USER MOD reduce.3.24.130724 H: found=0, std=0, add=665, rem=0, adj=19 USER MOD reduce.3.24.130724 removed 666 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: B 78 ASN : amide:sc= 1.12 K(o=3.5,f=-5.4!) USER MOD Set 1.2: B 81 LYS NZ :NH3+ 156:sc= 2.35 (180deg=-0.09) USER MOD Set 2.1: B 73 GLN : amide:sc= 0.166! K(o=0.61!,f=-0.87) USER MOD Set 2.2: B 75 GLN : amide:sc= 0.446 K(o=0.61,f=-3.1) USER MOD Set 3.1: B 53 SER OG : rot 180:sc= 0.664 USER MOD Set 3.2: B 83 ASN : amide:sc= 0.428 K(o=1.1,f=-8.8!) USER MOD Set 4.1: A 18 SER OG : rot -48:sc= 1.87 USER MOD Set 4.2: B 93 GLN : amide:sc= -0.606 K(o=1.3,f=0.26) USER MOD Single : A 12 GLN : amide:sc= 0.604 K(o=0.6,f=-1.6!) USER MOD Single : A 14 HIS :FLIP no HD1:sc= -0.724 F(o=-1.8,f=-0.72) USER MOD Single : A 15 THR OG1 : rot 98:sc= 1.22 USER MOD Single : A 19 ASN : amide:sc= 1.1 K(o=1.1,f=-0.17) USER MOD Single : A 20 THR OG1 : rot -79:sc= 1.18 USER MOD Single : A 23 THR OG1 : rot -27:sc= 0.379 USER MOD Single : B 51 SER OG : rot -12:sc= 0.543 USER MOD Single : B 55 SER OG : rot 180:sc= 0.0394 USER MOD Single : B 58 GLN : amide:sc= 0.608 K(o=0.61,f=-0.63) USER MOD Single : B 63 THR OG1 : rot 82:sc= 1.14 USER MOD Single : B 65 LYS NZ :NH3+ -174:sc= 0 (180deg=-0.0184) USER MOD Single : B 66 SER OG : rot -31:sc= 1.21 USER MOD Single : B 68 SER OG : rot 180:sc= -0.0106 USER MOD Single : B 69 SER OG : rot 180:sc= 0 USER MOD Single : B 71 GLN : amide:sc= 0.626 K(o=0.63,f=-5.2!) USER MOD Single : B 72 GLN : amide:sc= 1.19 K(o=1.2,f=-0.023) USER MOD Single : B 74 GLN : amide:sc= 1.48 K(o=1.5,f=-4.3!) USER MOD Single : B 82 SER OG : rot -95:sc= 1.21 USER MOD Single : B 85 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : B 87 MET CE :methyl -105:sc= -0.969 (180deg=-6.1!) USER MOD Single : B 92 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 95 THR OG1 : rot 84:sc= 1.14 USER MOD Single : B 97 LYS NZ :NH3+ 179:sc= 1.31 (180deg=1.25) USER MOD Single : B 98 TYR OH : rot 116:sc= 1.17 USER MOD ----------------------------------------------------------------- ATOM 65 N GLU A 6 12.301 -10.162 -3.790 1.00 10.00 N ATOM 66 CA GLU A 6 11.027 -9.659 -4.257 1.00 10.00 C ATOM 67 C GLU A 6 10.013 -9.644 -3.120 1.00 10.00 C ATOM 68 O GLU A 6 9.350 -8.630 -2.926 1.00 10.00 O ATOM 69 CB GLU A 6 10.497 -10.466 -5.463 1.00 10.00 C ATOM 70 CG GLU A 6 11.543 -11.059 -6.427 1.00 10.00 C ATOM 71 CD GLU A 6 12.055 -12.447 -6.042 1.00 10.00 C ATOM 72 OE1 GLU A 6 12.649 -12.571 -4.944 1.00 10.00 O ATOM 73 OE2 GLU A 6 11.900 -13.401 -6.839 1.00 10.00 O ATOM 0 HA GLU A 6 11.180 -8.636 -4.600 1.00 10.00 H new ATOM 0 HB2 GLU A 6 9.888 -11.285 -5.080 1.00 10.00 H new ATOM 0 HB3 GLU A 6 9.836 -9.818 -6.039 1.00 10.00 H new ATOM 0 HG2 GLU A 6 11.108 -11.111 -7.425 1.00 10.00 H new ATOM 0 HG3 GLU A 6 12.391 -10.377 -6.484 1.00 10.00 H new ATOM 80 N ARG A 7 9.940 -10.732 -2.326 1.00 10.00 N ATOM 81 CA ARG A 7 9.104 -10.792 -1.128 1.00 10.00 C ATOM 82 C ARG A 7 9.561 -9.770 -0.100 1.00 10.00 C ATOM 83 O ARG A 7 8.754 -8.933 0.301 1.00 10.00 O ATOM 84 CB ARG A 7 9.111 -12.215 -0.550 1.00 10.00 C ATOM 85 CG ARG A 7 8.388 -12.423 0.792 1.00 10.00 C ATOM 86 CD ARG A 7 6.859 -12.313 0.774 1.00 10.00 C ATOM 87 NE ARG A 7 6.334 -10.960 0.643 1.00 10.00 N ATOM 88 CZ ARG A 7 5.159 -10.608 0.144 1.00 10.00 C ATOM 89 NH1 ARG A 7 4.588 -11.210 -0.872 1.00 10.00 N ATOM 90 NH2 ARG A 7 4.505 -9.624 0.700 1.00 10.00 N ATOM 0 H ARG A 7 10.462 -11.590 -2.505 1.00 10.00 H new ATOM 0 HA ARG A 7 8.079 -10.543 -1.401 1.00 10.00 H new ATOM 0 HB2 ARG A 7 8.661 -12.882 -1.285 1.00 10.00 H new ATOM 0 HB3 ARG A 7 10.148 -12.527 -0.429 1.00 10.00 H new ATOM 0 HG2 ARG A 7 8.654 -13.409 1.173 1.00 10.00 H new ATOM 0 HG3 ARG A 7 8.773 -11.692 1.503 1.00 10.00 H new ATOM 0 HD2 ARG A 7 6.478 -12.915 -0.051 1.00 10.00 H new ATOM 0 HD3 ARG A 7 6.469 -12.749 1.694 1.00 10.00 H new ATOM 0 HE ARG A 7 6.935 -10.204 0.970 1.00 10.00 H new ATOM 0 HH11 ARG A 7 5.052 -11.998 -1.324 1.00 10.00 H new ATOM 0 HH12 ARG A 7 3.680 -10.890 -1.210 1.00 10.00 H new ATOM 0 HH21 ARG A 7 4.901 -9.140 1.506 1.00 10.00 H new ATOM 0 HH22 ARG A 7 3.599 -9.340 0.328 1.00 10.00 H new ATOM 104 N ALA A 8 10.834 -9.821 0.304 1.00 10.00 N ATOM 105 CA ALA A 8 11.341 -8.918 1.324 1.00 10.00 C ATOM 106 C ALA A 8 11.216 -7.443 0.926 1.00 10.00 C ATOM 107 O ALA A 8 10.833 -6.637 1.779 1.00 10.00 O ATOM 108 CB ALA A 8 12.796 -9.289 1.627 1.00 10.00 C ATOM 0 H ALA A 8 11.524 -10.477 -0.062 1.00 10.00 H new ATOM 0 HA ALA A 8 10.731 -9.034 2.220 1.00 10.00 H new ATOM 0 HB1 ALA A 8 13.191 -8.620 2.391 1.00 10.00 H new ATOM 0 HB2 ALA A 8 12.842 -10.317 1.986 1.00 10.00 H new ATOM 0 HB3 ALA A 8 13.392 -9.195 0.719 1.00 10.00 H new ATOM 114 N LEU A 9 11.465 -7.080 -0.349 1.00 10.00 N ATOM 115 CA LEU A 9 11.318 -5.679 -0.750 1.00 10.00 C ATOM 116 C LEU A 9 9.840 -5.292 -0.938 1.00 10.00 C ATOM 117 O LEU A 9 9.480 -4.158 -0.625 1.00 10.00 O ATOM 118 CB LEU A 9 12.350 -5.295 -1.849 1.00 10.00 C ATOM 119 CG LEU A 9 11.935 -4.897 -3.275 1.00 10.00 C ATOM 120 CD1 LEU A 9 11.453 -6.102 -4.080 1.00 10.00 C ATOM 121 CD2 LEU A 9 10.941 -3.721 -3.312 1.00 10.00 C ATOM 0 H LEU A 9 11.758 -7.717 -1.090 1.00 10.00 H new ATOM 0 HA LEU A 9 11.605 -5.009 0.061 1.00 10.00 H new ATOM 0 HB2 LEU A 9 12.933 -4.464 -1.451 1.00 10.00 H new ATOM 0 HB3 LEU A 9 13.029 -6.142 -1.948 1.00 10.00 H new ATOM 0 HG LEU A 9 12.835 -4.527 -3.765 1.00 10.00 H new ATOM 0 HD11 LEU A 9 11.169 -5.780 -5.082 1.00 10.00 H new ATOM 0 HD12 LEU A 9 12.254 -6.838 -4.149 1.00 10.00 H new ATOM 0 HD13 LEU A 9 10.591 -6.549 -3.585 1.00 10.00 H new ATOM 0 HD21 LEU A 9 10.689 -3.490 -4.347 1.00 10.00 H new ATOM 0 HD22 LEU A 9 10.035 -3.993 -2.770 1.00 10.00 H new ATOM 0 HD23 LEU A 9 11.394 -2.846 -2.845 1.00 10.00 H new ATOM 133 N LEU A 10 8.957 -6.210 -1.380 1.00 10.00 N ATOM 134 CA LEU A 10 7.498 -6.033 -1.393 1.00 10.00 C ATOM 135 C LEU A 10 6.966 -5.817 0.027 1.00 10.00 C ATOM 136 O LEU A 10 6.252 -4.841 0.251 1.00 10.00 O ATOM 137 CB LEU A 10 6.871 -7.258 -2.089 1.00 10.00 C ATOM 138 CG LEU A 10 5.349 -7.453 -2.032 1.00 10.00 C ATOM 139 CD1 LEU A 10 4.580 -6.249 -2.528 1.00 10.00 C ATOM 140 CD2 LEU A 10 4.971 -8.632 -2.935 1.00 10.00 C ATOM 0 H LEU A 10 9.250 -7.116 -1.746 1.00 10.00 H new ATOM 0 HA LEU A 10 7.222 -5.139 -1.953 1.00 10.00 H new ATOM 0 HB2 LEU A 10 7.158 -7.221 -3.140 1.00 10.00 H new ATOM 0 HB3 LEU A 10 7.332 -8.149 -1.664 1.00 10.00 H new ATOM 0 HG LEU A 10 5.090 -7.621 -0.987 1.00 10.00 H new ATOM 0 HD11 LEU A 10 3.510 -6.448 -2.463 1.00 10.00 H new ATOM 0 HD12 LEU A 10 4.826 -5.382 -1.914 1.00 10.00 H new ATOM 0 HD13 LEU A 10 4.849 -6.047 -3.565 1.00 10.00 H new ATOM 0 HD21 LEU A 10 3.892 -8.782 -2.904 1.00 10.00 H new ATOM 0 HD22 LEU A 10 5.279 -8.419 -3.959 1.00 10.00 H new ATOM 0 HD23 LEU A 10 5.473 -9.534 -2.585 1.00 10.00 H new ATOM 152 N ASP A 11 7.365 -6.663 0.987 1.00 10.00 N ATOM 153 CA ASP A 11 6.962 -6.556 2.387 1.00 10.00 C ATOM 154 C ASP A 11 7.285 -5.186 2.987 1.00 10.00 C ATOM 155 O ASP A 11 6.391 -4.525 3.515 1.00 10.00 O ATOM 156 CB ASP A 11 7.600 -7.690 3.218 1.00 10.00 C ATOM 157 CG ASP A 11 6.845 -9.005 3.071 1.00 10.00 C ATOM 158 OD1 ASP A 11 5.599 -8.977 3.002 1.00 10.00 O ATOM 159 OD2 ASP A 11 7.510 -10.046 2.910 1.00 10.00 O ATOM 0 H ASP A 11 7.986 -7.451 0.805 1.00 10.00 H new ATOM 0 HA ASP A 11 5.878 -6.662 2.421 1.00 10.00 H new ATOM 0 HB2 ASP A 11 8.635 -7.830 2.905 1.00 10.00 H new ATOM 0 HB3 ASP A 11 7.621 -7.401 4.269 1.00 10.00 H new ATOM 164 N GLN A 12 8.544 -4.738 2.903 1.00 10.00 N ATOM 165 CA GLN A 12 8.917 -3.432 3.423 1.00 10.00 C ATOM 166 C GLN A 12 8.230 -2.302 2.646 1.00 10.00 C ATOM 167 O GLN A 12 7.860 -1.299 3.257 1.00 10.00 O ATOM 168 CB GLN A 12 10.454 -3.299 3.502 1.00 10.00 C ATOM 169 CG GLN A 12 11.227 -3.246 2.187 1.00 10.00 C ATOM 170 CD GLN A 12 11.265 -1.893 1.492 1.00 10.00 C ATOM 171 OE1 GLN A 12 11.648 -0.876 2.054 1.00 10.00 O ATOM 172 NE2 GLN A 12 10.907 -1.868 0.223 1.00 10.00 N ATOM 0 H GLN A 12 9.311 -5.262 2.482 1.00 10.00 H new ATOM 0 HA GLN A 12 8.551 -3.337 4.446 1.00 10.00 H new ATOM 0 HB2 GLN A 12 10.684 -2.394 4.064 1.00 10.00 H new ATOM 0 HB3 GLN A 12 10.835 -4.140 4.082 1.00 10.00 H new ATOM 0 HG2 GLN A 12 12.252 -3.564 2.378 1.00 10.00 H new ATOM 0 HG3 