445 1.00 0.00 C ATOM 1001 C TYR A 67 14.573 -2.935 21.669 1.00 0.00 C ATOM 1002 O TYR A 67 15.123 -3.945 21.225 1.00 0.00 O ATOM 1003 CB TYR A 67 12.663 -3.032 19.995 1.00 0.00 C ATOM 1004 CG TYR A 67 11.391 -2.350 19.531 1.00 0.00 C ATOM 1005 CD1 TYR A 67 10.134 -2.768 20.006 1.00 0.00 C ATOM 1006 CD2 TYR A 67 11.492 -1.213 18.712 1.00 0.00 C ATOM 1007 CE1 TYR A 67 8.977 -2.041 19.671 1.00 0.00 C ATOM 1008 CE2 TYR A 67 10.345 -0.478 18.387 1.00 0.00 C ATOM 1009 CZ TYR A 67 9.078 -0.884 18.863 1.00 0.00 C ATOM 1010 OH TYR A 67 7.976 -0.137 18.573 1.00 0.00 O ATOM 0 H TYR A 67 13.170 -0.632 21.311 1.00 0.00 H new ATOM 0 HA TYR A 67 12.549 -3.414 22.104 1.00 0.00 H new ATOM 0 HB2 TYR A 67 13.478 -2.740 19.333 1.00 0.00 H new ATOM 0 HB3 TYR A 67 12.540 -4.110 19.892 1.00 0.00 H new ATOM 0 HD1 TYR A 67 10.057 -3.647 20.628 1.00 0.00 H new ATOM 0 HD2 TYR A 67 12.455 -0.905 18.333 1.00 0.00 H new ATOM 0 HE1 TYR A 67 8.012 -2.366 20.031 1.00 0.00 H new ATOM 0 HE2 TYR A 67 10.429 0.404 17.769 1.00 0.00 H new ATOM 0 HH TYR A 67 8.068 0.248 17.676 1.00 0.00 H new ATOM 1020 N GLY A 68 15.254 -1.997 22.338 1.00 0.00 N ATOM 1021 CA GLY A 68 16.691 -2.054 22.579 1.00 0.00 C ATOM 1022 C GLY A 68 17.517 -1.961 21.291 1.00 0.00 C ATOM 1023 O GLY A 68 18.617 -2.515 21.237 1.00 0.00 O ATOM 0 H GLY A 68 14.811 -1.167 22.731 1.00 0.00 H new ATOM 0 HA2 GLY A 68 16.975 -1.240 23.246 1.00 0.00 H new ATOM 0 HA3 GLY A 68 16.931 -2.985 23.092 1.00 0.00 H new ATOM 1027 N VAL A 69 17.003 -1.297 20.249 1.00 0.00 N ATOM 1028 CA VAL A 69 17.763 -1.001 19.036 1.00 0.00 C ATOM 1029 C VAL A 69 18.935 -0.100 19.449 1.00 0.00 C ATOM 1030 O VAL A 69 18.735 0.928 20.103 1.00 0.00 O ATOM 1031 CB VAL A 69 16.851 -0.346 17.972 1.00 0.00 C ATOM 1032 CG1 VAL A 69 17.609 -0.065 16.666 1.00 0.00 C ATOM 1033 CG2 VAL A 69 15.619 -1.208 17.652 1.00 0.00 C ATOM 0 H VAL A 69 16.044 -0.950 20.227 1.00 0.00 H new ATOM 0 HA VAL A 69 18.152 -1.909 18.574 1.00 0.00 H new ATOM 0 HB VAL A 69 16.520 0.596 18.408 1.00 0.00 H new ATOM 0 HG11 VAL A 69 16.933 0.395 15.945 1.00 0.00 H new ATOM 0 HG12 VAL A 69 18.441 0.611 16.866 1.00 0.00 H new ATOM 0 HG13 VAL A 69 17.992 -1.001 16.259 1.00 0.00 H new ATOM 0 HG21 VAL A 69 15.009 -0.707 16.900 1.00 0.00 H new ATOM 0 HG22 VAL A 69 15.942 -2.177 17.270 1.00 0.00 H new ATOM 0 HG23 VAL A 69 15.031 -1.353 18.558 1.00 0.00 H new ATOM 1043 N MET A 70 20.154 -0.493 19.068 1.00 0.00 N ATOM 1044 CA MET A 70 21.399 0.197 19.423 1.00 0.00 C ATOM 1045 C MET A 70 22.346 0.285 18.210 1.00 0.00 C ATOM 1046 O MET A 70 23.435 0.855 18.309 1.00 0.00 O ATOM 1047 CB MET A 70 22.027 -0.543 20.619 1.00 0.00 C ATOM 1048 CG MET A 70 23.098 0.272 21.357 1.00 0.00 C ATOM 1049 SD MET A 70 23.692 -0.465 22.909 1.00 0.00 S ATOM 1050 CE MET A 70 24.577 -1.918 22.276 1.00 0.00 C ATOM 0 H MET A 70 20.307 -1.320 18.490 1.00 0.00 H new ATOM 0 HA MET A 70 21.199 1.228 19.714 1.00 0.00 H new ATOM 0 HB2 MET A 70 21.239 -0.812 21.323 1.00 0.00 H new ATOM 0 HB3 MET A 70 22.471 -1.474 20.266 1.00 0.00 H new ATOM 0 HG2 MET A 70 23.949 0.413 20.691 1.00 0.00 H new ATOM 0 HG3 MET A 70 22.695 1.261 21.573 1.00 0.00 H new ATOM 0 HE1 MET A 70 25.046 -2.448 23.105 1.00 0.00 H new ATOM 0 HE2 MET A 70 23.874 -2.581 21.772 1.00 0.00 H new ATOM 0 HE3 MET A 70 25.343 -1.598 21.570 1.00 0.00 H new ATOM 1060 N SER A 71 21.919 -0.237 17.056 1.00 0.00 N ATOM 1061 CA SER A 71 22.641 -0.255 15.795 1.00 0.00 C ATOM 1062 C SER A 71 21.615 -0.094 14.671 1.00 0.00 C ATOM 1063 O SER A 71 20.421 -0.318 14.891 1.00 0.00 O ATOM 1064 CB SER A 71 23.400 -1.586 15.644 1.00 0.00 C ATOM 1065 OG SER A 71 24.263 -1.836 16.745 1.00 0.00 O ATOM 0 H SER A 71 21.005 -0.683 16.980 1.00 0.00 H new ATOM 0 HA SER A 71 23.371 0.554 15.757 1.00 0.00 H new ATOM 0 HB2 SER A 71 22.684 -2.403 15.552 1.00 0.00 H new ATOM 0 HB3 SER A 71 23.983 -1.568 14.723 1.00 0.00 H new ATOM 0 HG SER A 71 24.725 -2.690 16.612 1.00 0.00 H new ATOM 1071 N ILE A 72 22.068 0.267 13.470 1.00 0.00 N ATOM 1072 CA ILE A 72 21.243 0.400 12.270 1.00 0.00 C ATOM 1073 C ILE A 72 22.063 -0.082 11.053 1.00 0.00 C ATOM 1074 O ILE A 72 23.297 -0.052 11.129 1.00 0.00 O ATOM 1075 CB ILE A 72 20.732 1.854 12.102 1.00 0.00 C ATOM 1076 CG1 ILE A 72 21.873 