GLN A 12 10.790 -3.973 1.502 1.00 10.00 H new ATOM 0 HE21 GLN A 12 10.589 -2.723 -0.234 1.00 10.00 H new ATOM 0 HE22 GLN A 12 10.948 -0.994 -0.301 1.00 10.00 H new ATOM 181 N LEU A 13 7.983 -2.474 1.339 1.00 10.00 N ATOM 182 CA LEU A 13 7.332 -1.437 0.541 1.00 10.00 C ATOM 183 C LEU A 13 5.840 -1.345 0.858 1.00 10.00 C ATOM 184 O LEU A 13 5.360 -0.228 1.014 1.00 10.00 O ATOM 185 CB LEU A 13 7.638 -1.623 -0.964 1.00 10.00 C ATOM 186 CG LEU A 13 7.432 -0.374 -1.847 1.00 10.00 C ATOM 187 CD1 LEU A 13 8.070 0.895 -1.268 1.00 10.00 C ATOM 188 CD2 LEU A 13 8.085 -0.652 -3.212 1.00 10.00 C ATOM 0 H LEU A 13 8.224 -3.318 0.819 1.00 10.00 H new ATOM 0 HA LEU A 13 7.751 -0.469 0.817 1.00 10.00 H new ATOM 0 HB2 LEU A 13 8.672 -1.953 -1.068 1.00 10.00 H new ATOM 0 HB3 LEU A 13 7.008 -2.425 -1.348 1.00 10.00 H new ATOM 0 HG LEU A 13 6.359 -0.195 -1.916 1.00 10.00 H new ATOM 0 HD11 LEU A 13 7.886 1.734 -1.940 1.00 10.00 H new ATOM 0 HD12 LEU A 13 7.633 1.109 -0.292 1.00 10.00 H new ATOM 0 HD13 LEU A 13 9.144 0.745 -1.160 1.00 10.00 H new ATOM 0 HD21 LEU A 13 7.956 0.215 -3.860 1.00 10.00 H new ATOM 0 HD22 LEU A 13 9.149 -0.846 -3.074 1.00 10.00 H new ATOM 0 HD23 LEU A 13 7.614 -1.521 -3.670 1.00 10.00 H new ATOM 200 N HIS A 14 5.106 -2.460 1.010 1.00 10.00 N ATOM 201 CA HIS A 14 3.694 -2.385 1.409 1.00 10.00 C ATOM 202 C HIS A 14 3.550 -1.986 2.885 1.00 10.00 C ATOM 203 O HIS A 14 2.534 -1.399 3.260 1.00 10.00 O ATOM 204 CB HIS A 14 2.898 -3.656 1.049 1.00 10.00 C ATOM 205 CG HIS A 14 2.998 -4.847 1.980 1.00 10.00 C ATOM 206 ND1 HIS A 14 2.614 -4.862 3.294 1.00 10.00 N flip ATOM 207 CD2 HIS A 14 3.368 -6.141 1.615 1.00 10.00 C flip ATOM 208 CE1 HIS A 14 2.835 -6.142 3.757 1.00 10.00 C flip ATOM 209 NE2 HIS A 14 3.265 -6.886 2.724 1.00 10.00 N flip ATOM 0 H HIS A 14 5.460 -3.406 0.866 1.00 10.00 H new ATOM 0 HA HIS A 14 3.240 -1.589 0.819 1.00 10.00 H new ATOM 0 HB2 HIS A 14 1.846 -3.380 0.972 1.00 10.00 H new ATOM 0 HB3 HIS A 14 3.216 -3.980 0.058 1.00 10.00 H new ATOM 0 HD2 HIS A 14 3.676 -6.476 0.635 1.00 10.00 H new ATOM 0 HE1 HIS A 14 2.688 -6.486 4.770 1.00 10.00 H new ATOM 0 HE2 HIS A 14 3.483 -7.881 2.777 1.00 10.00 H new ATOM 217 N THR A 15 4.565 -2.269 3.718 1.00 10.00 N ATOM 218 CA THR A 15 4.625 -1.768 5.092 1.00 10.00 C ATOM 219 C THR A 15 4.757 -0.250 5.103 1.00 10.00 C ATOM 220 O THR A 15 3.940 0.398 5.748 1.00 10.00 O ATOM 221 CB THR A 15 5.760 -2.413 5.910 1.00 10.00 C ATOM 222 OG1 THR A 15 5.656 -3.819 5.870 1.00 10.00 O ATOM 223 CG2 THR A 15 5.690 -2.000 7.387 1.00 10.00 C ATOM 0 H THR A 15 5.362 -2.849 3.455 1.00 10.00 H new ATOM 0 HA THR A 15 3.688 -2.050 5.572 1.00 10.00 H new ATOM 0 HB THR A 15 6.698 -2.074 5.469 1.00 10.00 H new ATOM 0 HG1 THR A 15 6.267 -4.173 5.191 1.00 10.00 H new ATOM 0 HG21 THR A 15 6.505 -2.472 7.936 1.00 10.00 H new ATOM 0 HG22 THR A 15 5.779 -0.917 7.466 1.00 10.00 H new ATOM 0 HG23 THR A 15 4.736 -2.317 7.809 1.00 10.00 H new ATOM 231 N LEU A 16 5.700 0.344 4.362 1.00 10.00 N ATOM 232 CA LEU A 16 5.765 1.798 4.154 1.00 10.00 C ATOM 233 C LEU A 16 4.403 2.332 3.683 1.00 10.00 C ATOM 234 O LEU A 16 3.798 3.194 4.325 1.00 10.00 O ATOM 235 CB LEU A 16 6.856 2.122 3.116 1.00 10.00 C ATOM 236 CG LEU A 16 6.920 3.627 2.733 1.00 10.00 C ATOM 237 CD1 LEU A 16 7.935 4.398 3.594 1.00 10.00 C ATOM 238 CD2 LEU A 16 7.211 3.759 1.236 1.00 10.00 C ATOM 0 H LEU A 16 6.442 -0.170 3.888 1.00 10.00 H new ATOM 0 HA LEU A 16 6.015 2.283 5.098 1.00 10.00 H new ATOM 0 HB2 LEU A 16 7.824 1.814 3.510 1.00 10.00 H new ATOM 0 HB3 LEU A 16 6.677 1.534 2.216 1.00 10.00 H new ATOM 0 HG LEU A 16 5.952 4.083 2.939 1.00 10.00 H new ATOM 0 HD11 LEU A 16 7.947 5.445 3.292 1.00 10.00 H new ATOM 0 HD12 LEU A 16 7.651 4.326 4.644 1.00 10.00 H new ATOM 0 HD13 LEU A 16 8.928 3.970 3.457 1.00 10.00 H new ATOM 0 HD21 LEU A 16 7.256 4.814 0.966 1.00 10.00 H new ATOM 0 HD22 LEU A 16 8.165 3.285 1.008 1.00 10.00 H new ATOM 0 HD23 LEU A 16 6.419 3.272 0.667 1.00 10.00 H new ATOM 250 N LEU A 17 3.911 1.800 2.559 1.00 10.00 N ATOM 251 CA LEU A 17 2.731 2.289 1.850 1.00 10.00 C ATOM 252 C LEU A 17 1.404 2.019 2.586 1.00 10.00 C ATOM 253 O LEU A 17 0.342 2.420 2.111 1.00 10.00 O ATOM 254 CB LEU A 17 2.784 1.718 0.425 1.00 10.00 C ATOM 255 CG LEU A 17 2.529 2.693 -0.731 1.00 10.00 C ATOM 256 CD1 LEU A 17 3.235 4.038 -0.614 1.00 10.00 C ATOM 257 CD2 LEU A 17 3.021 2.014 -2.002 1.00 10.00 C ATOM 0 H LEU A 17 4.339 0.992 2.106 1.00 10.00 H new ATOM 0 HA LEU A 17 2.754 3.378 1.807 1.00 10.00 H new ATOM 0 HB2 LEU A 17 3.766 1.269 0.277 1.00 10.00 H new ATOM 0 HB3 LEU A 17 2.052 0.913 0.356 1.00 10.00 H new ATOM 0 HG LEU A 17 1.462 2.916 -0.726 1.00 10.00 H new ATOM 0 HD11 LEU A 17 2.990 4.654 -1.479 1.00 10.00 H new ATOM 0 HD12 LEU A 17 2.908 4.543 0.295 1.00 10.00 H new ATOM 0 HD13 LEU A 17 4.313 3.881 -0.574 1.00 10.00 H new ATOM 0 HD21 LEU A 17 2.859 2.675 -2.854 1.00 10.00 H new ATOM 0 HD22 LEU A 17 4.085 1.796 -1.910 1.00 10.00 H new ATOM 0 HD23 LEU A 17 2.472 1.085 -2.154 1.00 10.00 H new ATOM 269 N SER A 18 1.456 1.391 3.759 1.00 10.00 N ATOM 270 CA SER A 18 0.306 1.161 4.624 1.00 10.00 C ATOM 271 C SER A 18 0.617 1.256 6.129 1.00 10.00 C ATOM 272 O SER A 18 -0.153 0.744 6.935 1.00 10.00 O ATOM 273 CB SER A 18 -0.336 -0.169 4.246 1.00 10.00 C ATOM 274 OG SER A 18 0.440 -1.253 4.719 1.00 10.00 O ATOM 0 H SER A 18 2.325 1.019 4.143 1.00 10.00 H new ATOM 0 HA SER A 18 -0.402 1.972 4.455 1.00 10.00 H new ATOM 0 HB2 SER A 18 -1.341 -0.225 4.665 1.00 10.00 H new ATOM 0 HB3 SER A 18 -0.438 -0.234 3.163 1.00 10.00 H new ATOM 0 HG SER A 18 1.380 -1.111 4.481 1.00 10.00 H new ATOM 280 N ASN A 19 1.700 1.944 6.509 1.00 10.00 N ATOM 281 CA ASN A 19 2.301 2.094 7.860 1.00 10.00 C ATOM 282 C ASN A 19 1.384 2.669 8.969 1.00 10.00 C ATOM 283 O ASN A 19 1.828 2.953 10.083 1.00 10.00 O ATOM 284 CB ASN A 19 3.552 2.992 7.715 1.00 10.00 C ATOM 285 CG ASN A 19 3.168 4.459 7.518 1.00 10.00 C ATOM 286 OD1 ASN A 19 3.020 5.217 8.463 1.00 10.00 O ATOM 287 ND2 ASN A 19 2.924 4.883 6.300 1.00 10.00 N ATOM 0 H ASN A 19 2.238 2.465 5.817 1.00 10.00 H new ATOM 0 HA ASN A 19 2.524 1.083 8.201 1.00 10.00 H new ATOM 0 HB2 ASN A 19 4.176 2.894 8.603 1.00 10.00 H new ATOM 0 HB3 ASN A 19 4.148 2.654 6.867 1.00 10.00 H new ATOM 0 HD21 ASN A 19 2.612 5.842 6.147 1.00 10.00 H new ATOM 0 HD22 ASN A 19 3.046 4.253 5.507 1.00 10.00 H new ATOM 294 N THR A 20 0.119 2.877 8.612 1.00 10.00 N ATOM 295 CA THR A 20 -1.049 3.548 9.186 1.00 10.00 C ATOM 296 C THR A 20 -1.538 4.419 8.048 1.00 10.00 C ATOM 297 O THR A 20 -2.358 3.957 7.262 1.00 10.00 O ATOM 298 CB THR A 20 -0.876 4.311 10.512 1.00 10.00 C ATOM 299 OG1 THR A 20 0.327 5.046 10.535 1.00 10.00 O ATOM 300 CG2 THR A 20 -0.926 3.328 11.684 1.00 10.00 C ATOM 0 H THR A 20 -0.165 2.489 7.712 1.00 10.00 H new ATOM 0 HA THR A 20 -1.765 2.801 9.530 1.00 10.00 H new ATOM 0 HB THR A 20 -1.695 5.024 10.604 1.00 10.00 H new ATOM 0 HG1 THR A 20 1.074 4.444 10.733 1.00 10.00 H new ATOM 0 HG21 THR A 20 -0.803 3.872 12.621 1.00 10.00 H new ATOM 0 HG22 THR A 20 -1.887 2.813 11.687 1.00 10.00 H new ATOM 0 HG23 THR A 20 -0.124 2.598 11.581 1.00 10.00 H new ATOM 308 N ASP A 21 -1.002 5.628 7.860 1.00 10.00 N ATOM 309 CA ASP A 21 -1.457 6.576 6.832 1.00 10.00 C ATOM 310 C ASP A 21 -0.331 7.507 6.355 1.00 10.00 C ATOM 311 O ASP A 21 0.839 7.333 6.698 1.00 10.00 O ATOM 312 CB ASP A 21 -2.647 7.382 7.396 1.00 10.00 C ATOM 313 CG ASP A 21 -3.866 6.495 7.646 1.00 10.00 C ATOM 314 OD1 ASP A 21 -4.463 6.044 6.644 1.00 10.00 O ATOM 315 OD2 ASP A 21 -4.209 6.245 8.826 1.00 10.00 O ATOM 0 H ASP A 21 -0.230 5.983 8.423 1.00 10.00 H new ATOM 0 HA ASP A 21 -1.773 6.013 5.954 1.00 10.00 H new ATOM 0 HB2 ASP A 21 -2.351 7.864 8.328 1.00 10.00 H new ATOM 0 HB3 ASP A 21 -2.912 8.176 6.697 1.00 10.00 H new ATOM 320 N ALA A 22 -0.692 8.484 5.515 1.00 10.00 N ATOM 321 CA ALA A 22 0.079 9.630 5.088 1.00 10.00 C ATOM 322 C ALA A 22 -0.919 10.652 4.533 1.00 10.00 C ATOM 323 O ALA A 22 -1.897 10.306 3.879 1.00 10.00 O ATOM 324 CB ALA A 22 1.233 9.247 4.145 1.00 10.00 C ATOM 0 H ALA A 22 -1.617 8.481 5.085 1.00 10.00 H new ATOM 0 HA ALA A 22 0.612 10.089 5.921 1.00 10.00 H new ATOM 0 HB1 ALA A 22 1.779 10.145 3.855 1.00 10.00 H new ATOM 0 HB2 ALA A 22 1.908 8.561 4.656 1.00 10.00 H new ATOM 0 HB3 ALA A 22 0.830 8.764 3.255 1.00 10.00 H new ATOM 330 N THR A 23 -0.693 11.922 4.843 1.00 10.00 N ATOM 331 CA THR A 23 -1.658 13.023 4.607 1.00 10.00 C ATOM 332 C THR A 23 -2.189 13.232 3.180 1.00 10.00 C ATOM 333 O THR A 23 -3.241 13.857 3.053 1.00 10.00 O ATOM 334 CB THR A 23 -1.123 14.355 5.147 1.00 10.00 C ATOM 335 OG1 THR A 23 -2.169 15.298 5.168 1.00 10.00 O ATOM 336 CG2 THR A 23 0.026 14.960 4.339 1.00 10.00 C ATOM 0 H THR A 23 0.177 12.236 5.274 1.00 10.00 H new ATOM 0 HA THR A 23 -2.529 12.674 5.162 1.00 10.00 H new ATOM 0 HB THR A 23 -0.733 14.130 6.140 1.00 10.00 H new ATOM 0 HG1 THR A 23 -2.827 15.072 4.477 1.00 10.00 H new ATOM 0 HG21 THR A 23 0.337 15.899 4.796 1.00 10.00 H new ATOM 0 HG22 THR A 23 0.867 14.266 4.326 1.00 10.00 H new ATOM 0 HG23 THR A 23 -0.306 15.146 3.318 1.00 10.00 H new ATOM 344 N GLY A 24 -1.515 12.726 2.136 1.00 10.00 N ATOM 345 CA GLY A 24 -2.030 12.678 0.761 1.00 10.00 C ATOM 346 C GLY A 24 -2.498 11.285 0.323 1.00 10.00 C ATOM 347 O GLY A 24 -3.237 11.145 -0.647 1.00 10.00 O ATOM 0 H GLY A 24 -0.579 12.331 2.227 1.00 10.00 H new ATOM 0 HA2 GLY A 24 -2.862 13.376 0.670 1.00 10.00 H new ATOM 0 HA3 GLY A 24 -1.251 13.020 0.079 1.00 10.00 H new ATOM 351 N LEU A 25 -2.124 10.247 1.079 1.00 10.00 N ATOM 352 CA LEU A 25 -2.614 8.874 0.968 1.00 10.00 C ATOM 353 C LEU A 25 -4.136 8.750 1.025 1.00 10.00 C ATOM 354 O LEU A 25 -4.674 7.832 0.417 1.00 10.00 O ATOM 355 CB LEU A 25 -1.897 7.994 2.016 1.00 10.00 C ATOM 356 CG LEU A 25 -1.367 6.628 1.533 1.00 10.00 C ATOM 357 CD1 LEU A 25 -0.306 6.785 0.439 1.00 10.00 C ATOM 358 CD2 LEU A 25 -0.742 5.911 2.731 1.00 10.00 C ATOM 0 H LEU A 25 -1.435 10.351 1.824 1.00 10.00 H new ATOM 0 HA LEU A 25 -2.366 8.511 -0.029 1.00 10.00 H new ATOM 0 HB2 LEU A 25 -1.057 8.561 2.418 1.00 10.00 H new ATOM 0 HB3 LEU A 25 -2.587 7.818 2.841 1.00 10.00 H new ATOM 0 HG LEU A 25 -2.197 6.059 1.114 1.00 10.00 H new ATOM 0 HD11 LEU A 25 0.042 5.801 0.126 1.00 10.00 H new ATOM 0 HD12 LEU A 25 -0.739 7.306 -0.415 1.00 10.00 H new ATOM 0 HD13 LEU A 25 0.534 7.360 0.827 1.00 10.00 H new ATOM 0 HD21 LEU A 25 -0.359 4.941 2.415 1.00 10.00 H new ATOM 0 HD22 LEU A 25 0.076 6.512 3.129 1.00 10.00 H new ATOM 0 HD23 LEU A 25 -1.497 5.769 3.504 1.00 10.00 H new ATOM 370 N GLU A 26 -4.836 9.698 1.669 1.00 10.00 N ATOM 371 CA GLU A 26 -6.298 9.795 1.586 1.00 10.00 C ATOM 372 C GLU A 26 -6.774 9.941 0.130 1.00 10.00 C ATOM 373 O GLU A 26 -7.656 9.187 -0.288 1.00 10.00 O ATOM 374 CB GLU A 26 -6.819 10.882 2.549 1.00 10.00 C ATOM 375 CG GLU A 26 -6.633 12.349 2.122 1.00 10.00 C ATOM 376 CD GLU A 26 -7.620 12.862 1.052 1.00 10.00 C ATOM 377 OE1 GLU A 26 -8.751 12.336 0.926 1.00 10.00 O ATOM 378 OE2 GLU A 26 -7.247 13.794 0.318 1.00 10.00 O ATOM 0 H GLU A 26 -4.406 10.412 2.257 1.00 10.00 H new ATOM 0 HA GLU A 26 -6.743 8.860 1.925 1.00 10.00 H new ATOM 0 HB2 GLU A 26 -7.883 10.709 2.709 1.00 10.00 H new ATOM 0 HB3 GLU A 26 -6.326 10.745 3.511 1.00 10.00 H new ATOM 0 HG2 GLU A 26 -6.723 12.980 3.006 1.00 10.00 H new ATOM 0 HG3 GLU A 26 -5.618 12.473 1.744 1.00 10.00 H new ATOM 385 N GLU A 27 -6.143 10.826 -0.672 1.00 10.00 N ATOM 386 CA GLU A 27 -6.466 10.961 -2.090 1.00 10.00 C ATOM 387 C GLU A 27 -6.104 9.688 -2.844 1.00 10.00 C ATOM 388 O GLU A 27 -6.931 9.208 -3.610 1.00 10.00 O ATOM 389 CB GLU A 27 -5.804 12.180 -2.758 1.00 10.00 C ATOM 390 CG GLU A 27 -6.266 12.263 -4.232 1.00 10.00 C ATOM 391 CD GLU A 27 -6.375 13.676 -4.803 1.00 10.00 C ATOM 392 OE1 GLU A 27 -7.346 14.368 -4.387 1.00 10.00 O ATOM 393 OE2 GLU A 27 -5.574 14.004 -5.713 1.00 10.00 O ATOM 0 H GLU A 27 -5.407 11.454 -0.351 1.00 10.00 H new ATOM 0 HA GLU A 27 -7.542 11.126 -2.141 1.00 10.00 H new ATOM 0 HB2 GLU A 27 -6.075 13.093 -2.227 1.00 10.00 H new ATOM 0 HB3 GLU A 27 -4.719 12.093 -2.709 1.00 10.00 H new ATOM 0 HG2 GLU A 27 -5.569 11.693 -4.847 1.00 10.00 H new ATOM 0 HG3 GLU A 27 -7.238 11.778 -4.319 1.00 10.00 H new ATOM 400 N ILE A 28 -4.907 9.135 -2.629 1.00 10.00 N ATOM 401 CA ILE A 28 -4.477 7.912 -3.304 1.00 10.00 C ATOM 402 C ILE A 28 -5.466 6.761 -3.035 1.00 10.00 C ATOM 403 O ILE A 28 -5.803 6.019 -3.956 1.00 10.00 O ATOM 404 CB ILE A 28 -3.026 7.562 -2.893 1.00 10.00 C ATOM 405 CG1 ILE A 28 -2.039 8.750 -2.971 1.00 10.00 C ATOM 406 CG2 ILE A 28 -2.439 6.399 -3.710 1.00 10.00 C ATOM 407 CD1 ILE A 28 -1.892 9.416 -4.344 1.00 10.00 C ATOM 0 H ILE A 28 -4.215 9.521 -1.987 1.00 10.00 H new ATOM 0 HA ILE A 28 -4.479 8.075 -4.382 1.00 10.00 H new ATOM 0 HB ILE A 28 -3.128 7.269 -1.848 1.00 10.00 H new ATOM 0 HG12 ILE A 28 -2.357 9.508 -2.255 1.00 10.00 H new ATOM 0 HG13 ILE A 28 -1.057 8.401 -2.652 1.00 10.00 H new ATOM 0 HG21 ILE A 28 -1.420 6.199 -3.378 1.00 10.00 H new ATOM 0 HG22 ILE A 28 -3.050 5.508 -3.565 1.00 10.00 H new ATOM 0 HG23 ILE A 28 -2.430 6.665 -4.767 1.00 10.00 H new ATOM 0 HD11 ILE A 28 -1.175 10.234 -4.277 1.00 10.00 H new ATOM 0 HD12 ILE A 28 -1.538 8.682 -5.068 1.00 10.00 H new ATOM 0 HD13 ILE A 28 -2.858 9.806 -4.665 1.00 10.00 H new ATOM 419 N ASP A 29 -5.998 6.660 -1.810 1.00 10.00 N ATOM 420 CA ASP A 29 -7.009 5.676 -1.434 1.00 10.00 C ATOM 421 C ASP A 29 -8.333 5.926 -2.173 1.00 10.00 C ATOM 422 O ASP A 29 -8.843 5.017 -2.829 1.00 10.00 O ATOM 423 CB ASP A 29 -7.242 5.728 0.081 1.00 10.00 C ATOM 424 CG ASP A 29 -6.101 5.199 0.942 1.00 10.00 C ATOM 425 OD1 ASP A 29 -5.237 4.447 0.457 1.00 10.00 O ATOM 426 OD2 ASP A 29 -6.173 5.446 2.163 1.00 10.00 O ATOM 0 H ASP A 29 -5.729 7.274 -1.041 1.00 10.00 H new ATOM 0 HA ASP A 29 -6.645 4.688 -1.717 1.00 10.00 H new ATOM 0 HB2 ASP A 29 -7.438 6.762 0.365 1.00 10.00 H new ATOM 0 HB3 ASP A 29 -8.142 5.158 0.312 1.00 10.00 H new ATOM 431 N ARG A 30 -8.911 7.142 -2.102 1.00 10.00 N ATOM 432 CA ARG A 30 -10.167 7.440 -2.819 1.00 10.00 C ATOM 433 C ARG A 30 -10.024 7.417 -4.343 1.00 10.00 C ATOM 434 O ARG A 30 -10.968 6.995 -5.013 1.00 10.00 O ATOM 435 CB ARG A 30 -10.870 8.711 -2.293 1.00 10.00 C ATOM 436 CG ARG A 30 -10.089 10.003 -2.456 1.00 10.00 C ATOM 437 CD ARG A 30 -10.821 11.206 -1.827 1.00 10.00 C ATOM 438 NE ARG A 30 -9.911 12.323 -1.527 1.00 10.00 N ATOM 439 CZ ARG A 30 -9.366 13.173 -2.377 1.00 10.00 C ATOM 440 NH1 ARG A 30 -9.618 13.163 -3.663 1.00 10.00 N ATOM 441 NH2 ARG A 30 -8.483 14.047 -1.992 1.00 10.00 N ATOM 0 H ARG A 30 -8.535 7.923 -1.564 1.00 10.00 H new ATOM 0 HA ARG A 30 -10.836 6.611 -2.587 1.00 10.00 H new ATOM 0 HB2 ARG A 30 -11.825 8.816 -2.807 1.00 10.00 H new ATOM 0 HB3 ARG A 30 -11.092 8.571 -1.235 1.00 10.00 H new ATOM 0 HG2 ARG A 30 -9.108 9.894 -1.994 1.00 10.00 H new ATOM 0 HG3 ARG A 30 -9.922 10.194 -3.516 1.00 10.00 H new ATOM 0 HD2 ARG A 30 -11.601 11.549 -2.507 1.00 10.00 H new ATOM 0 HD3 ARG A 30 -11.316 10.887 -0.909 1.00 10.00 H new ATOM 0 HE ARG A 30 -9.673 12.456 -0.544 1.00 10.00 H new ATOM 0 HH11 ARG A 30 -10.263 12.475 -4.051 1.00 10.00 H new ATOM 0 HH12 ARG A 30 -9.169 13.843 -4.276 1.00 10.00 H new ATOM 0 HH21 ARG A 30 -8.197 14.086 -1.014 1.00 10.00 H new ATOM 0 HH22 ARG A 30 -8.076 14.693 -2.668 1.00 10.00 H new ATOM 455 N ALA A 31 -8.854 7.757 -4.908 1.00 10.00 N ATOM 456 CA ALA A 31 -8.538 7.569 -6.324 1.00 10.00 C ATOM 457 C ALA A 31 -8.569 6.098 -6.757 1.00 10.00 C ATOM 458 O ALA A 31 -8.730 5.822 -7.946 1.00 10.00 O ATOM 459 CB ALA A 31 -7.170 8.203 -6.598 1.00 10.00 C ATOM 0 H ALA A 31 -8.090 8.178 -4.379 1.00 10.00 H new ATOM 0 HA ALA A 31 -9.309 8.059 -6.919 1.00 10.00 H new ATOM 0 HB1 ALA A 31 -6.914 8.075 -7.650 1.00 10.00 H new ATOM 0 HB2 ALA A 31 -7.208 9.266 -6.361 1.00 10.00 H new ATOM 0 HB3 ALA A 31 -6.414 7.720 -5.979 1.00 10.00 H new ATOM 465 N LEU A 32 -8.461 5.163 -5.800 1.00 10.00 N ATOM 466 CA LEU A 32 -8.589 3.719 -5.980 1.00 10.00 C ATOM 467 C LEU A 32 -9.869 3.166 -5.334 1.00 10.00 C ATOM 468 O LEU A 32 -10.021 1.958 -5.193 1.00 10.00 O ATOM 469 CB LEU A 32 -7.292 3.072 -5.441 1.00 10.00 C ATOM 470 CG LEU A 32 -6.077 3.388 -6.331 1.00 10.00 C ATOM 471 CD1 LEU A 32 -4.770 3.233 -5.553 1.00 10.00 C ATOM 472 CD2 LEU A 32 -6.050 2.470 -7.554 1.00 10.00 C ATOM 0 H LEU A 32 -8.272 5.414 -4.830 1.00 10.00 H new ATOM 0 HA LEU A 32 -8.700 3.470 -7.035 1.00 10.00 H new ATOM 0 HB2 LEU A 32 -7.102 3.429 -4.429 1.00 10.00 H new ATOM 0 HB3 LEU A 32 -7.425 1.992 -5.379 1.00 10.00 H new ATOM 0 