2.896 12.043 1.00 0.00 C ATOM 1077 CG2 ILE A 72 19.712 2.215 13.199 1.00 0.00 C ATOM 1078 CD1 ILE A 72 21.393 4.289 11.624 1.00 0.00 C ATOM 0 H ILE A 72 23.051 0.482 13.301 1.00 0.00 H new ATOM 0 HA ILE A 72 20.352 -0.222 12.358 1.00 0.00 H new ATOM 0 HB ILE A 72 20.231 1.891 11.135 1.00 0.00 H new ATOM 0 HG12 ILE A 72 22.349 2.961 13.022 1.00 0.00 H new ATOM 0 HG13 ILE A 72 22.634 2.554 11.341 1.00 0.00 H new ATOM 0 HG21 ILE A 72 19.371 3.240 13.056 1.00 0.00 H new ATOM 0 HG22 ILE A 72 18.860 1.538 13.141 1.00 0.00 H new ATOM 0 HG23 ILE A 72 20.182 2.123 14.178 1.00 0.00 H new ATOM 0 HD11 ILE A 72 22.240 4.974 11.602 1.00 0.00 H new ATOM 0 HD12 ILE A 72 20.943 4.236 10.633 1.00 0.00 H new ATOM 0 HD13 ILE A 72 20.654 4.649 12.339 1.00 0.00 H new ATOM 1090 N PRO A 73 21.442 -0.511 9.935 1.00 0.00 N ATOM 1091 CA PRO A 73 20.005 -0.681 9.748 1.00 0.00 C ATOM 1092 C PRO A 73 19.488 -1.812 10.634 1.00 0.00 C ATOM 1093 O PRO A 73 20.131 -2.861 10.750 1.00 0.00 O ATOM 1094 CB PRO A 73 19.811 -1.012 8.264 1.00 0.00 C ATOM 1095 CG PRO A 73 21.132 -1.666 7.862 1.00 0.00 C ATOM 1096 CD PRO A 73 22.156 -0.958 8.748 1.00 0.00 C ATOM 0 HA PRO A 73 19.450 0.215 10.025 1.00 0.00 H new ATOM 0 HB2 PRO A 73 18.968 -1.686 8.111 1.00 0.00 H new ATOM 0 HB3 PRO A 73 19.613 -0.115 7.676 1.00 0.00 H new ATOM 0 HG2 PRO A 73 21.120 -2.741 8.041 1.00 0.00 H new ATOM 0 HG3 PRO A 73 21.347 -1.521 6.803 1.00 0.00 H new ATOM 0 HD2 PRO A 73 22.969 -1.633 9.016 1.00 0.00 H new ATOM 0 HD3 PRO A 73 22.603 -0.113 8.224 1.00 0.00 H new ATOM 1104 N THR A 74 18.316 -1.608 11.226 1.00 0.00 N ATOM 1105 CA THR A 74 17.652 -2.619 12.035 1.00 0.00 C ATOM 1106 C THR A 74 16.201 -2.685 11.575 1.00 0.00 C ATOM 1107 O THR A 74 15.577 -1.665 11.280 1.00 0.00 O ATOM 1108 CB THR A 74 17.845 -2.295 13.527 1.00 0.00 C ATOM 1109 OG1 THR A 74 19.209 -2.458 13.851 1.00 0.00 O ATOM 1110 CG2 THR A 74 17.041 -3.221 14.445 1.00 0.00 C ATOM 0 H THR A 74 17.799 -0.732 11.157 1.00 0.00 H new ATOM 0 HA THR A 74 18.080 -3.613 11.906 1.00 0.00 H new ATOM 0 HB THR A 74 17.498 -1.273 13.681 1.00 0.00 H new ATOM 0 HG1 THR A 74 19.514 -1.690 14.378 1.00 0.00 H new ATOM 0 HG21 THR A 74 17.217 -2.945 15.485 1.00 0.00 H new ATOM 0 HG22 THR A 74 15.979 -3.125 14.219 1.00 0.00 H new ATOM 0 HG23 THR A 74 17.354 -4.253 14.286 1.00 0.00 H new ATOM 1118 N LEU A 75 15.675 -3.899 11.473 1.00 0.00 N ATOM 1119 CA LEU A 75 14.383 -4.197 10.889 1.00 0.00 C ATOM 1120 C LEU A 75 13.524 -4.762 12.003 1.00 0.00 C ATOM 1121 O LEU A 75 13.938 -5.705 12.683 1.00 0.00 O ATOM 1122 CB LEU A 75 14.534 -5.223 9.756 1.00 0.00 C ATOM 1123 CG LEU A 75 15.247 -4.701 8.495 1.00 0.00 C ATOM 1124 CD1 LEU A 75 15.527 -5.877 7.553 1.00 0.00 C ATOM 1125 CD2 LEU A 75 14.422 -3.648 7.748 1.00 0.00 C ATOM 0 H LEU A 75 16.159 -4.732 11.809 1.00 0.00 H new ATOM 0 HA LEU A 75 13.930 -3.303 10.460 1.00 0.00 H new ATOM 0 HB2 LEU A 75 15.085 -6.083 10.136 1.00 0.00 H new ATOM 0 HB3 LEU A 75 13.543 -5.578 9.474 1.00 0.00 H new ATOM 0 HG LEU A 75 16.174 -4.226 8.816 1.00 0.00 H new ATOM 0 HD11 LEU A 75 16.032 -5.514 6.658 1.00 0.00 H new ATOM 0 HD12 LEU A 75 16.162 -6.605 8.058 1.00 0.00 H new ATOM 0 HD13 LEU A 75 14.586 -6.350 7.272 1.00 0.00 H new ATOM 0 HD21 LEU A 75 14.970 -3.314 6.867 1.00 0.00 H new ATOM 0 HD22 LEU A 75 13.471 -4.082 7.440 1.00 0.00 H new ATOM 0 HD23 LEU A 75 14.237 -2.798 8.405 1.00 0.00 H new ATOM 1137 N LEU A 76 12.329 -4.208 12.183 1.00 0.00 N ATOM 1138 CA LEU A 76 11.370 -4.677 13.177 1.00 0.00 C ATOM 1139 C LEU A 76 10.188 -5.077 12.329 1.00 0.00 C ATOM 1140 O LEU A 76 9.719 -4.280 11.518 1.00 0.00 O ATOM 1141 CB LEU A 76 10.977 -3.567 14.178 1.00 0.00 C ATOM 1142 CG LEU A 76 11.882 -3.342 15.407 1.00 0.00 C ATOM 1143 CD1 LEU A 76 11.749 -4.495 16.405 1.00 0.00 C ATOM 1144 CD2 LEU A 76 13.351 -3.156 15.028 1.00 0.00 C ATOM 0 H LEU A 76 11.996 -3.413 11.637 1.00 0.00 H new ATOM 0 HA LEU A 76 11.765 -5.482 13.796 1.00 0.00 H new ATOM 0 HB2 LEU A 76 10.921 -2.627 13.629 1.00 0.00 H new ATOM 0 HB3 LEU A 76 9.972 -3.785 14.540 1.00 0.00 H new ATOM 0 HG LEU A 76 11.540 -2.418 15.874 1.00 0.00 H new ATOM 0 HD11 LEU A 76 12.397 -4.311 17.262 1.00 0.00 H new ATOM 0 HD12 LEU A 76 10.715 -4.567 16.742 1.00 0.00 H new ATOM 0 HD13 LEU A 76 12.040 -5.429 15.923 1.00 0.00 H new ATOM 0 HD21 LEU A 76 13.943 -3.001 15.930 1.00 0.00 H new ATOM 0 HD22 LEU A 76 13.708 -4.045 14.508 1.00 0.00 H new ATOM 0 HD23 LEU A 76 13.451 -2.289 14.375 1.00 0.00 H new ATOM 1156 N VAL A 77 9.725 -6.308 12.474 1.00 0.00 N ATOM 1157 CA VAL A 77 8.607 -6.802 11.705 1.00 0.00 C ATOM 1158 C VAL A 77 7.470 -6.821 12.702 1.00 0.00 C ATOM 1159 O VAL A 77 7.594 -7.422 13.775 1.00 0.00 O ATOM 1160 CB VAL A 77 8.907 -8.182 11.092 1.00 0.00 C ATOM 1161 CG1 VAL A 77 8.055 -8.361 9.827 1.00 0.00 C ATOM 1162 CG2 VAL A 77 10.389 -8.389 10.736 1.00 0.00 C ATOM 0 H VAL A 77 10.116 -6.987 13.127 1.00 0.00 H new ATOM 0 HA VAL A 77 8.370 -6.184 10.839 1.00 0.00 H new ATOM 0 HB VAL A 77 8.660 -8.926 11.850 1.00 0.00 H new ATOM 0 HG11 VAL A 77 8.260 -9.336 9.385 1.00 0.00 H new ATOM 0 HG12 VAL A 77 6.999 -8.296 10.088 1.00 0.00 H new ATOM 0 HG13 VAL A 77 8.301 -7.578 9.109 1.00 0.00 H new ATOM 0 HG21 VAL A 77 10.525 -9.383 10.309 1.00 0.00 H new ATOM 0 HG22 VAL A 77 10.697 -7.637 10.010 1.00 0.00 H new ATOM 0 HG23 VAL A 77 10.996 -8.294 11.636 1.00 0.00 H new ATOM 1172 N LEU A 78 6.392 -6.114 12.385 1.00 0.00 N ATOM 1173 CA LEU A 78 5.246 -5.965 13.254 1.00 0.00 C ATOM 1174 C LEU A 78 4.048 -6.522 12.509 1.00 0.00 C ATOM 1175 O LEU A 78 4.019 -6.514 11.277 1.00 0.00 O ATOM 1176 CB LEU A 78 5.021 -4.494 13.662 1.00 0.00 C ATOM 1177 CG LEU A 78 6.181 -3.886 14.481 1.00 0.00 C ATOM 1178 CD1 LEU A 78 7.167 -3.115 13.595 1.00 0.00 C ATOM 1179 CD2 LEU A 78 5.669 -2.961 15.590 1.00 0.00 C ATOM 0 H LEU A 78 6.295 -5.621 11.497 1.00 0.00 H new ATOM 0 HA LEU A 78 5.407 -6.508 14.185 1.00 0.00 H new ATOM 0 HB2 LEU A 78 4.872 -3.897 12.762 1.00 0.00 H new ATOM 0 HB3 LEU A 78 4.103 -4.426 14.245 1.00 0.00 H new ATOM 0 HG LEU A 78 6.703 -4.728 14.935 1.00 0.00 H new ATOM 0 HD11 LEU A 78 7.966 -2.704 14.212 1.00 0.00 H new ATOM 0 HD12 LEU A 78 7.592 -3.789 12.852 1.00 0.00 H new ATOM 0 HD13 LEU A 78 6.644 -2.302 13.091 1.00 0.00 H new ATOM 0 HD21 LEU A 78 6.515 -2.553 16.143 1.00 0.00 H new ATOM 0 HD22 LEU A 78 5.097 -2.145 15.148 1.00 0.00 H new ATOM 0 HD23 LEU A 78 5.030 -3.526 16.269 1.00 0.00 H new ATOM 1191 N LYS A 79 3.048 -6.985 13.246 1.00 0.00 N ATOM 1192 CA LYS A 79 1.772 -7.379 12.678 1.00 0.00 C ATOM 1193 C LYS A 79 0.689 -6.829 13.581 1.00 0.00 C ATOM 1194 O LYS A 79 0.695 -7.105 14.778 1.00 0.00 O ATOM 1195 CB LYS A 79 1.691 -8.905 12.518 1.00 0.00 C ATOM 1196 CG LYS A 79 0.404 -9.304 11.786 1.00 0.00 C ATOM 1197 CD LYS A 79 0.344 -10.811 11.506 1.00 0.00 C ATOM 1198 CE LYS A 79 -0.938 -11.146 10.731 1.00 0.00 C ATOM 1199 NZ LYS A 79 -0.982 -12.569 10.316 1.00 0.00 N ATOM 0 H LYS A 79 3.102 -7.097 14.258 1.00 0.00 H new ATOM 0 HA LYS A 79 1.646 -6.972 11.675 1.00 0.00 H new ATOM 0 HB2 LYS A 79 2.558 -9.264 11.963 1.00 0.00 H new ATOM 0 HB3 LYS A 79 1.721 -9.381 13.498 1.00 0.00 H new ATOM 0 HG2 LYS A 79 -0.459 -9.012 12.385 1.00 0.00 H new ATOM 0 HG3 LYS A 79 0.338 -8.758 10.845 1.00 0.00 H new ATOM 0 HD2 LYS A 79 1.218 -11.118 10.931 1.00 0.00 H new ATOM 0 HD3 LYS A 79 0.368 -11.366 12.444 1.00 0.00 H new ATOM 0 HE2 LYS A 79 -1.806 -10.923 11.352 1.00 0.00 H new ATOM 0 HE3 LYS A 79 -1.005 -10.509 9.849 1.00 0.00 H new ATOM 0 HZ1 LYS A 79 -1.856 -12.748 9.781 1.00 0.00 H new ATOM 0 HZ2 LYS A 79 -0.159 -12.781 9.716 1.00 0.00 H new ATOM 0 HZ3 LYS A 79 -0.962 -13.177 11.159 1.00 0.00 H new ATOM 1213 N ASP A 80 -0.230 -6.062 12.995 1.00 0.00 N ATOM 1214 CA ASP A 80 -1.427 -5.533 13.653 1.00 0.00 C ATOM 1215 C ASP A 80 -1.105 -4.871 15.009 1.00 0.00 C ATOM 1216 O ASP A 80 -1.859 -4.973 15.977 1.00 0.00 O ATOM 1217 CB ASP A 80 -2.503 -6.630 13.731 1.00 0.00 C ATOM 1218 CG ASP A 80 -3.859 -6.099 14.231 1.00 0.00 C ATOM 1219 OD1 ASP A 80 -4.322 -5.043 13.745 1.00 0.00 O ATOM 1220 OD2 ASP A 80 -4.505 -6.772 15.067 1.00 0.00 O ATOM 0 H ASP A 80 -0.160 -5.782 12.017 1.00 0.00 H new ATOM 0 HA ASP A 80 -1.837 -4.723 13.050 1.00 0.00 H new ATOM 0 HB2 ASP A 80 -2.633 -7.076 12.745 1.00 0.00 H new ATOM 0 HB3 ASP A 80 -2.160 -7.422 14.396 1.00 0.00 H new ATOM 1225 N GLY A 81 0.054 -4.205 15.084 1.00 0.00 N ATOM 1226 CA GLY A 81 0.431 -3.349 16.200 1.00 0.00 C ATOM 1227 C GLY A 81 1.379 -3.992 17.217 