HG LEU A 32 -6.172 4.423 -6.659 1.00 10.00 H new ATOM 0 HD11 LEU A 32 -3.928 3.462 -6.206 1.00 10.00 H new ATOM 0 HD12 LEU A 32 -4.768 3.918 -4.705 1.00 10.00 H new ATOM 0 HD13 LEU A 32 -4.681 2.208 -5.192 1.00 10.00 H new ATOM 0 HD21 LEU A 32 -5.183 2.710 -8.170 1.00 10.00 H new ATOM 0 HD22 LEU A 32 -5.987 1.432 -7.228 1.00 10.00 H new ATOM 0 HD23 LEU A 32 -6.960 2.613 -8.137 1.00 10.00 H new ATOM 484 N GLY A 33 -10.808 4.041 -4.949 1.00 10.00 N ATOM 485 CA GLY A 33 -12.095 3.696 -4.332 1.00 10.00 C ATOM 486 C GLY A 33 -12.008 2.986 -2.976 1.00 10.00 C ATOM 487 O GLY A 33 -13.014 2.458 -2.506 1.00 10.00 O ATOM 0 H GLY A 33 -10.687 5.047 -5.063 1.00 10.00 H new ATOM 0 HA2 GLY A 33 -12.675 4.610 -4.207 1.00 10.00 H new ATOM 0 HA3 GLY A 33 -12.649 3.059 -5.021 1.00 10.00 H new ATOM 491 N ILE A 34 -10.829 2.964 -2.338 1.00 10.00 N ATOM 492 CA ILE A 34 -10.546 2.139 -1.157 1.00 10.00 C ATOM 493 C ILE A 34 -11.558 2.326 -0.016 1.00 10.00 C ATOM 494 O ILE A 34 -12.079 1.311 0.441 1.00 10.00 O ATOM 495 CB ILE A 34 -9.066 2.184 -0.725 1.00 10.00 C ATOM 496 CG1 ILE A 34 -8.157 1.802 -1.918 1.00 10.00 C ATOM 497 CG2 ILE A 34 -8.845 1.207 0.442 1.00 10.00 C ATOM 498 CD1 ILE A 34 -6.662 1.771 -1.604 1.00 10.00 C ATOM 0 H ILE A 34 -10.033 3.529 -2.634 1.00 10.00 H new ATOM 0 HA ILE A 34 -10.703 1.108 -1.473 1.00 10.00 H new ATOM 0 HB ILE A 34 -8.813 3.194 -0.401 1.00 10.00 H new ATOM 0 HG12 ILE A 34 -8.457 0.820 -2.285 1.00 10.00 H new ATOM 0 HG13 ILE A 34 -8.329 2.511 -2.728 1.00 10.00 H new ATOM 0 HG21 ILE A 34 -7.800 1.237 0.749 1.00 10.00 H new ATOM 0 HG22 ILE A 34 -9.478 1.494 1.282 1.00 10.00 H new ATOM 0 HG23 ILE A 34 -9.101 0.196 0.124 1.00 10.00 H new ATOM 0 HD11 ILE A 34 -6.108 1.494 -2.501 1.00 10.00 H new ATOM 0 HD12 ILE A 34 -6.340 2.757 -1.269 1.00 10.00 H new ATOM 0 HD13 ILE A 34 -6.470 1.040 -0.818 1.00 10.00 H new ATOM 510 N PRO A 35 -11.934 3.549 0.415 1.00 10.00 N ATOM 511 CA PRO A 35 -13.012 3.757 1.395 1.00 10.00 C ATOM 512 C PRO A 35 -14.384 3.164 1.033 1.00 10.00 C ATOM 513 O PRO A 35 -15.191 2.931 1.928 1.00 10.00 O ATOM 514 CB PRO A 35 -13.096 5.276 1.583 1.00 10.00 C ATOM 515 CG PRO A 35 -11.684 5.749 1.235 1.00 10.00 C ATOM 516 CD PRO A 35 -11.317 4.822 0.079 1.00 10.00 C ATOM 0 HA PRO A 35 -12.761 3.214 2.306 1.00 10.00 H new ATOM 0 HB2 PRO A 35 -13.843 5.722 0.927 1.00 10.00 H new ATOM 0 HB3 PRO A 35 -13.369 5.541 2.604 1.00 10.00 H new ATOM 0 HG2 PRO A 35 -11.666 6.798 0.939 1.00 10.00 H new ATOM 0 HG3 PRO A 35 -10.999 5.644 2.076 1.00 10.00 H new ATOM 0 HD2 PRO A 35 -11.692 5.205 -0.870 1.00 10.00 H new ATOM 0 HD3 PRO A 35 -10.236 4.724 -0.022 1.00 10.00 H new ATOM 524 N GLU A 36 -14.656 2.878 -0.247 1.00 10.00 N ATOM 525 CA GLU A 36 -15.825 2.120 -0.692 1.00 10.00 C ATOM 526 C GLU A 36 -15.530 0.613 -0.587 1.00 10.00 C ATOM 527 O GLU A 36 -16.300 -0.120 0.028 1.00 10.00 O ATOM 528 CB GLU A 36 -16.210 2.558 -2.117 1.00 10.00 C ATOM 529 CG GLU A 36 -17.696 2.358 -2.461 1.00 10.00 C ATOM 530 CD GLU A 36 -18.110 0.891 -2.594 1.00 10.00 C ATOM 531 OE1 GLU A 36 -17.386 0.134 -3.266 1.00 10.00 O ATOM 532 OE2 GLU A 36 -19.151 0.513 -2.007 1.00 10.00 O ATOM 0 H GLU A 36 -14.055 3.175 -1.016 1.00 10.00 H new ATOM 0 HA GLU A 36 -16.683 2.324 -0.052 1.00 10.00 H new ATOM 0 HB2 GLU A 36 -15.959 3.611 -2.241 1.00 10.00 H new ATOM 0 HB3 GLU A 36 -15.605 2.000 -2.832 1.00 10.00 H new ATOM 0 HG2 GLU A 36 -18.304 2.828 -1.688 1.00 10.00 H new ATOM 0 HG3 GLU A 36 -17.915 2.873 -3.396 1.00 10.00 H new ATOM 539 N LEU A 37 -14.353 0.157 -1.051 1.00 10.00 N ATOM 540 CA LEU A 37 -13.889 -1.232 -0.925 1.00 10.00 C ATOM 541 C LEU A 37 -13.898 -1.746 0.534 1.00 10.00 C ATOM 542 O LEU A 37 -14.069 -2.945 0.771 1.00 10.00 O ATOM 543 CB LEU A 37 -12.486 -1.387 -1.543 1.00 10.00 C ATOM 544 CG LEU A 37 -12.387 -1.045 -3.039 1.00 10.00 C ATOM 545 CD1 LEU A 37 -10.936 -1.214 -3.500 1.00 10.00 C ATOM 546 CD2 LEU A 37 -13.283 -1.923 -3.912 1.00 10.00 C ATOM 0 H LEU A 37 -13.685 0.758 -1.534 1.00 10.00 H new ATOM 0 HA LEU A 37 -14.599 -1.849 -1.475 1.00 10.00 H new ATOM 0 HB2 LEU A 37 -11.793 -0.749 -0.994 1.00 10.00 H new ATOM 0 HB3 LEU A 37 -12.155 -2.416 -1.399 1.00 10.00 H new ATOM 0 HG LEU A 37 -12.724 -0.015 -3.153 1.00 10.00 H new ATOM 0 HD11 LEU A 37 -10.861 -0.973 -4.560 1.00 10.00 H new ATOM 0 HD12 LEU A 37 -10.292 -0.545 -2.929 1.00 10.00 H new ATOM 0 HD13 LEU A 37 -10.621 -2.245 -3.339 1.00 10.00 H new ATOM 0 HD21 LEU A 37 -13.169 -1.634 -4.957 1.00 10.00 H new ATOM 0 HD22 LEU A 37 -12.997 -2.968 -3.792 1.00 10.00 H new ATOM 0 HD23 LEU A 37 -14.323 -1.794 -3.611 1.00 10.00 H new ATOM 558 N VAL A 38 -13.757 -0.844 1.515 1.00 10.00 N ATOM 559 CA VAL A 38 -13.954 -1.106 2.956 1.00 10.00 C ATOM 560 C VAL A 38 -15.356 -1.670 3.219 1.00 10.00 C ATOM 561 O VAL A 38 -15.470 -2.797 3.677 1.00 10.00 O ATOM 562 CB VAL A 38 -13.706 0.188 3.761 1.00 10.00 C ATOM 563 CG1 VAL A 38 -14.084 0.125 5.248 1.00 10.00 C ATOM 564 CG2 VAL A 38 -12.223 0.548 3.706 1.00 10.00 C ATOM 0 H VAL A 38 -13.494 0.123 1.325 1.00 10.00 H new ATOM 0 HA VAL A 38 -13.235 -1.857 3.283 1.00 10.00 H new ATOM 0 HB VAL A 38 -14.354 0.927 3.289 1.00 10.00 H new ATOM 0 HG11 VAL A 38 -13.870 1.084 5.719 1.00 10.00 H new ATOM 0 HG12 VAL A 38 -15.147 -0.097 5.344 1.00 10.00 H new ATOM 0 HG13 VAL A 38 -13.504 -0.657 5.738 1.00 10.00 H new ATOM 0 HG21 VAL A 38 -12.049 1.462 4.275 1.00 10.00 H new ATOM 0 HG22 VAL A 38 -11.635 -0.264 4.135 1.00 10.00 H new ATOM 0 HG23 VAL A 38 -11.925 0.703 2.669 1.00 10.00 H new ATOM 765 N SER B 51 12.805 -9.163 -9.298 1.00 10.00 N ATOM 766 CA SER B 51 11.992 -8.355 -8.410 1.00 10.00 C ATOM 767 C SER B 51 11.455 -7.247 -9.323 1.00 10.00 C ATOM 768 O SER B 51 12.188 -6.719 -10.169 1.00 10.00 O ATOM 769 CB SER B 51 12.777 -7.805 -7.199 1.00 10.00 C ATOM 770 OG SER B 51 14.173 -7.990 -7.303 1.00 10.00 O ATOM 0 HA SER B 51 11.196 -8.933 -7.940 1.00 10.00 H new ATOM 0 HB2 SER B 51 12.566 -6.741 -7.092 1.00 10.00 H new ATOM 0 HB3 SER B 51 12.420 -8.293 -6.292 1.00 10.00 H new ATOM 0 HG SER B 51 14.368 -8.602 -8.044 1.00 10.00 H new ATOM 776 N ILE B 52 10.179 -6.903 -9.169 1.00 10.00 N ATOM 777 CA ILE B 52 9.464 -5.992 -10.076 1.00 10.00 C ATOM 778 C ILE B 52 9.590 -4.531 -9.591 1.00 10.00 C ATOM 779 O ILE B 52 9.612 -3.598 -10.388 1.00 10.00 O ATOM 780 CB ILE B 52 7.974 -6.419 -10.228 1.00 10.00 C ATOM 781 CG1 ILE B 52 7.770 -7.950 -10.391 1.00 10.00 C ATOM 782 CG2 ILE B 52 7.394 -5.716 -11.468 1.00 10.00 C ATOM 783 CD1 ILE B 52 7.701 -8.751 -9.076 1.00 10.00 C ATOM 0 H ILE B 52 9.601 -7.250 -8.404 1.00 10.00 H new ATOM 0 HA ILE B 52 9.925 -6.054 -11.062 1.00 10.00 H new ATOM 0 HB ILE B 52 7.466 -6.131 -9.308 1.00 10.00 H new ATOM 0 HG12 ILE B 52 6.849 -8.119 -10.949 1.00 10.00 H new ATOM 0 HG13 ILE B 52 8.586 -8.346 -10.996 1.00 10.00 H new ATOM 0 HG21 ILE B 52 6.350 -6.002 -11.593 1.00 10.00 H new ATOM 0 HG22 ILE B 52 7.462 -4.636 -11.339 1.00 10.00 H new ATOM 0 HG23 ILE B 52 7.959 -6.012 -12.352 1.00 10.00 H new ATOM 0 HD11 ILE B 52 7.557 -9.808 -9.301 1.00 10.00 H new ATOM 0 HD12 ILE B 52 8.631 -8.621 -8.522 1.00 10.00 H new ATOM 0 HD13 ILE B 52 6.866 -8.391 -8.474 1.00 10.00 H new ATOM 795 N SER B 53 9.771 -4.339 -8.283 1.00 10.00 N ATOM 796 CA SER B 53 9.909 -3.054 -7.574 1.00 10.00 C ATOM 797 C SER B 53 11.346 -2.620 -7.174 1.00 10.00 C ATOM 798 O SER B 53 11.426 -1.669 -6.411 1.00 10.00 O ATOM 799 CB SER B 53 8.982 -3.104 -6.346 1.00 10.00 C ATOM 800 OG SER B 53 8.936 -4.396 -5.744 1.00 10.00 O ATOM 0 H SER B 53 9.830 -5.130 -7.641 1.00 10.00 H new ATOM 0 HA SER B 53 9.625 -2.279 -8.286 1.00 10.00 H new ATOM 0 HB2 SER B 53 9.322 -2.376 -5.609 1.00 10.00 H new ATOM 0 HB3 SER B 53 7.975 -2.810 -6.643 1.00 10.00 H new ATOM 0 HG SER B 53 8.336 -4.375 -4.969 1.00 10.00 H new ATOM 806 N PRO B 54 12.488 -3.192 -7.623 1.00 10.00 N ATOM 807 CA PRO B 54 13.830 -2.875 -7.102 1.00 10.00 C ATOM 808 C PRO B 54 14.296 -1.459 -7.459 1.00 10.00 C ATOM 809 O PRO B 54 15.291 -0.996 -6.909 1.00 10.00 O ATOM 810 CB PRO B 54 14.760 -3.942 -7.662 1.00 10.00 C ATOM 811 CG PRO B 54 14.124 -4.249 -9.012 1.00 10.00 C ATOM 812 CD PRO B 54 12.639 -4.155 -8.683 1.00 10.00 C ATOM 0 HA PRO B 54 13.825 -2.884 -6.012 1.00 10.00 H new ATOM 0 HB2 PRO B 54 15.782 -3.577 -7.767 1.00 10.00 H new ATOM 0 HB3 PRO B 54 14.801 -4.823 -7.022 1.00 10.00 H new ATOM 0 HG2 PRO B 54 14.420 -3.531 -9.777 1.00 10.00 H new ATOM 0 HG3 PRO B 54 14.400 -5.237 -9.379 1.00 10.00 H new ATOM 0 HD2 PRO B 54 12.071 -3.850 -9.562 1.00 10.00 H new ATOM 0 HD3 PRO B 54 12.253 -5.127 -8.375 1.00 10.00 H new ATOM 820 N SER B 55 13.622 -0.775 -8.386 1.00 10.00 N ATOM 821 CA SER B 55 13.780 0.649 -8.689 1.00 10.00 C ATOM 822 C SER B 55 12.896 1.507 -7.773 1.00 10.00 C ATOM 823 O SER B 55 13.385 2.435 -7.132 1.00 10.00 O ATOM 824 CB SER B 55 13.392 0.871 -10.152 1.00 10.00 C ATOM 825 OG SER B 55 12.153 0.238 -10.461 1.00 10.00 O ATOM 0 H SER B 55 12.917 -1.220 -8.974 1.00 10.00 H new ATOM 0 HA SER B 55 14.815 0.945 -8.520 1.00 10.00 H new ATOM 0 HB2 SER B 55 13.317 1.940 -10.352 1.00 10.00 H new ATOM 0 HB3 SER B 55 14.175 0.479 -10.802 1.00 10.00 H new ATOM 0 HG SER B 55 11.930 0.398 -11.402 1.00 10.00 H new ATOM 831 N ALA B 56 11.608 1.152 -7.661 1.00 10.00 N ATOM 832 CA ALA B 56 10.645 1.704 -6.707 1.00 10.00 C ATOM 833 C ALA B 56 11.115 1.539 -5.249 1.00 10.00 C ATOM 834 O ALA B 56 10.752 2.319 -4.368 1.00 10.00 O ATOM 835 CB ALA B 56 9.298 1.014 -6.939 1.00 10.00 C ATOM 0 H ALA B 56 11.194 0.439 -8.262 1.00 10.00 H new ATOM 0 HA ALA B 56 10.549 2.777 -6.871 1.00 10.00 H new ATOM 0 HB1 ALA B 56 8.562 1.409 -6.239 1.00 10.00 H new ATOM 0 HB2 ALA B 56 8.965 1.201 -7.960 1.00 10.00 H new ATOM 0 HB3 ALA B 56 9.407 -0.059 -6.784 1.00 10.00 H new ATOM 841 N LEU B 57 11.970 0.557 -4.966 1.00 10.00 N ATOM 842 CA LEU B 57 12.683 0.386 -3.701 1.00 10.00 C ATOM 843 C LEU B 57 13.471 1.648 -3.337 1.00 10.00 C ATOM 844 O LEU B 57 13.640 1.916 -2.158 1.00 10.00 O ATOM 845 CB LEU B 57 13.596 -0.851 -3.832 1.00 10.00 C ATOM 846 CG LEU B 57 14.599 -1.099 -2.692 1.00 10.00 C ATOM 847 CD1 LEU B 57 13.912 -1.374 -1.356 1.00 10.00 C ATOM 848 CD2 LEU B 57 15.456 -2.303 -3.084 1.00 10.00 C ATOM 0 H LEU B 57 12.194 -0.173 -5.642 1.00 10.00 H new ATOM 0 HA LEU B 57 11.976 0.227 -2.887 1.00 10.00 H new ATOM 0 HB2 LEU B 57 12.962 -1.733 -3.924 1.00 10.00 H new ATOM 0 HB3 LEU B 57 14.156 -0.763 -4.763 1.00 10.00 H new ATOM 0 HG LEU B 57 15.202 -0.201 -2.556 1.00 10.00 H new ATOM 0 HD11 LEU B 57 14.666 -1.542 -0.587 1.00 10.00 H new ATOM 0 HD12 LEU B 57 13.297 -0.518 -1.080 1.00 10.00 H new ATOM 0 HD13 LEU B 57 13.282 -2.259 -1.446 1.00 10.00 H new ATOM 0 HD21 LEU B 57 16.180 -2.507 -2.295 1.00 10.00 H new ATOM 0 HD22 LEU B 57 14.817 -3.175 -3.224 1.00 10.00 H new ATOM 0 HD23 LEU B 57 15.983 -2.087 -4.013 1.00 10.00 H new ATOM 860 N GLN B 58 13.938 2.418 -4.328 1.00 10.00 N ATOM 861 CA GLN B 58 14.489 3.741 -4.104 1.00 10.00 C ATOM 862 C GLN B 58 13.356 4.767 -4.224 1.00 10.00 C ATOM 863 O GLN B 58 13.068 5.482 -3.267 1.00 10.00 O ATOM 864 CB GLN B 58 15.634 4.054 -5.089 1.00 10.00 C ATOM 865 CG GLN B 58 16.905 3.226 -4.820 1.00 10.00 C ATOM 866 CD GLN B 58 16.754 1.738 -5.144 1.00 10.00 C ATOM 867 OE1 GLN B 58 16.940 0.873 -4.299 1.00 10.00 O ATOM 868 NE2 GLN B 58 16.408 1.414 -6.372 1.00 10.00 N ATOM 0 H GLN B 58 13.940 2.131 -5.307 1.00 10.00 H new ATOM 0 HA GLN B 58 14.921 3.787 -3.104 1.00 10.00 H new ATOM 0 HB2 GLN B 58 15.292 3.864 -6.106 1.00 10.00 H new ATOM 0 HB3 GLN B 58 15.879 5.114 -5.028 1.00 10.00 H new ATOM 0 HG2 GLN B 58 17.725 3.635 -5.410 1.00 10.00 H new ATOM 0 HG3 GLN B 58 17.182 3.333 -3.771 1.00 10.00 H new ATOM 0 HE21 GLN B 58 16.256 2.144 -7.068 1.00 10.00 H new ATOM 0 HE22 GLN B 58 16.292 0.433 -6.627 1.00 10.00 H new ATOM 877 N ASP B 59 12.679 4.824 -5.384 1.00 10.00 N ATOM 878 CA ASP B 59 11.760 5.927 -5.685 1.00 10.00 C ATOM 879 C ASP B 59 10.364 5.912 -5.043 1.00 10.00 C ATOM 880 O ASP B 59 9.897 6.980 -4.649 1.00 10.00 O ATOM 881 CB ASP B 59 11.670 6.185 -7.189 1.00 10.00 C ATOM 882 CG ASP B 59 11.651 7.702 -7.423 1.00 10.00 C ATOM 883 OD1 ASP B 59 12.630 8.369 -7.013 1.00 10.00 O ATOM 884 OD2 ASP B 59 10.609 8.237 -7.873 1.00 10.00 O ATOM 0 H ASP B 59 12.752 4.123 -6.121 1.00 10.00 H new ATOM 0 HA ASP B 59 12.240 6.763 -5.176 1.00 10.00 H new ATOM 0 HB2 ASP B 59 12.519 5.733 -7.702 1.00 10.00 H new ATOM 0 HB3 ASP B 59 10.770 5.727 -7.599 1.00 10.00 H new ATOM 889 N LEU B 60 9.691 4.761 -4.889 1.00 10.00 N ATOM 890 CA LEU B 60 8.413 4.718 -4.157 1.00 10.00 C ATOM 891 C LEU B 60 8.659 4.799 -2.641 1.00 10.00 C ATOM 892 O LEU B 60 7.908 5.446 -1.918 1.00 10.00 O ATOM 893 CB LEU B 60 7.642 3.465 -4.550 1.00 10.00 C ATOM 894 CG LEU B 60 6.219 3.360 -3.962 1.00 10.00 C ATOM 895 CD1 LEU B 60 5.369 4.640 -4.049 1.00 10.00 C ATOM 896 CD2 LEU B 60 5.487 2.273 -4.746 1.00 10.00 C ATOM 0 H LEU B 60 10.003 3.861 -5.254 1.00 10.00 H new ATOM 0 HA LEU B 60 7.805 5.582 -4.426 1.00 10.00 H new ATOM 0 HB2 LEU B 60 7.573 3.426 -5.637 1.00 10.00 H new ATOM 0 HB3 LEU B 60 8.214 2.592 -4.235 1.00 10.00 H new ATOM 0 HG LEU B 60 6.341 3.150 -2.899 1.00 10.00 H new ATOM 0 HD11 LEU B 60 4.389 4.457 -3.608 1.00 10.00 H new ATOM 0 HD12 LEU B 60 5.866 5.444 -3.507 1.00 10.00 H new ATOM 0 HD13 LEU B 60 5.249 4.927 -5.094 1.00 10.00 H new ATOM 0 HD21 LEU B 60 4.473 2.166 -4.360 1.00 10.00 H new ATOM 0 HD22 LEU B 60 5.447 2.549 -5.800 1.00 10.00 H new ATOM 0 HD23 LEU B 60 6.017 1.327 -4.638 1.00 10.00 H new ATOM 908 N LEU B 61 9.772 4.208 -2.192 1.00 10.00 N ATOM 909 CA LEU B 61 10.265 4.332 -0.827 1.00 10.00 C ATOM 910 C LEU B 61 10.523 5.807 -0.489 1.00 10.00 C ATOM 911 O LEU B 61 9.856 6.329 0.403 1.00 10.00 O ATOM 912 CB LEU B 61 11.488 3.419 -0.655 1.00 10.00 C ATOM 913 CG LEU B 61 11.919 3.170 0.806 1.00 10.00 C ATOM 914 CD1 LEU B 61 10.870 2.352 1.563 1.00 10.00 C ATOM 915 CD2 LEU B 61 13.223 2.380 0.888 1.00 10.00 C ATOM 0 H LEU B 61 10.362 3.621 -2.782 1.00 10.00 H new ATOM 0 HA LEU B 61 9.519 3.997 -0.106 1.00 10.00 H new ATOM 0 HB2 LEU B 61 11.273 2.458 -1.123 1.00 10.00 H new ATOM 0 HB3 LEU B 61 12.327 3.856 -1.196 1.00 10.00 H new ATOM 0 HG LEU B 61 12.042 4.159 1.248 1.00 10.00 H new ATOM 0 HD11 LEU B 61 11.203 2.194 2.589 1.00 10.00 H new ATOM 0 HD12 LEU B 61 9.923 2.891 1.568 1.00 10.00 H new ATOM 0 HD13 LEU B 61 10.736 1.388 1.072 1.00 10.00 H new ATOM 0 HD21 LEU B 61 13.490 2.227 1.934 1.00 10.00 H new ATOM 0 HD22 LEU B 61 13.094 1.413 0.401 1.00 10.00 H new ATOM 0 HD23 LEU B 61 14.017 2.935 0.388 1.00 10.00 H new ATOM 927 N ARG B 62 11.405 6.516 -1.216 1.00 10.00 N ATOM 928 CA ARG B 62 11.626 7.950 -0.986 1.00 10.00 C ATOM 929 C ARG B 62 10.365 8.791 -1.256 1.00 10.00 C ATOM 930 O ARG B 62 10.201 9.805 -0.583 1.00 10.00 O ATOM 931 CB ARG B 62 12.890 8.461 -1.717 1.00 10.00 C ATOM 932 CG ARG B 62 12.771 8.579 -3.245 1.00 10.00 C ATOM 933 CD ARG B 62 12.666 10.023 -3.751 1.00 10.00 C ATOM 934 NE ARG B 62 11.899 10.073 -5.012 1.00 10.00 N ATOM 935 CZ ARG B 62 10.674 10.547 -5.182 1.00 10.00 C ATOM 936 NH1 ARG B 62 10.090 11.273 -4.255 1.00 10.00 N ATOM 937 NH2 ARG B 62 9.989 10.276 -6.265 1.00 10.00 N ATOM 0 H ARG B 62 11.973 6.119 -1.964 1.00 10.00 H new ATOM 0 HA ARG B 62 11.827 8.082 0.077 1.00 10.00 H new ATOM 0 HB2 ARG B 62 13.150 9.440 -1.314 1.00 10.00 H new ATOM 0 HB3 ARG B 62 13.718 7.791 -1.486 1.00 10.00 H new ATOM 0 HG2 ARG B 62 13.639 8.106 -3.705 1.00 10.00 H new ATOM 0 HG3 ARG B 62 11.893 8.024 -3.575 1.00 10.00 H new ATOM 0 HD2 ARG B 62 12.181 10.644 -2.998 1.00 10.00 H new ATOM 0 HD3 ARG B 62 13.664 10.433 -3.908 1.00 10.00 H new ATOM 0 HE ARG B 62 12.363 9.703 -5.842 1.00 10.00 H new ATOM 0 HH11 ARG B 62 10.581 11.481 -3.385 1.00 10.00 H new ATOM 0 HH12 ARG B 62 9.146 11.629 -4.405 1.00 10.00 H new ATOM 0 HH21 ARG B 62 10.398 9.691 -6.994 1.00 10.00 H new ATOM 0 HH22 ARG B 62 9.047 10.650 -6.379 1.00 10.00 H new ATOM 951 N THR B 63 9.450 8.357 -2.139 1.00 10.00 N ATOM 952 CA THR B 63 8.131 8.989 -2.372 1.00 10.00 C ATOM 953 C THR B 63 7.194 8.978 -1.168 1.00 10.00 C ATOM 954 O THR B 63 6.308 9.834 -1.108 1.00 10.00 O ATOM 955 CB THR B 63 7.420 8.365 -3.588 1.00 10.00 C ATOM 956 OG1 THR B 63 8.093 8.775 -4.749 1.00 10.00 O ATOM 957 CG2 THR B 63 5.945 8.704 -3.790 1.00 10.00 C ATOM 0 H THR B 63 9.606 7.538 -2.727 1.00 10.00 H new ATOM 0 HA THR B 63 8.362 10.036 -2.568 1.00 10.00 H new ATOM 0 HB THR B 63 7.449 7.294 -3.389 1.00 10.00 H new ATOM 0 HG1 THR B 63 8.882 8.210 -4.887 1.00 10.00 H new ATOM 0 HG21 THR B 63 5.574 8.198 -4.681 1.00 10.00 H new ATOM 0 