1.00 0.00 C ATOM 1228 O GLY A 81 1.713 -3.324 18.197 1.00 0.00 O ATOM 0 H GLY A 81 0.765 -4.251 14.354 1.00 0.00 H new ATOM 0 HA2 GLY A 81 0.902 -2.449 15.805 1.00 0.00 H new ATOM 0 HA3 GLY A 81 -0.474 -3.034 16.719 1.00 0.00 H new ATOM 1232 N GLU A 82 1.837 -5.235 17.021 1.00 0.00 N ATOM 1233 CA GLU A 82 2.810 -5.882 17.908 1.00 0.00 C ATOM 1234 C GLU A 82 4.038 -6.298 17.103 1.00 0.00 C ATOM 1235 O GLU A 82 3.903 -6.661 15.935 1.00 0.00 O ATOM 1236 CB GLU A 82 2.159 -7.065 18.650 1.00 0.00 C ATOM 1237 CG GLU A 82 2.072 -8.392 17.872 1.00 0.00 C ATOM 1238 CD GLU A 82 1.318 -9.462 18.681 1.00 0.00 C ATOM 1239 OE1 GLU A 82 1.944 -10.166 19.506 1.00 0.00 O ATOM 1240 OE2 GLU A 82 0.089 -9.624 18.500 1.00 0.00 O ATOM 0 H GLU A 82 1.542 -5.821 16.240 1.00 0.00 H new ATOM 0 HA GLU A 82 3.140 -5.178 18.672 1.00 0.00 H new ATOM 0 HB2 GLU A 82 2.718 -7.243 19.569 1.00 0.00 H new ATOM 0 HB3 GLU A 82 1.150 -6.773 18.942 1.00 0.00 H new ATOM 0 HG2 GLU A 82 1.565 -8.227 16.921 1.00 0.00 H new ATOM 0 HG3 GLU A 82 3.076 -8.748 17.640 1.00 0.00 H new ATOM 1247 N VAL A 83 5.229 -6.262 17.707 1.00 0.00 N ATOM 1248 CA VAL A 83 6.429 -6.832 17.103 1.00 0.00 C ATOM 1249 C VAL A 83 6.236 -8.344 17.044 1.00 0.00 C ATOM 1250 O VAL A 83 5.911 -8.980 18.051 1.00 0.00 O ATOM 1251 CB VAL A 83 7.697 -6.436 17.891 1.00 0.00 C ATOM 1252 CG1 VAL A 83 8.967 -7.004 17.238 1.00 0.00 C ATOM 1253 CG2 VAL A 83 7.859 -4.910 17.973 1.00 0.00 C ATOM 0 H VAL A 83 5.385 -5.839 18.622 1.00 0.00 H new ATOM 0 HA VAL A 83 6.574 -6.441 16.096 1.00 0.00 H new ATOM 0 HB VAL A 83 7.571 -6.852 18.891 1.00 0.00 H new ATOM 0 HG11 VAL A 83 9.840 -6.706 17.819 1.00 0.00 H new ATOM 0 HG12 VAL A 83 8.906 -8.092 17.208 1.00 0.00 H new ATOM 0 HG13 VAL A 83 9.058 -6.618 16.223 1.00 0.00 H new ATOM 0 HG21 VAL A 83 8.762 -4.670 18.535 1.00 0.00 H new ATOM 0 HG22 VAL A 83 7.937 -4.498 16.967 1.00 0.00 H new ATOM 0 HG23 VAL A 83 6.993 -4.479 18.476 1.00 0.00 H new ATOM 1263 N VAL A 84 6.478 -8.907 15.865 1.00 0.00 N ATOM 1264 CA VAL A 84 6.433 -10.333 15.608 1.00 0.00 C ATOM 1265 C VAL A 84 7.805 -10.864 15.154 1.00 0.00 C ATOM 1266 O VAL A 84 8.028 -12.067 15.296 1.00 0.00 O ATOM 1267 CB VAL A 84 5.275 -10.660 14.641 1.00 0.00 C ATOM 1268 CG1 VAL A 84 3.906 -10.310 15.243 1.00 0.00 C ATOM 1269 CG2 VAL A 84 5.403 -9.963 13.276 1.00 0.00 C ATOM 0 H VAL A 84 6.718 -8.361 15.038 1.00 0.00 H new ATOM 0 HA VAL A 84 6.219 -10.865 16.535 1.00 0.00 H new ATOM 0 HB VAL A 84 5.345 -11.736 14.483 1.00 0.00 H new ATOM 0 HG11 VAL A 84 3.121 -10.556 14.529 1.00 0.00 H new ATOM 0 HG12 VAL A 84 3.755 -10.880 16.159 1.00 0.00 H new ATOM 0 HG13 VAL A 84 3.870 -9.244 15.469 1.00 0.00 H new ATOM 0 HG21 VAL A 84 4.556 -10.237 12.647 1.00 0.00 H new ATOM 0 HG22 VAL A 84 5.414 -8.882 13.419 1.00 0.00 H new ATOM 0 HG23 VAL A 84 6.329 -10.275 12.794 1.00 0.00 H new ATOM 1279 N GLU A 85 8.753 -10.018 14.709 1.00 0.00 N ATOM 1280 CA GLU A 85 10.129 -10.451 14.417 1.00 0.00 C ATOM 1281 C GLU A 85 11.098 -9.265 14.503 1.00 0.00 C ATOM 1282 O GLU A 85 10.679 -8.106 14.542 1.00 0.00 O ATOM 1283 CB GLU A 85 10.214 -11.111 13.020 1.00 0.00 C ATOM 1284 CG GLU A 85 10.508 -12.619 13.041 1.00 0.00 C ATOM 1285 CD GLU A 85 11.969 -12.961 13.372 1.00 0.00 C ATOM 1286 OE1 GLU A 85 12.510 -12.443 14.374 1.00 0.00 O ATOM 1287 OE2 GLU A 85 12.560 -13.788 12.638 1.00 0.00 O ATOM 0 H GLU A 85 8.588 -9.025 14.544 1.00 0.00 H new ATOM 0 HA GLU A 85 10.415 -11.190 15.165 1.00 0.00 H new ATOM 0 HB2 GLU A 85 9.272 -10.945 12.497 1.00 0.00 H new ATOM 0 HB3 GLU A 85 10.992 -10.611 12.443 1.00 0.00 H new ATOM 0 HG2 GLU A 85 9.858 -13.096 13.774 1.00 0.00 H new ATOM 0 HG3 GLU A 85 10.257 -13.042 12.068 1.00 0.00 H new ATOM 1294 N THR A 86 12.404 -9.535 14.516 1.00 0.00 N ATOM 1295 CA THR A 86 13.460 -8.526 14.477 1.00 0.00 C ATOM 1296 C THR A 86 14.654 -9.093 13.697 1.00 0.00 C ATOM 1297 O THR A 86 14.989 -10.271 13.854 1.00 0.00 O ATOM 1298 CB THR A 86 13.868 -8.173 15.920 1.00 0.00 C ATOM 1299 OG1 THR A 86 12.727 -7.894 16.714 1.00 0.00 O ATOM 1300 CG2 THR A 86 14.818 -6.974 16.008 1.00 0.00 C ATOM 0 H THR A 86 12.765 -10.488 14.555 1.00 0.00 H new ATOM 0 HA THR A 86 13.111 -7.620 13.981 1.00 0.00 H new ATOM 0 HB THR A 86 14.394 -9.051 