HG22 THR B 63 5.374 8.375 -2.922 1.00 10.00 H new ATOM 0 HG23 THR B 63 5.833 9.781 -3.912 1.00 10.00 H new ATOM 965 N LEU B 64 7.394 8.084 -0.191 1.00 10.00 N ATOM 966 CA LEU B 64 6.635 8.143 1.063 1.00 10.00 C ATOM 967 C LEU B 64 7.504 8.381 2.301 1.00 10.00 C ATOM 968 O LEU B 64 6.989 8.896 3.294 1.00 10.00 O ATOM 969 CB LEU B 64 5.718 6.917 1.197 1.00 10.00 C ATOM 970 CG LEU B 64 4.256 7.342 1.456 1.00 10.00 C ATOM 971 CD1 LEU B 64 3.522 7.619 0.132 1.00 10.00 C ATOM 972 CD2 LEU B 64 3.546 6.236 2.246 1.00 10.00 C ATOM 0 H LEU B 64 8.067 7.320 -0.244 1.00 10.00 H new ATOM 0 HA LEU B 64 6.002 9.028 1.010 1.00 10.00 H new ATOM 0 HB2 LEU B 64 5.770 6.319 0.287 1.00 10.00 H new ATOM 0 HB3 LEU B 64 6.067 6.286 2.014 1.00 10.00 H new ATOM 0 HG LEU B 64 4.248 8.265 2.036 1.00 10.00 H new ATOM 0 HD11 LEU B 64 2.494 7.917 0.341 1.00 10.00 H new ATOM 0 HD12 LEU B 64 4.030 8.420 -0.405 1.00 10.00 H new ATOM 0 HD13 LEU B 64 3.521 6.717 -0.479 1.00 10.00 H new ATOM 0 HD21 LEU B 64 2.513 6.528 2.433 1.00 10.00 H new ATOM 0 HD22 LEU B 64 3.563 5.310 1.671 1.00 10.00 H new ATOM 0 HD23 LEU B 64 4.057 6.082 3.196 1.00 10.00 H new ATOM 984 N LYS B 65 8.812 8.073 2.247 1.00 10.00 N ATOM 985 CA LYS B 65 9.773 8.478 3.271 1.00 10.00 C ATOM 986 C LYS B 65 9.846 10.004 3.282 1.00 10.00 C ATOM 987 O LYS B 65 9.939 10.586 4.359 1.00 10.00 O ATOM 988 CB LYS B 65 11.148 7.820 3.096 1.00 10.00 C ATOM 989 CG LYS B 65 11.157 6.369 3.590 1.00 10.00 C ATOM 990 CD LYS B 65 12.585 5.816 3.677 1.00 10.00 C ATOM 991 CE LYS B 65 12.597 4.340 4.101 1.00 10.00 C ATOM 992 NZ LYS B 65 12.088 4.148 5.489 1.00 10.00 N ATOM 0 H LYS B 65 9.227 7.534 1.487 1.00 10.00 H new ATOM 0 HA LYS B 65 9.428 8.125 4.243 1.00 10.00 H new ATOM 0 HB2 LYS B 65 11.431 7.847 2.044 1.00 10.00 H new ATOM 0 HB3 LYS B 65 11.897 8.394 3.642 1.00 10.00 H new ATOM 0 HG2 LYS B 65 10.684 6.314 4.570 1.00 10.00 H new ATOM 0 HG3 LYS B 65 10.566 5.750 2.915 1.00 10.00 H new ATOM 0 HD2 LYS B 65 13.076 5.921 2.709 1.00 10.00 H new ATOM 0 HD3 LYS B 65 13.160 6.405 4.391 1.00 10.00 H new ATOM 0 HE2 LYS B 65 11.987 3.760 3.409 1.00 10.00 H new ATOM 0 HE3 LYS B 65 13.613 3.952 4.032 1.00 10.00 H new ATOM 0 HZ1 LYS B 65 12.209 3.154 5.769 1.00 10.00 H new ATOM 0 HZ2 LYS B 65 12.620 4.758 6.141 1.00 10.00 H new ATOM 0 HZ3 LYS B 65 11.079 4.398 5.526 1.00 10.00 H new ATOM 1006 N SER B 66 9.848 10.659 2.105 1.00 10.00 N ATOM 1007 CA SER B 66 9.633 12.112 2.027 1.00 10.00 C ATOM 1008 C SER B 66 8.099 12.241 2.133 1.00 10.00 C ATOM 1009 O SER B 66 7.411 11.723 1.254 1.00 10.00 O ATOM 1010 CB SER B 66 10.228 12.774 0.775 1.00 10.00 C ATOM 1011 OG SER B 66 9.788 12.272 -0.459 1.00 10.00 O ATOM 0 H SER B 66 9.995 10.207 1.203 1.00 10.00 H new ATOM 0 HA SER B 66 10.157 12.651 2.816 1.00 10.00 H new ATOM 0 HB2 SER B 66 10.003 13.840 0.811 1.00 10.00 H new ATOM 0 HB3 SER B 66 11.313 12.676 0.818 1.00 10.00 H new ATOM 0 HG SER B 66 9.577 11.319 -0.368 1.00 10.00 H new ATOM 1017 N PRO B 67 7.535 12.797 3.223 1.00 10.00 N ATOM 1018 CA PRO B 67 6.102 12.719 3.489 1.00 10.00 C ATOM 1019 C PRO B 67 5.166 13.159 2.369 1.00 10.00 C ATOM 1020 O PRO B 67 5.446 14.109 1.641 1.00 10.00 O ATOM 1021 CB PRO B 67 5.866 13.543 4.763 1.00 10.00 C ATOM 1022 CG PRO B 67 7.203 13.468 5.483 1.00 10.00 C ATOM 1023 CD PRO B 67 8.206 13.450 4.338 1.00 10.00 C ATOM 0 HA PRO B 67 5.845 11.665 3.594 1.00 10.00 H new ATOM 0 HB2 PRO B 67 5.592 14.572 4.531 1.00 10.00 H new ATOM 0 HB3 PRO B 67 5.060 13.127 5.367 1.00 10.00 H new ATOM 0 HG2 PRO B 67 7.356 14.324 6.141 1.00 10.00 H new ATOM 0 HG3 PRO B 67 7.279 12.573 6.101 1.00 10.00 H new ATOM 0 HD2 PRO B 67 8.511 14.462 4.071 1.00 10.00 H new ATOM 0 HD3 PRO B 67 9.109 12.909 4.620 1.00 10.00 H new ATOM 1031 N SER B 68 3.975 12.550 2.352 1.00 10.00 N ATOM 1032 CA SER B 68 2.846 12.855 1.467 1.00 10.00 C ATOM 1033 C SER B 68 2.257 14.272 1.594 1.00 10.00 C ATOM 1034 O SER B 68 1.080 14.455 1.298 1.00 10.00 O ATOM 1035 CB SER B 68 1.744 11.796 1.618 1.00 10.00 C ATOM 1036 OG SER B 68 2.266 10.501 1.393 1.00 10.00 O ATOM 0 H SER B 68 3.761 11.786 2.993 1.00 10.00 H new ATOM 0 HA SER B 68 3.269 12.826 0.463 1.00 10.00 H new ATOM 0 HB2 SER B 68 1.313 11.852 2.617 1.00 10.00 H new ATOM 0 HB3 SER B 68 0.939 11.998 0.912 1.00 10.00 H new ATOM 0 HG SER B 68 1.551 9.838 1.495 1.00 10.00 H new ATOM 1042 N SER B 69 3.018 15.259 2.079 1.00 10.00 N ATOM 1043 CA SER B 69 2.674 16.685 2.027 1.00 10.00 C ATOM 1044 C SER B 69 3.244 17.258 0.711 1.00 10.00 C ATOM 1045 O SER B 69 2.454 17.522 -0.193 1.00 10.00 O ATOM 1046 CB SER B 69 3.068 17.412 3.320 1.00 10.00 C ATOM 1047 OG SER B 69 2.891 18.808 3.169 1.00 10.00 O ATOM 0 H SER B 69 3.915 15.084 2.531 1.00 10.00 H new ATOM 0 HA SER B 69 1.596 16.844 1.995 1.00 10.00 H new ATOM 0 HB2 SER B 69 2.461 17.049 4.149 1.00 10.00 H new ATOM 0 HB3 SER B 69 4.107 17.194 3.566 1.00 10.00 H new ATOM 0 HG SER B 69 3.144 19.262 4.000 1.00 10.00 H new ATOM 1053 N PRO B 70 4.580 17.373 0.506 1.00 10.00 N ATOM 1054 CA PRO B 70 5.125 17.685 -0.815 1.00 10.00 C ATOM 1055 C PRO B 70 4.942 16.492 -1.765 1.00 10.00 C ATOM 1056 O PRO B 70 4.902 16.666 -2.983 1.00 10.00 O ATOM 1057 CB PRO B 70 6.601 18.009 -0.585 1.00 10.00 C ATOM 1058 CG PRO B 70 6.955 17.235 0.685 1.00 10.00 C ATOM 1059 CD PRO B 70 5.661 17.328 1.492 1.00 10.00 C ATOM 0 HA PRO B 70 4.613 18.525 -1.285 1.00 10.00 H new ATOM 0 HB2 PRO B 70 7.215 17.694 -1.429 1.00 10.00 H new ATOM 0 HB3 PRO B 70 6.760 19.080 -0.457 1.00 10.00 H new ATOM 0 HG2 PRO B 70 7.227 16.202 0.469 1.00 10.00 H new ATOM 0 HG3 PRO B 70 7.797 17.683 1.213 1.00 10.00 H new ATOM 0 HD2 PRO B 70 5.551 16.470 2.155 1.00 10.00 H new ATOM 0 HD3 PRO B 70 5.655 18.219 2.120 1.00 10.00 H new ATOM 1067 N GLN B 71 4.843 15.264 -1.230 1.00 10.00 N ATOM 1068 CA GLN B 71 4.461 14.048 -1.944 1.00 10.00 C ATOM 1069 C GLN B 71 2.942 13.748 -1.941 1.00 10.00 C ATOM 1070 O GLN B 71 2.559 12.580 -2.046 1.00 10.00 O ATOM 1071 CB GLN B 71 5.349 12.888 -1.459 1.00 10.00 C ATOM 1072 CG GLN B 71 6.841 13.107 -1.745 1.00 10.00 C ATOM 1073 CD GLN B 71 7.176 13.243 -3.236 1.00 10.00 C ATOM 1074 OE1 GLN B 71 7.596 12.305 -3.902 1.00 10.00 O ATOM 1075 NE2 GLN B 71 7.034 14.416 -3.827 1.00 10.00 N ATOM 0 H GLN B 71 5.037 15.091 -0.244 1.00 10.00 H new ATOM 0 HA GLN B 71 4.649 14.200 -3.007 1.00 10.00 H new ATOM 0 HB2 GLN B 71 5.207 12.755 -0.387 1.00 10.00 H new ATOM 0 HB3 GLN B 71 5.025 11.965 -1.941 1.00 10.00 H new ATOM 0 HG2 GLN B 71 7.172 14.006 -1.225 1.00 10.00 H new ATOM 0 HG3 GLN B 71 7.406 12.272 -1.331 1.00 10.00 H new ATOM 0 HE21 GLN B 71 6.686 15.215 -3.297 1.00 10.00 H new ATOM 0 HE22 GLN B 71 7.272 14.522 -4.813 1.00 10.00 H new ATOM 1084 N GLN B 72 2.064 14.754 -1.777 1.00 10.00 N ATOM 1085 CA GLN B 72 0.599 14.528 -1.748 1.00 10.00 C ATOM 1086 C GLN B 72 -0.010 14.011 -3.060 1.00 10.00 C ATOM 1087 O GLN B 72 -1.116 13.473 -3.041 1.00 10.00 O ATOM 1088 CB GLN B 72 -0.134 15.818 -1.313 1.00 10.00 C ATOM 1089 CG GLN B 72 0.008 16.981 -2.309 1.00 10.00 C ATOM 1090 CD GLN B 72 -0.544 18.287 -1.743 1.00 10.00 C ATOM 1091 OE1 GLN B 72 -1.638 18.723 -2.059 1.00 10.00 O ATOM 1092 NE2 GLN B 72 0.199 18.936 -0.874 1.00 10.00 N ATOM 0 H GLN B 72 2.338 15.730 -1.662 1.00 10.00 H new ATOM 0 HA GLN B 72 0.455 13.729 -1.020 1.00 10.00 H new ATOM 0 HB2 GLN B 72 -1.192 15.595 -1.178 1.00 10.00 H new ATOM 0 HB3 GLN B 72 0.251 16.134 -0.343 1.00 10.00 H new ATOM 0 HG2 GLN B 72 1.059 17.112 -2.566 1.00 10.00 H new ATOM 0 HG3 GLN B 72 -0.517 16.735 -3.232 1.00 10.00 H new ATOM 0 HE21 GLN B 72 1.114 18.570 -0.611 1.00 10.00 H new ATOM 0 HE22 GLN B 72 -0.139 19.806 -0.463 1.00 10.00 H new ATOM 1101 N GLN B 73 0.682 14.192 -4.184 1.00 10.00 N ATOM 1102 CA GLN B 73 0.152 13.938 -5.525 1.00 10.00 C ATOM 1103 C GLN B 73 0.172 12.450 -5.908 1.00 10.00 C ATOM 1104 O GLN B 73 0.831 11.609 -5.300 1.00 10.00 O ATOM 1105 CB GLN B 73 0.916 14.754 -6.585 1.00 10.00 C ATOM 1106 CG GLN B 73 1.047 16.268 -6.324 1.00 10.00 C ATOM 1107 CD GLN B 73 2.108 16.715 -5.309 1.00 10.00 C ATOM 1108 OE1 GLN B 73 2.097 17.843 -4.839 1.00 10.00 O ATOM 1109 NE2 GLN B 73 3.063 15.893 -4.914 1.00 10.00 N ATOM 0 H GLN B 73 1.646 14.526 -4.189 1.00 10.00 H new ATOM 0 HA GLN B 73 -0.890 14.255 -5.499 1.00 10.00 H new ATOM 0 HB2 GLN B 