16.294 1.00 0.00 H new ATOM 0 HG1 THR A 86 13.009 -7.674 17.626 1.00 0.00 H new ATOM 0 HG21 THR A 86 15.064 -6.781 17.052 1.00 0.00 H new ATOM 0 HG22 THR A 86 15.731 -7.192 15.454 1.00 0.00 H new ATOM 0 HG23 THR A 86 14.335 -6.095 15.581 1.00 0.00 H new ATOM 1308 N SER A 87 15.324 -8.246 12.911 1.00 0.00 N ATOM 1309 CA SER A 87 16.524 -8.581 12.148 1.00 0.00 C ATOM 1310 C SER A 87 17.451 -7.360 12.127 1.00 0.00 C ATOM 1311 O SER A 87 16.994 -6.234 12.314 1.00 0.00 O ATOM 1312 CB SER A 87 16.140 -9.011 10.723 1.00 0.00 C ATOM 1313 OG SER A 87 15.285 -10.142 10.737 1.00 0.00 O ATOM 0 H SER A 87 15.034 -7.276 12.786 1.00 0.00 H new ATOM 0 HA SER A 87 17.046 -9.416 12.616 1.00 0.00 H new ATOM 0 HB2 SER A 87 15.645 -8.185 10.213 1.00 0.00 H new ATOM 0 HB3 SER A 87 17.042 -9.241 10.155 1.00 0.00 H new ATOM 0 HG SER A 87 15.310 -10.582 9.862 1.00 0.00 H new ATOM 1319 N VAL A 88 18.752 -7.562 11.917 1.00 0.00 N ATOM 1320 CA VAL A 88 19.756 -6.500 11.985 1.00 0.00 C ATOM 1321 C VAL A 88 20.672 -6.641 10.765 1.00 0.00 C ATOM 1322 O VAL A 88 20.938 -7.760 10.312 1.00 0.00 O ATOM 1323 CB VAL A 88 20.510 -6.592 13.335 1.00 0.00 C ATOM 1324 CG1 VAL A 88 21.496 -5.428 13.522 1.00 0.00 C ATOM 1325 CG2 VAL A 88 19.560 -6.609 14.551 1.00 0.00 C ATOM 0 H VAL A 88 19.142 -8.477 11.693 1.00 0.00 H new ATOM 0 HA VAL A 88 19.306 -5.508 11.952 1.00 0.00 H new ATOM 0 HB VAL A 88 21.051 -7.537 13.290 1.00 0.00 H new ATOM 0 HG11 VAL A 88 22.003 -5.531 14.481 1.00 0.00 H new ATOM 0 HG12 VAL A 88 22.233 -5.442 12.719 1.00 0.00 H new ATOM 0 HG13 VAL A 88 20.952 -4.483 13.499 1.00 0.00 H new ATOM 0 HG21 VAL A 88 20.145 -6.674 15.469 1.00 0.00 H new ATOM 0 HG22 VAL A 88 18.968 -5.694 14.563 1.00 0.00 H new ATOM 0 HG23 VAL A 88 18.896 -7.470 14.482 1.00 0.00 H new ATOM 1335 N GLY A 89 21.166 -5.522 10.233 1.00 0.00 N ATOM 1336 CA GLY A 89 22.089 -5.506 9.106 1.00 0.00 C ATOM 1337 C GLY A 89 21.388 -5.778 7.773 1.00 0.00 C ATOM 1338 O GLY A 89 20.161 -5.886 7.700 1.00 0.00 O ATOM 0 H GLY A 89 20.931 -4.592 10.580 1.00 0.00 H new ATOM 0 HA2 GLY A 89 22.586 -4.537 9.061 1.00 0.00 H new ATOM 0 HA3 GLY A 89 22.865 -6.255 9.265 1.00 0.00 H new ATOM 1342 N PHE A 90 22.185 -5.862 6.706 1.00 0.00 N ATOM 1343 CA PHE A 90 21.708 -6.112 5.348 1.00 0.00 C ATOM 1344 C PHE A 90 21.041 -7.493 5.236 1.00 0.00 C ATOM 1345 O PHE A 90 21.456 -8.444 5.907 1.00 0.00 O ATOM 1346 CB PHE A 90 22.898 -6.005 4.378 1.00 0.00 C ATOM 1347 CG PHE A 90 22.537 -6.190 2.914 1.00 0.00 C ATOM 1348 CD1 PHE A 90 22.560 -7.475 2.334 1.00 0.00 C ATOM 1349 CD2 PHE A 90 22.165 -5.079 2.132 1.00 0.00 C ATOM 1350 CE1 PHE A 90 22.190 -7.649 0.988 1.00 0.00 C ATOM 1351 CE2 PHE A 90 21.808 -5.254 0.785 1.00 0.00 C ATOM 1352 CZ PHE A 90 21.814 -6.539 0.213 1.00 0.00 C ATOM 0 H PHE A 90 23.198 -5.756 6.764 1.00 0.00 H new ATOM 0 HA PHE A 90 20.954 -5.368 5.092 1.00 0.00 H new ATOM 0 HB2 PHE A 90 23.366 -5.028 4.503 1.00 0.00 H new ATOM 0 HB3 PHE A 90 23.642 -6.752 4.653 1.00 0.00 H new ATOM 0 HD1 PHE A 90 22.862 -8.327 2.924 1.00 0.00 H new ATOM 0 HD2 PHE A 90 22.154 -4.091 2.569 1.00 0.00 H new ATOM 0 HE1 PHE A 90 22.195 -8.636 0.550 1.00 0.00 H new ATOM 0 HE2 PHE A 90 21.528 -4.400 0.187 1.00 0.00 H new ATOM 0 HZ PHE A 90 21.530 -6.672 -0.820 1.00 0.00 H new ATOM 1362 N LYS A 91 20.048 -7.616 4.349 1.00 0.00 N ATOM 1363 CA LYS A 91 19.454 -8.877 3.904 1.00 0.00 C ATOM 1364 C LYS A 91 18.996 -8.677 2.454 1.00 0.00 C ATOM 1365 O LYS A 91 18.501 -7.590 2.141 1.00 0.00 O ATOM 1366 CB LYS A 91 18.248 -9.293 4.774 1.00 0.00 C ATOM 1367 CG LYS A 91 18.645 -10.112 6.013 1.00 0.00 C ATOM 1368 CD LYS A 91 18.623 -9.309 7.322 1.00 0.00 C ATOM 1369 CE LYS A 91 19.403 -10.069 8.405 1.00 0.00 C ATOM 1370 NZ LYS A 91 20.858 -9.780 8.355 1.00 0.00 N ATOM 0 H LYS A 91 19.620 -6.804 3.904 1.00 0.00 H new ATOM 0 HA LYS A 91 20.195 -9.672 3.990 1.00 0.00 H new ATOM 0 HB2 LYS A 91 17.714 -8.398 5.094 1.00 0.00 H new ATOM 0 HB3 LYS A 91 17.556 -9.877 4.168 1.00 0.00 H new ATOM 0 HG2 LYS A 91 17.968 -10.961 6.108 1.00 0.00 H new ATOM 0 HG3 LYS A 91 19.646 -10.517 5.863 1.00 0.00 H new ATOM 0 HD2 LYS A 91 19.065 -8.325 7.164 1.00 0.00 H new ATOM 0 HD3 LYS A 91 17.594 -9.149 7.645 1.00 0.00 H new ATOM 0 HE2 LYS A 91 