73 1.918 14.336 -6.680 1.00 10.00 H new ATOM 0 HB3 GLN B 73 0.420 14.615 -7.546 1.00 10.00 H new ATOM 0 HG2 GLN B 73 1.261 16.757 -7.274 1.00 10.00 H new ATOM 0 HG3 GLN B 73 0.079 16.638 -5.986 1.00 10.00 H new ATOM 0 HE21 GLN B 73 3.104 14.944 -5.285 1.00 10.00 H new ATOM 0 HE22 GLN B 73 3.759 16.207 -4.238 1.00 10.00 H new ATOM 1118 N GLN B 74 -0.437 12.158 -7.057 1.00 10.00 N ATOM 1119 CA GLN B 74 -0.433 10.890 -7.801 1.00 10.00 C ATOM 1120 C GLN B 74 0.978 10.362 -8.158 1.00 10.00 C ATOM 1121 O GLN B 74 1.072 9.296 -8.757 1.00 10.00 O ATOM 1122 CB GLN B 74 -1.293 11.064 -9.075 1.00 10.00 C ATOM 1123 CG GLN B 74 -2.813 11.146 -8.840 1.00 10.00 C ATOM 1124 CD GLN B 74 -3.302 12.392 -8.084 1.00 10.00 C ATOM 1125 OE1 GLN B 74 -2.662 13.438 -8.083 1.00 10.00 O ATOM 1126 NE2 GLN B 74 -4.441 12.291 -7.428 1.00 10.00 N ATOM 0 H GLN B 74 -0.997 12.863 -7.537 1.00 10.00 H new ATOM 0 HA GLN B 74 -0.856 10.130 -7.144 1.00 10.00 H new ATOM 0 HB2 GLN B 74 -0.972 11.971 -9.588 1.00 10.00 H new ATOM 0 HB3 GLN B 74 -1.091 10.229 -9.746 1.00 10.00 H new ATOM 0 HG2 GLN B 74 -3.315 11.110 -9.807 1.00 10.00 H new ATOM 0 HG3 GLN B 74 -3.125 10.261 -8.286 1.00 10.00 H new ATOM 0 HE21 GLN B 74 -4.960 11.413 -7.440 1.00 10.00 H new ATOM 0 HE22 GLN B 74 -4.803 13.091 -6.909 1.00 10.00 H new ATOM 1135 N GLN B 75 2.077 11.028 -7.769 1.00 10.00 N ATOM 1136 CA GLN B 75 3.420 10.468 -7.899 1.00 10.00 C ATOM 1137 C GLN B 75 3.590 9.170 -7.100 1.00 10.00 C ATOM 1138 O GLN B 75 4.413 8.346 -7.491 1.00 10.00 O ATOM 1139 CB GLN B 75 4.524 11.510 -7.637 1.00 10.00 C ATOM 1140 CG GLN B 75 5.074 11.639 -6.204 1.00 10.00 C ATOM 1141 CD GLN B 75 4.050 12.095 -5.173 1.00 10.00 C ATOM 1142 OE1 GLN B 75 3.559 13.217 -5.215 1.00 10.00 O ATOM 1143 NE2 GLN B 75 3.737 11.257 -4.207 1.00 10.00 N ATOM 0 H GLN B 75 2.054 11.962 -7.359 1.00 10.00 H new ATOM 0 HA GLN B 75 3.543 10.182 -8.944 1.00 10.00 H new ATOM 0 HB2 GLN B 75 5.361 11.282 -8.296 1.00 10.00 H new ATOM 0 HB3 GLN B 75 4.140 12.485 -7.936 1.00 10.00 H new ATOM 0 HG2 GLN B 75 5.477 10.675 -5.895 1.00 10.00 H new ATOM 0 HG3 GLN B 75 5.905 12.345 -6.209 1.00 10.00 H new ATOM 0 HE21 GLN B 75 4.153 10.326 -4.185 1.00 10.00 H new ATOM 0 HE22 GLN B 75 3.078 11.539 -3.481 1.00 10.00 H new ATOM 1152 N VAL B 76 2.783 8.948 -6.048 1.00 10.00 N ATOM 1153 CA VAL B 76 2.738 7.639 -5.392 1.00 10.00 C ATOM 1154 C VAL B 76 2.124 6.664 -6.390 1.00 10.00 C ATOM 1155 O VAL B 76 2.721 5.643 -6.711 1.00 10.00 O ATOM 1156 CB VAL B 76 1.899 7.597 -4.089 1.00 10.00 C ATOM 1157 CG1 VAL B 76 2.310 6.395 -3.255 1.00 10.00 C ATOM 1158 CG2 VAL B 76 1.984 8.805 -3.166 1.00 10.00 C ATOM 0 H VAL B 76 2.163 9.649 -5.642 1.00 10.00 H new ATOM 0 HA VAL B 76 3.757 7.386 -5.100 1.00 10.00 H new ATOM 0 HB VAL B 76 0.875 7.562 -4.460 1.00 10.00 H new ATOM 0 HG11 VAL B 76 1.719 6.368 -2.340 1.00 10.00 H new ATOM 0 HG12 VAL B 76 2.139 5.481 -3.825 1.00 10.00 H new ATOM 0 HG13 VAL B 76 3.367 6.472 -3.002 1.00 10.00 H new ATOM 0 HG21 VAL B 76 1.349 8.643 -2.295 1.00 10.00 H new ATOM 0 HG22 VAL B 76 3.016 8.944 -2.843 1.00 10.00 H new ATOM 0 HG23 VAL B 76 1.648 9.694 -3.699 1.00 10.00 H new ATOM 1168 N LEU B 77 0.931 7.005 -6.885 1.00 10.00 N ATOM 1169 CA LEU B 77 0.085 6.174 -7.733 1.00 10.00 C ATOM 1170 C LEU B 77 0.794 5.774 -9.043 1.00 10.00 C ATOM 1171 O LEU B 77 0.669 4.642 -9.522 1.00 10.00 O ATOM 1172 CB LEU B 77 -1.257 6.900 -7.972 1.00 10.00 C ATOM 1173 CG LEU B 77 -2.459 5.997 -7.628 1.00 10.00 C ATOM 1174 CD1 LEU B 77 -3.756 6.802 -7.596 1.00 10.00 C ATOM 1175 CD2 LEU B 77 -2.602 4.840 -8.620 1.00 10.00 C ATOM 0 H LEU B 77 0.512 7.915 -6.693 1.00 10.00 H new ATOM 0 HA LEU B 77 -0.121 5.233 -7.224 1.00 10.00 H new ATOM 0 HB2 LEU B 77 -1.295 7.805 -7.365 1.00 10.00 H new ATOM 0 HB3 LEU B 77 -1.322 7.212 -9.014 1.00 10.00 H new ATOM 0 HG LEU B 77 -2.269 5.582 -6.638 1.00 10.00 H new ATOM 0 HD11 LEU B 77 -4.588 6.142 -7.351 1.00 10.00 H new ATOM 0 HD12 LEU B 77 -3.680 7.585 -6.841 1.00 10.00 H new ATOM 0 HD13 LEU B 77 -3.927 7.255 -8.573 1.00 10.00 H new ATOM 0 HD21 LEU B 77 -3.460 4.227 -8.343 1.00 10.00 H new ATOM 0 HD22 LEU B 77 -2.749 5.238 -9.624 1.00 10.00 H new ATOM 0 HD23 LEU B 77 -1.699 4.230 -8.600 1.00 10.00 H new ATOM 1187 N ASN B 78 1.608 6.688 -9.577 1.00 10.00 N ATOM 1188 CA ASN B 78 2.428 6.474 -10.761 1.00 10.00 C ATOM 1189 C ASN B 78 3.603 5.508 -10.541 1.00 10.00 C ATOM 1190 O ASN B 78 3.978 4.830 -11.499 1.00 10.00 O ATOM 1191 CB ASN B 78 2.914 7.849 -11.270 1.00 10.00 C ATOM 1192 CG ASN B 78 3.480 7.794 -12.680 1.00 10.00 C ATOM 1193 OD1 ASN B 78 2.983 7.078 -13.542 1.00 10.00 O ATOM 1194 ND2 ASN B 78 4.544 8.529 -12.948 1.00 10.00 N ATOM 0 H ASN B 78 1.714 7.623 -9.182 1.00 10.00 H new ATOM 0 HA ASN B 78 1.809 5.984 -11.513 1.00 10.00 H new ATOM 0 HB2 ASN B 78 2.083 8.554 -11.245 1.00 10.00 H new ATOM 0 HB3 ASN B 78 3.677 8.232 -10.593 1.00 10.00 H new ATOM 0 HD21 ASN B 78 4.960 8.504 -13.879 1.00 10.00 H new ATOM 0 HD22 ASN B 78 4.950 9.122 -12.224 1.00 10.00 H new ATOM 1201 N ILE B 79 4.175 5.392 -9.339 1.00 10.00 N ATOM 1202 CA ILE B 79 5.192 4.358 -9.063 1.00 10.00 C ATOM 1203 C ILE B 79 4.536 3.062 -8.538 1.00 10.00 C ATOM 1204 O ILE B 79 4.943 1.969 -8.937 1.00 10.00 O ATOM 1205 CB ILE B 79 6.334 4.866 -8.155 1.00 10.00 C ATOM 1206 CG1 ILE B 79 6.906 6.245 -8.568 1.00 10.00 C ATOM 1207 CG2 ILE B 79 7.495 3.852 -8.213 1.00 10.00 C ATOM 1208 CD1 ILE B 79 7.533 6.979 -7.380 1.00 10.00 C ATOM 0 H ILE B 79 3.958 5.993 -8.544 1.00 10.00 H new ATOM 0 HA ILE B 79 5.671 4.115 -10.011 1.00 10.00 H new ATOM 0 HB ILE B 79 5.906 4.973 -7.158 1.00 10.00 H new ATOM 0 HG12 ILE B 79 7.655 6.109 -9.348 1.00 10.00 H new ATOM 0 HG13 ILE B 79 6.110 6.856 -8.994 1.00 10.00 H new ATOM 0 HG21 ILE B 79 8.311 4.196 -7.577 1.00 10.00 H new ATOM 0 HG22 ILE B 79 7.147 2.880 -7.863 1.00 10.00 H new ATOM 0 HG23 ILE B 79 7.849 3.763 -9.240 1.00 10.00 H new ATOM 0 HD11 ILE B 79 7.922 7.942 -7.711 1.00 10.00 H new ATOM 0 HD12 ILE B 79 6.777 7.139 -6.611 1.00 10.00 H new ATOM 0 HD13 ILE B 79 8.346 6.380 -6.970 1.00 10.00 H new ATOM 1220 N LEU B 80 3.463 3.189 -7.733 1.00 10.00 N ATOM 1221 CA LEU B 80 2.600 2.133 -7.178 1.00 10.00 C ATOM 1222 C LEU B 80 2.301 1.057 -8.214 1.00 10.00 C ATOM 1223 O LEU B 80 2.476 -0.129 -7.945 1.00 10.00 O ATOM 1224 CB LEU B 80 1.273 2.769 -6.698 1.00 10.00 C ATOM 1225 CG LEU B 80 1.131 3.022 -5.186 1.00 10.00 C ATOM 1226 CD1 LEU B 80 0.021 4.007 -4.810 1.00 10.00 C ATOM 1227 CD2 LEU B 80 0.752 1.716 -4.497 1.00 10.00 C ATOM 0 H LEU B 80 3.153 4.112 -7.430 1.00 10.00 H new ATOM 0 HA LEU B 80 3.122 1.662 -6.345 1.00 10.00 H new ATOM 0 HB2 LEU B 80 1.146 3.720 -7.215 1.00 10.00 H new ATOM 0 HB3 LEU B 80 0.453 2.123 -7.013 1.00 10.00 H new ATOM 0 HG LEU B 80 2.092 3.434 -4.876 1.00 10.00 H new ATOM 0 HD11 LEU B 80 -0.008 4.126 -3.727 1.00 10.00 H new ATOM 0 HD12 LEU B 80 0.218 4.972 -5.276 1.00 10.00 H new ATOM 0 HD13 LEU B 80 -0.938 3.625 -5.159 1.00 10.00 H new ATOM 0 HD21 LEU B 80 0.649 1.886 -3.425 1.00 10.00 H new ATOM 0 HD22 LEU B 80 -0.194 1.354 -4.899 1.00 10.00 H new ATOM 0 HD23 LEU B 80 1.529 0.973 -4.673 1.00 10.00 H new ATOM 1239 N LYS B 81 1.852 1.480 -9.400 1.00 10.00 N ATOM 1240 CA LYS B 81 1.420 0.590 -10.481 1.00 10.00 C ATOM 1241 C LYS B 81 2.491 -0.386 -11.004 1.00 10.00 C ATOM 1242 O LYS B 81 2.146 -1.363 -11.660 1.00 10.00 O ATOM 1243 CB LYS B 81 0.836 1.443 -11.617 1.00 10.00 C ATOM 1244 CG LYS B 81 1.920 2.182 -12.423 1.00 10.00 C ATOM 1245 CD LYS B 81 1.303 3.197 -13.399 1.00 10.00 C ATOM 1246 CE LYS B 81 2.258 3.582 -14.537 1.00 10.00 C ATOM 1247 NZ LYS B 81 3.362 4.473 -14.103 1.00 10.00 N ATOM 0 H LYS B 81 1.777 2.469 -9.639 1.00 10.00 H new ATOM 0 HA LYS B 81 0.662 -0.068 -10.056 1.00 10.00 H new ATOM 0 HB2 LYS B 81 0.263 0.803 -12.288 1.00 10.00 H new ATOM 0 HB3 LYS B 81 0.141 2.171 -11.199 1.00 10.00 H new ATOM 0 HG2 LYS B 81 2.595 2.697 -11.740 1.00 10.00 H new ATOM 0 HG3 LYS B 81 2.518 1.459 -12.978 1.00 10.00 H new ATOM 0 HD2 LYS B 81 0.390 2.779 -13.823 1.00 10.00 H new ATOM 0 HD3 LYS B 81 1.018 4.095 -12.851 1.00 10.00 H new ATOM 0 HE2 LYS B 81 2.681 2.675 -14.969 1.00 10.00 H new ATOM 0 HE3 LYS B 81 1.691 4.076 -15.326 1.00 10.00 H new ATOM 0 HZ1 LYS B 81 4.165 4.375 -14.757 1.00 10.00 H new ATOM 0 HZ2 