19.014 -9.799 9.387 1.00 0.00 H new ATOM 0 HE3 LYS A 91 19.243 -11.140 8.282 1.00 0.00 H new ATOM 0 HZ1 LYS A 91 21.392 -10.661 8.494 1.00 0.00 H new ATOM 0 HZ2 LYS A 91 21.099 -9.372 7.429 1.00 0.00 H new ATOM 0 HZ3 LYS A 91 21.104 -9.104 9.106 1.00 0.00 H new ATOM 1384 N PRO A 92 19.137 -9.687 1.576 1.00 0.00 N ATOM 1385 CA PRO A 92 18.646 -9.618 0.205 1.00 0.00 C ATOM 1386 C PRO A 92 17.116 -9.706 0.170 1.00 0.00 C ATOM 1387 O PRO A 92 16.487 -10.212 1.101 1.00 0.00 O ATOM 1388 CB PRO A 92 19.304 -10.800 -0.517 1.00 0.00 C ATOM 1389 CG PRO A 92 19.492 -11.833 0.593 1.00 0.00 C ATOM 1390 CD PRO A 92 19.788 -10.968 1.818 1.00 0.00 C ATOM 0 HA PRO A 92 18.897 -8.673 -0.277 1.00 0.00 H new ATOM 0 HB2 PRO A 92 18.673 -11.183 -1.319 1.00 0.00 H new ATOM 0 HB3 PRO A 92 20.255 -10.517 -0.967 1.00 0.00 H new ATOM 0 HG2 PRO A 92 18.599 -12.441 0.734 1.00 0.00 H new ATOM 0 HG3 PRO A 92 20.312 -12.517 0.374 1.00 0.00 H new ATOM 0 HD2 PRO A 92 19.405 -11.434 2.726 1.00 0.00 H new ATOM 0 HD3 PRO A 92 20.862 -10.840 1.954 1.00 0.00 H new ATOM 1398 N LYS A 93 16.510 -9.269 -0.938 1.00 0.00 N ATOM 1399 CA LYS A 93 15.052 -9.210 -1.102 1.00 0.00 C ATOM 1400 C LYS A 93 14.365 -10.559 -0.956 1.00 0.00 C ATOM 1401 O LYS A 93 13.212 -10.602 -0.533 1.00 0.00 O ATOM 1402 CB LYS A 93 14.683 -8.550 -2.440 1.00 0.00 C ATOM 1403 CG LYS A 93 15.245 -9.256 -3.688 1.00 0.00 C ATOM 1404 CD LYS A 93 15.240 -8.293 -4.879 1.00 0.00 C ATOM 1405 CE LYS A 93 15.705 -9.015 -6.149 1.00 0.00 C ATOM 1406 NZ LYS A 93 15.954 -8.079 -7.271 1.00 0.00 N ATOM 0 H LYS A 93 17.023 -8.942 -1.757 1.00 0.00 H new ATOM 0 HA LYS A 93 14.680 -8.595 -0.283 1.00 0.00 H new ATOM 0 HB2 LYS A 93 13.597 -8.510 -2.521 1.00 0.00 H new ATOM 0 HB3 LYS A 93 15.040 -7.520 -2.431 1.00 0.00 H new ATOM 0 HG2 LYS A 93 16.260 -9.603 -3.494 1.00 0.00 H new ATOM 0 HG3 LYS A 93 14.646 -10.137 -3.919 1.00 0.00 H new ATOM 0 HD2 LYS A 93 14.237 -7.892 -5.027 1.00 0.00 H new ATOM 0 HD3 LYS A 93 15.895 -7.446 -4.673 1.00 0.00 H new ATOM 0 HE2 LYS A 93 16.617 -9.571 -5.934 1.00 0.00 H new ATOM 0 HE3 LYS A 93 14.950 -9.743 -6.447 1.00 0.00 H new ATOM 0 HZ1 LYS A 93 16.050 -8.616 -8.156 1.00 0.00 H new ATOM 0 HZ2 LYS A 93 15.157 -7.416 -7.353 1.00 0.00 H new ATOM 0 HZ3 LYS A 93 16.830 -7.548 -7.092 1.00 0.00 H new ATOM 1420 N GLU A 94 15.038 -11.652 -1.306 1.00 0.00 N ATOM 1421 CA GLU A 94 14.508 -12.994 -1.102 1.00 0.00 C ATOM 1422 C GLU A 94 14.373 -13.272 0.400 1.00 0.00 C ATOM 1423 O GLU A 94 13.301 -13.660 0.861 1.00 0.00 O ATOM 1424 CB GLU A 94 15.417 -14.016 -1.804 1.00 0.00 C ATOM 1425 CG GLU A 94 14.859 -15.444 -1.719 1.00 0.00 C ATOM 1426 CD GLU A 94 15.732 -16.439 -2.503 1.00 0.00 C ATOM 1427 OE1 GLU A 94 16.705 -16.985 -1.934 1.00 0.00 O ATOM 1428 OE2 GLU A 94 15.447 -16.702 -3.695 1.00 0.00 O ATOM 0 H GLU A 94 15.962 -11.631 -1.737 1.00 0.00 H new ATOM 0 HA GLU A 94 13.514 -13.080 -1.541 1.00 0.00 H new ATOM 0 HB2 GLU A 94 15.535 -13.736 -2.851 1.00 0.00 H new ATOM 0 HB3 GLU A 94 16.409 -13.988 -1.353 1.00 0.00 H new ATOM 0 HG2 GLU A 94 14.803 -15.752 -0.675 1.00 0.00 H new ATOM 0 HG3 GLU A 94 13.842 -15.462 -2.112 1.00 0.00 H new ATOM 1435 N ALA A 95 15.430 -13.016 1.179 1.00 0.00 N ATOM 1436 CA ALA A 95 15.413 -13.225 2.621 1.00 0.00 C ATOM 1437 C ALA A 95 14.394 -12.305 3.292 1.00 0.00 C ATOM 1438 O ALA A 95 13.703 -12.723 4.220 1.00 0.00 O ATOM 1439 CB ALA A 95 16.812 -13.002 3.205 1.00 0.00 C ATOM 0 H ALA A 95 16.317 -12.659 0.823 1.00 0.00 H new ATOM 0 HA ALA A 95 15.115 -14.255 2.817 1.00 0.00 H new ATOM 0 HB1 ALA A 95 16.786 -13.161 4.283 1.00 0.00 H new ATOM 0 HB2 ALA A 95 17.512 -13.704 2.751 1.00 0.00 H new ATOM 0 HB3 ALA A 95 17.135 -11.982 2.997 1.00 0.00 H new ATOM 1445 N LEU A 96 14.268 -11.066 2.810 1.00 0.00 N ATOM 1446 CA LEU A 96 13.275 -10.126 3.307 1.00 0.00 C ATOM 1447 C LEU A 96 11.862 -10.621 3.037 1.00 0.00 C ATOM 1448 O LEU A 96 11.022 -10.574 3.931 1.00 0.00 O ATOM 1449 CB LEU A 96 13.455 -8.741 2.677 1.00 0.00 C ATOM 1450 CG LEU A 96 14.735 -7.990 3.092 1.00 0.00 C ATOM 1451 CD1 LEU A 96 14.812 -6.647 2.359 1.00 0.00 C ATOM 1452 CD2 LEU A 96 14.792 -7.745 4.604 1.00 0.00 C ATOM 0 H LEU A 96 14.854 -10.692 2.064 1.00 0.00 H new ATOM 0 HA LEU A 96 13.424 -10.048 4.384 1.00 0.00 H new ATOM 0 HB2 LEU A 96 13.453 -8.850 1.592 1.00 0.00 H new ATOM 0 HB3 LEU A 96 12.593 -8.127 2.937 1.00 0.00 H new ATOM 0 HG LEU A 96 15.584 -8.617 2.819 1.00 0.00 H new ATOM 0 HD11 LEU A 96 15.719 -6.121 2.657 1.00 0.00 H new ATOM 0 HD12 LEU A 96 14.830 -6.820 1.283 1.00 0.00 H new ATOM 0 HD13 LEU A 96 13.942 -6.042 2.615 1.00 0.00 H new ATOM 0 HD21 LEU A 96 15.711 -7.213 4.852 1.00 0.00 H new ATOM 0 HD22 LEU A 96 13.933 -7.147 4.908 1.00 0.00 H new ATOM 0 HD23 LEU A 96 14.773 -8.700 5.128 1.00 0.00 H new ATOM 1464 N GLN A 97 11.588 -11.124 1.833 1.00 0.00 N ATOM 1465 CA GLN A 97 10.284 -11.694 1.528 1.00 0.00 C ATOM 1466 C GLN A 97 10.009 -12.872 2.446 1.00 0.00 C ATOM 1467 O GLN A 97 8.904 -12.975 2.961 1.00 0.00 O ATOM 1468 CB GLN A 97 10.192 -12.146 0.060 1.00 0.00 C ATOM 1469 CG GLN A 97 9.930 -10.959 -0.864 1.00 0.00 C ATOM 1470 CD GLN A 97 10.064 -11.326 -2.338 1.00 0.00 C ATOM 1471 OE1 GLN A 97 9.132 -11.822 -2.965 1.00 0.00 O ATOM 1472 NE2 GLN A 97 11.218 -11.055 -2.923 1.00 0.00 N ATOM 0 H GLN A 97 12.251 -11.146 1.059 1.00 0.00 H new ATOM 0 HA GLN A 97 9.535 -10.919 1.688 1.00 0.00 H new ATOM 0 HB2 GLN A 97 11.119 -12.640 -0.231 1.00 0.00 H new ATOM 0 HB3 GLN A 97 9.393 -12.879 -0.049 1.00 0.00 H new ATOM 0 HG2 GLN A 97 8.928 -10.573 -0.679 1.00 0.00 H new ATOM 0 HG3 GLN A 97 10.629 -10.157 -0.627 1.00 0.00 H new ATOM 0 HE21 GLN A 97 11.979 -10.643 -2.383 1.00 0.00 H new ATOM 0 HE22 GLN A 97 11.347 -11.258 -3.914 1.00 0.00 H new ATOM 1481 N GLU A 98 10.999 -13.726 2.693 1.00 0.00 N ATOM 1482 CA GLU A 98 10.827 -14.891 3.553 1.00 0.00 C ATOM 1483 C GLU A 98 10.520 -14.464 4.991 1.00 0.00 C ATOM 1484 O GLU A 98 9.634 -15.032 5.628 1.00 0.00 O ATOM 1485 CB GLU A 98 12.063 -15.805 3.490 1.00 0.00 C ATOM 1486 CG GLU A 98 12.149 -16.617 2.188 1.00 0.00 C ATOM 1487 CD GLU A 98 11.083 -17.726 2.117 1.00 0.00 C ATOM 1488 OE1 GLU A 98 11.316 -18.832 2.655 1.00 0.00 O ATOM 1489 OE2 GLU A 98 10.010 -17.513 1.509 1.00 0.00 O ATOM 0 H GLU A 98 11.937 -13.630 2.305 1.00 0.00 H new ATOM 0 HA GLU A 98 9.974 -15.463 3.188 1.00 0.00 H new ATOM 0 HB2 GLU A 98 12.962 -15.197 3.592 1.00 0.00 H new ATOM 0 HB3 GLU A 98 12.044 -16.490 4.337 1.00 0.00 H new ATOM 0 HG2 GLU A 98 12.030 -15.947 1.337 1.00 0.00 H new ATOM 0 HG3 GLU A 98 13.140 -17.063 2.106 1.00 0.00 H new ATOM 1496 N LEU A 99 11.200 -13.427 5.485 1.00 0.00 N ATOM 1497 CA LEU A 99 10.991 -12.845 6.797 1.00 0.00 C ATOM 1498 C LEU A 99 9.564 -12.305 6.929 1.00 0.00 C ATOM 1499 O LEU A 99 8.901 -12.570 7.928 1.00 0.00 O ATOM 1500 CB LEU A 99 12.055 -11.750 6.967 1.00 0.00 C ATOM 1501 CG LEU A 99 11.911 -10.910 8.237 1.00 0.00 C ATOM 1502 CD1 LEU A 99 12.118 -11.764 9.492 1.00 0.00 C ATOM 1503 CD2 LEU A 99 12.928 -9.766 8.177 1.00 0.00 C ATOM 0 H LEU A 99 11.936 -12.958 4.957 1.00 0.00 H new ATOM 0 HA LEU A 99 11.097 -13.587 7.588 1.00 0.00 H new ATOM 0 HB2 LEU A 99 13.040 -12.217 6.966 1.00 0.00 H new ATOM 0 HB3 LEU A 99 12.016 -11.087 6.103 1.00 0.00 H new ATOM 0 HG LEU A 99 10.901 -10.503 8.294 1.00 0.00 H new ATOM 0 HD11 LEU A 99 12.010 -11.140 10.379 1.00 0.00 H new ATOM 0 HD12 LEU A 99 11.375 -12.561 9.516 1.00 0.00 H new ATOM 0 HD13 LEU A 99 13.117 -12.200 9.475 1.00 0.00 H new ATOM 0 HD21 LEU A 99 12.841 -9.154 9.075 1.00 0.00 H new ATOM 0 HD22 LEU A 99 13.935 -10.178 8.114 1.00 0.00 H new ATOM 0 HD23 LEU A 99 12.732 -9.151 7.299 1.00 0.00 H new ATOM 1515 N VAL A 100 9.067 -11.592 5.915 1.00 0.00 N ATOM 1516 CA VAL A 100 7.684 -11.132 5.853 1.00 0.00 C ATOM 1517 C VAL A 100 6.737 -12.344 5.831 1.00 0.00 C ATOM 1518 O VAL A 100 5.734 -12.378 6.546 1.00 0.00 O ATOM 1519 CB VAL A 100 7.523 -10.230 4.608 1.00 0.00 C ATOM 1520 CG1 VAL A 100 6.071 -9.804 4.361 1.00 0.00 C ATOM 1521 CG2 VAL A 100 8.387 -8.958 4.668 1.00 0.00 C ATOM 0 H VAL A 100 9.623 -11.316 5.106 1.00 0.00 H new ATOM 0 HA VAL A 100 7.425 -10.543 6.733 1.00 0.00 H new ATOM 0 HB VAL A 100 7.862 -10.858 3.784 1.00 0.00 H new ATOM 0 HG11 VAL A 100 6.023 -9.173 3.474 1.00 0.00 H new ATOM 0 HG12 VAL A 100 5.453 -10.689 4.211 1.00 0.00 H new ATOM 0 HG13 VAL A 100 5.704 -9.247 5.223 1.00 0.00 H new ATOM 0 HG21 VAL A 100 8.229 -8.368 3.765 1.00 0.00 H new ATOM 0 HG22 VAL A 100 8.106 -8.368 5.541 1.00 0.00 H new ATOM 0 HG23 VAL A 100 9.439 -9.236 4.740 1.00 0.00 H new ATOM 1531 N ASN A 101 7.071 -13.362 5.034 1.00 0.00 N ATOM 1532 CA ASN A 101 6.238 -14.533 4.770 1.00 0.00 C ATOM 1533 C ASN A 101 5.971 -15.350 6.036 1.00 0.00 C ATOM 1534 O ASN A 101 4.937 -16.011 6.118 1.00 0.00 O ATOM 1535 CB ASN A 101 6.880 -15.409 3.682 1.00 0.00 C ATOM 1536 CG ASN A 101 5.866 -16.338 3.030 1.00 0.00 C ATOM 1537 OD1 ASN A 101 5.603 -17.441 3.499 1.00 0.00 O ATOM 1538 ND2 ASN A 101 5.294 -15.910 1.915 1.00 0.00 N ATOM 0 H ASN A 101 7.962 -13.392 4.538 1.00 0.00 H new ATOM 0 HA ASN A 101 5.272 -14.174 4.413 1.00 0.00 H new ATOM 0 HB2 ASN A 101 7.330 -14.771 2.921 1.00 0.00 H new ATOM 0 HB3 ASN A 101 7.685 -16.000 4.119 1.00 0.00 H new ATOM 0 HD21 ASN A 101 4.620 -16.501 1.428 1.00 0.00 H new ATOM 0 HD22 ASN A 101 5.527 -14.989 1.543 1.00 0.00 H new ATOM 1545 N LYS A 102 6.842 -15.253 7.052 1.00 0.00 N ATOM 1546 CA LYS A 102 6.606 -15.847 8.373 1.00 0.00 C ATOM 1547 C LYS A 102 5.276 -15.389 8.986 1.00 0.00 C ATOM 1548 O LYS A 102 4.720 -16.123 9.806 1.00 0.00 O ATOM 1549 CB LYS A 102 7.728 -15.484 9.361 1.00 0.00 C ATOM 1550 CG LYS A 102 9.133 -15.988 9.003 1.00 0.00 C ATOM 1551 CD LYS A 102 10.100 -15.698 10.162 1.00 0.00 C ATOM 1552 CE LYS A 102 11.540 -16.087 9.803 1.00 0.00 C ATOM 1553 NZ LYS A 102 12.450 -16.012 10.973 1.00 0.00 N ATOM 0 H LYS A 102 7.731 -14.759 6.979 1.00 0.00 H new ATOM 0 HA LYS A 102 6.579 -16.925 8.211 1.00 0.00 H new ATOM 0 HB2 LYS A 102 7.766 -14.399 9.453 1.00 0.00 H new ATOM 0 HB3 LYS A 102 7.462 -15.878 10.342 1.00 0.00 H new ATOM 0 HG2 LYS A 102 9.105 -17.059 8.800 1.00 0.00 H new ATOM 0 HG3 LYS A 102 9.484 -15.500 8.094 1.00 0.00 H new ATOM 0 HD2 LYS A 102 10.060 -14.638 10.414 1.00 0.00 H new ATOM 0 HD3 LYS A 102 9.783 -16.248 11.048 1.00 0.00 H new ATOM 0 HE2 LYS A 102 11.551 -17.100 9.401 1.00 0.00 H new ATOM 0 HE3 LYS A 102 11.907 -15.428 9.017 1.00 0.00 H new ATOM 0 HZ1 LYS A 102 13.436 -16.082 10.651 1.00 0.00 H new ATOM 0 HZ2 LYS A 102 12.310 -15.106 11.464 1.00 0.00 H new ATOM 0 HZ3 LYS A 102 12.242 -16.795 11.625 1.00 0.00 H new ATOM 1567 N HIS A 103 4.770 -14.209 8.612 1.00 0.00 N ATOM 1568 CA HIS A 103 3.649 -13.559 9.287 1.00 0.00 C ATOM 1569 C HIS A 103 2.479 -13.237 8.352 1.00 0.00 C ATOM 1570 O HIS A 103 1.401 -12.898 8.847 1.00 0.00 O ATOM 1571 CB HIS A 103 4.165 -12.293 9.985 1.00 0.00 C ATOM 1572 CG HIS A 103 5.337 -12.564 10.892 1.00 0.00 C ATOM 1573 ND1 HIS A 103 5.324 -13.322 12.043 1.00 0.00 N ATOM 1574 CD2 HIS A 103 6.635 -12.190 10.666 1.00 0.00 C ATOM 1575 CE1 HIS A 103 6.584 -13.398 12.501 1.00 0.00 C ATOM 1576 NE2 HIS A 103 7.419 -12.724 11.693 1.00 0.00 N ATOM 0 H HIS A 103 5.134 -13.675 7.823 1.00 0.00 H new ATOM 0 HA HIS A 103 3.246 -14.259 10.019 1.00 0.00 H new ATOM 0 HB2 HIS A 103 4.456 -11.561 9.232 1.00 0.00 H new ATOM 0 HB3 HIS A 103 3.357 -11.849 10.566 1.00 0.00 H new ATOM 0 HD1 HIS A 103 4.503 -13.750 12.471 1.00 0.00 H new ATOM 0 HD2 HIS A 103 6.990 -11.590 9.841 1.00 0.00 H new ATOM 0 HE1 HIS A 103 6.884 -13.927 13.394 1.00 0.00 H new ATOM 1584 N LEU A 104 2.654 -13.340 7.029 1.00 0.00 N ATOM 1585 CA LEU A 104 1.549 -13.225 6.080 1.00 0.00 C ATOM 1586 C LEU A 104 0.500 -14.286 6.397 1.00 0.00 C ATOM 1587 O LEU A 104 0.869 -15.461 6.604 1.00 0.00 O ATOM 1588 CB LEU A 104 2.018 -13.365 4.620 1.00 0.00 C ATOM 1589 CG LEU A 104 2.926 -12.235 4.105 1.00 0.00 C ATOM 1590 CD1 LEU A 104 3.262 -12.483 2.632 1.00 0.00 C ATOM 1591 CD2 LEU A 104 2.289 -10.848 4.253 1.00 0.00 C ATOM 1592 OXT LEU A 104 -0.700 -13.946 6.406 1.00 0.00 O ATOM 0 H LEU A 104 3.561 -13.504 6.592 1.00 0.00 H new ATOM 0 HA LEU A 104 1.119 -12.229 6.185 1.00 0.00 H new ATOM 0 HB2 LEU A 104 2.550 -14.311 4.517 1.00 0.00 H new ATOM 0 HB3 LEU A 104 1.139 -13.422 3.978 1.00 0.00 H new ATOM 0 HG LEU A 104 3.829 -12.244 4.715 1.00 0.00 H new ATOM 0 HD11 LEU A 104 3.905 -11.683 2.266 1.00 0.00 H new ATOM 0 HD12 LEU A 104 3.778 -13.438 2.532 1.00 0.00 H new ATOM 0 HD13 LEU A 104 2.342 -12.505 2.048 1.00 0.00 H new ATOM 0 HD21 LEU A 104 2.975 -10.090 3.874 1.00 0.00 H new ATOM 0 HD22 LEU A 104 1.359 -10.812 3.686 1.00 0.00 H new ATOM 0 HD23 LEU A 104 2.080 -10.654 5.305 1.00 0.00 H new TER 1604 LEU A 104