LYS B 81 3.033 5.460 -14.104 1.00 10.00 H new ATOM 0 HZ3 LYS B 81 3.663 4.210 -13.143 1.00 10.00 H new ATOM 1261 N SER B 82 3.780 -0.113 -10.754 1.00 10.00 N ATOM 1262 CA SER B 82 4.922 -0.834 -11.350 1.00 10.00 C ATOM 1263 C SER B 82 5.029 -2.294 -10.906 1.00 10.00 C ATOM 1264 O SER B 82 5.094 -3.183 -11.758 1.00 10.00 O ATOM 1265 CB SER B 82 6.236 -0.089 -11.047 1.00 10.00 C ATOM 1266 OG SER B 82 6.450 0.057 -9.650 1.00 10.00 O ATOM 0 H SER B 82 4.067 0.631 -10.118 1.00 10.00 H new ATOM 0 HA SER B 82 4.742 -0.855 -12.425 1.00 10.00 H new ATOM 0 HB2 SER B 82 7.072 -0.632 -11.488 1.00 10.00 H new ATOM 0 HB3 SER B 82 6.212 0.895 -11.516 1.00 10.00 H new ATOM 0 HG SER B 82 6.119 0.932 -9.358 1.00 10.00 H new ATOM 1272 N ASN B 83 5.028 -2.556 -9.592 1.00 10.00 N ATOM 1273 CA ASN B 83 4.905 -3.901 -9.045 1.00 10.00 C ATOM 1274 C ASN B 83 3.420 -4.181 -8.766 1.00 10.00 C ATOM 1275 O ASN B 83 2.865 -3.607 -7.828 1.00 10.00 O ATOM 1276 CB ASN B 83 5.818 -4.098 -7.830 1.00 10.00 C ATOM 1277 CG ASN B 83 5.715 -5.497 -7.235 1.00 10.00 C ATOM 1278 OD1 ASN B 83 4.716 -6.198 -7.345 1.00 10.00 O ATOM 1279 ND2 ASN B 83 6.765 -5.992 -6.634 1.00 10.00 N ATOM 0 H ASN B 83 5.113 -1.831 -8.879 1.00 10.00 H new ATOM 0 HA ASN B 83 5.250 -4.640 -9.768 1.00 10.00 H new ATOM 0 HB2 ASN B 83 6.851 -3.908 -8.122 1.00 10.00 H new ATOM 0 HB3 ASN B 83 5.562 -3.364 -7.066 1.00 10.00 H new ATOM 0 HD21 ASN B 83 6.742 -6.944 -6.268 1.00 10.00 H new ATOM 0 HD22 ASN B 83 7.608 -5.426 -6.531 1.00 10.00 H new ATOM 1286 N PRO B 84 2.752 -5.052 -9.546 1.00 10.00 N ATOM 1287 CA PRO B 84 1.311 -5.283 -9.422 1.00 10.00 C ATOM 1288 C PRO B 84 0.945 -5.899 -8.058 1.00 10.00 C ATOM 1289 O PRO B 84 -0.110 -5.604 -7.505 1.00 10.00 O ATOM 1290 CB PRO B 84 0.948 -6.229 -10.582 1.00 10.00 C ATOM 1291 CG PRO B 84 2.126 -6.112 -11.543 1.00 10.00 C ATOM 1292 CD PRO B 84 3.303 -5.886 -10.602 1.00 10.00 C ATOM 0 HA PRO B 84 0.753 -4.348 -9.474 1.00 10.00 H new ATOM 0 HB2 PRO B 84 0.818 -7.254 -10.234 1.00 10.00 H new ATOM 0 HB3 PRO B 84 0.014 -5.933 -11.059 1.00 10.00 H new ATOM 0 HG2 PRO B 84 2.253 -7.015 -12.141 1.00 10.00 H new ATOM 0 HG3 PRO B 84 2.000 -5.284 -12.240 1.00 10.00 H new ATOM 0 HD2 PRO B 84 3.686 -6.827 -10.208 1.00 10.00 H new ATOM 0 HD3 PRO B 84 4.131 -5.392 -11.110 1.00 10.00 H new ATOM 1300 N GLN B 85 1.838 -6.720 -7.498 1.00 10.00 N ATOM 1301 CA GLN B 85 1.674 -7.312 -6.163 1.00 10.00 C ATOM 1302 C GLN B 85 1.823 -6.259 -5.073 1.00 10.00 C ATOM 1303 O GLN B 85 1.056 -6.283 -4.119 1.00 10.00 O ATOM 1304 CB GLN B 85 2.679 -8.450 -5.921 1.00 10.00 C ATOM 1305 CG GLN B 85 2.404 -9.630 -6.844 1.00 10.00 C ATOM 1306 CD GLN B 85 3.524 -10.651 -6.761 1.00 10.00 C ATOM 1307 OE1 GLN B 85 3.413 -11.681 -6.108 1.00 10.00 O ATOM 1308 NE2 GLN B 85 4.612 -10.384 -7.449 1.00 10.00 N ATOM 0 H GLN B 85 2.704 -6.996 -7.961 1.00 10.00 H new ATOM 0 HA GLN B 85 0.666 -7.725 -6.122 1.00 10.00 H new ATOM 0 HB2 GLN B 85 3.693 -8.085 -6.085 1.00 10.00 H new ATOM 0 HB3 GLN B 85 2.621 -8.776 -4.882 1.00 10.00 H new ATOM 0 HG2 GLN B 85 1.458 -10.098 -6.571 1.00 10.00 H new ATOM 0 HG3 GLN B 85 2.302 -9.278 -7.871 1.00 10.00 H new ATOM 0 HE21 GLN B 85 4.677 -9.518 -7.984 1.00 10.00 H new ATOM 0 HE22 GLN B 85 5.391 -11.043 -7.448 1.00 10.00 H new ATOM 1317 N LEU B 86 2.763 -5.311 -5.212 1.00 10.00 N ATOM 1318 CA LEU B 86 2.847 -4.141 -4.330 1.00 10.00 C ATOM 1319 C LEU B 86 1.559 -3.332 -4.428 1.00 10.00 C ATOM 1320 O LEU B 86 0.995 -2.985 -3.396 1.00 10.00 O ATOM 1321 CB LEU B 86 4.101 -3.301 -4.629 1.00 10.00 C ATOM 1322 CG LEU B 86 4.360 -2.054 -3.746 1.00 10.00 C ATOM 1323 CD1 LEU B 86 3.575 -0.827 -4.218 1.00 10.00 C ATOM 1324 CD2 LEU B 86 4.104 -2.239 -2.242 1.00 10.00 C ATOM 0 H LEU B 86 3.482 -5.335 -5.935 1.00 10.00 H new ATOM 0 HA LEU B 86 2.952 -4.476 -3.298 1.00 10.00 H new ATOM 0 HB2 LEU B 86 4.970 -3.955 -4.549 1.00 10.00 H new ATOM 0 HB3 LEU B 86 4.044 -2.971 -5.666 1.00 10.00 H new ATOM 0 HG LEU B 86 5.431 -1.897 -3.873 1.00 10.00 H new ATOM 0 HD11 LEU B 86 3.793 0.018 -3.565 1.00 10.00 H new ATOM 0 HD12 LEU B 86 3.865 -0.580 -5.239 1.00 10.00 H new ATOM 0 HD13 LEU B 86 2.507 -1.044 -4.186 1.00 10.00 H new ATOM 0 HD21 LEU B 86 4.316 -1.306 -1.719 1.00 10.00 H new ATOM 0 HD22 LEU B 86 3.062 -2.516 -2.082 1.00 10.00 H new ATOM 0 HD23 LEU B 86 4.752 -3.026 -1.857 1.00 10.00 H new ATOM 1336 N MET B 87 1.054 -3.071 -5.633 1.00 10.00 N ATOM 1337 CA MET B 87 -0.213 -2.354 -5.826 1.00 10.00 C ATOM 1338 C MET B 87 -1.378 -3.063 -5.137 1.00 10.00 C ATOM 1339 O MET B 87 -2.115 -2.455 -4.360 1.00 10.00 O ATOM 1340 CB MET B 87 -0.476 -2.140 -7.318 1.00 10.00 C ATOM 1341 CG MET B 87 -0.828 -0.688 -7.575 1.00 10.00 C ATOM 1342 SD MET B 87 -2.380 -0.156 -6.830 1.00 10.00 S ATOM 1343 CE MET B 87 -2.257 1.590 -7.244 1.00 10.00 C ATOM 0 H MET B 87 1.508 -3.348 -6.503 1.00 10.00 H new ATOM 0 HA MET B 87 -0.127 -1.376 -5.353 1.00 10.00 H new ATOM 0 HB2 MET B 87 0.406 -2.417 -7.895 1.00 10.00 H new ATOM 0 HB3 MET B 87 -1.290 -2.785 -7.649 1.00 10.00 H new ATOM 0 HG2 MET B 87 -0.023 -0.059 -7.196 1.00 10.00 H new ATOM 0 HG3 MET B 87 -0.881 -0.524 -8.651 1.00 10.00 H new ATOM 0 HE1 MET B 87 -1.996 2.158 -6.351 1.00 10.00 H new ATOM 0 HE2 MET B 87 -1.487 1.731 -8.002 1.00 10.00 H new ATOM 0 HE3 MET B 87 -3.214 1.941 -7.630 1.00 10.00 H new ATOM 1353 N ALA B 88 -1.541 -4.371 -5.366 1.00 10.00 N ATOM 1354 CA ALA B 88 -2.560 -5.149 -4.675 1.00 10.00 C ATOM 1355 C ALA B 88 -2.333 -5.219 -3.162 1.00 10.00 C ATOM 1356 O ALA B 88 -3.294 -5.083 -2.415 1.00 10.00 O ATOM 1357 CB ALA B 88 -2.634 -6.549 -5.292 1.00 10.00 C ATOM 0 H ALA B 88 -0.977 -4.907 -6.026 1.00 10.00 H new ATOM 0 HA ALA B 88 -3.515 -4.641 -4.807 1.00 10.00 H new ATOM 0 HB1 ALA B 88 -3.396 -7.134 -4.777 1.00 10.00 H new ATOM 0 HB2 ALA B 88 -2.891 -6.468 -6.348 1.00 10.00 H new ATOM 0 HB3 ALA B 88 -1.668 -7.043 -5.191 1.00 10.00 H new ATOM 1363 N ALA B 89 -1.092 -5.405 -2.688 1.00 10.00 N ATOM 1364 CA ALA B 89 -0.740 -5.394 -1.265 1.00 10.00 C ATOM 1365 C ALA B 89 -1.029 -4.038 -0.611 1.00 10.00 C ATOM 1366 O ALA B 89 -1.537 -4.001 0.508 1.00 10.00 O ATOM 1367 CB ALA B 89 0.725 -5.801 -1.078 1.00 10.00 C ATOM 0 H ALA B 89 -0.291 -5.570 -3.297 1.00 10.00 H new ATOM 0 HA ALA B 89 -1.371 -6.125 -0.760 1.00 10.00 H new ATOM 0 HB1 ALA B 89 0.973 -5.789 -0.017 1.00 10.00 H new ATOM 0 HB2 ALA B 89 0.877 -6.805 -1.475 1.00 10.00 H new ATOM 0 HB3 ALA B 89 1.368 -5.099 -1.609 1.00 10.00 H new ATOM 1373 N PHE B 90 -0.765 -2.928 -1.323 1.00 10.00 N ATOM 1374 CA PHE B 90 -1.186 -1.592 -0.920 1.00 10.00 C ATOM 1375 C PHE B 90 -2.699 -1.608 -0.775 1.00 10.00 C ATOM 1376 O PHE B 90 -3.183 -1.453 0.332 1.00 10.00 O ATOM 1377 CB PHE B 90 -0.735 -0.529 -1.943 1.00 10.00 C ATOM 1378 CG PHE B 90 -1.358 0.856 -1.778 1.00 10.00 C ATOM 1379 CD1 PHE B 90 -0.794 1.764 -0.863 1.00 10.00 C ATOM 1380 CD2 PHE B 90 -2.439 1.317 -2.564 1.00 10.00 C ATOM 1381 CE1 PHE B 90 -1.213 3.103 -0.811 1.00 10.00 C ATOM 1382 CE2 PHE B 90 -2.908 2.635 -2.457 1.00 10.00 C ATOM 1383 CZ PHE B 90 -2.281 3.543 -1.590 1.00 10.00 C ATOM 0 H PHE B 90 -0.248 -2.943 -2.202 1.00 10.00 H new ATOM 0 HA PHE B 90 -0.721 -1.324 0.029 1.00 10.00 H new ATOM 0 HB2 PHE B 90 0.349 -0.429 -1.882 1.00 10.00 H new ATOM 0 HB3 PHE B 90 -0.965 -0.894 -2.944 1.00 10.00 H new ATOM 0 HD1 PHE B 90 -0.023 1.424 -0.187 1.00 10.00 H new ATOM 0 HD2 PHE B 90 -2.913 0.641 -3.260 1.00 10.00 H new ATOM 0 HE1 PHE B 90 -0.703 3.798 -0.161 1.00 10.00 H new ATOM 0 HE2 PHE B 90 -3.756 2.953 -3.045 1.00 10.00 H new ATOM 0 HZ PHE B 90 -2.621 4.566 -1.528 1.00 10.00 H new ATOM 1393 N ILE B 91 -3.459 -1.891 -1.837 1.00 10.00 N ATOM 1394 CA ILE B 91 -4.927 -1.832 -1.809 1.00 10.00 C ATOM 1395 C ILE B 91 -5.507 -2.711 -0.680 1.00 10.00 C ATOM 1396 O ILE B 91 -6.345 -2.258 0.101 1.00 10.00 O ATOM 1397 CB ILE B 91 -5.535 -2.138 -3.192 1.00 10.00 C ATOM 1398 CG1 ILE B 91 -5.113 -0.997 -4.132 1.00 10.00 C ATOM 1399 CG2 ILE B 91 -7.070 -2.265 -3.134 1.00 10.00 C ATOM 1400 CD1 ILE B 91 -5.580 -1.118 -5.580 1.00 10.00 C ATOM 0 H ILE B 91 -3.076 -2.168 -2.741 1.00 10.00 H new ATOM 0 HA ILE B 91 -5.217 -0.808 -1.574 1.00 10.00 H new ATOM 0 HB ILE B 91 -5.169 -3.099 -3.554 1.00 10.00 H new ATOM 0 HG12 ILE B 91 -5.492 -0.059 -3.726 1.00 10.00 H new ATOM 0 HG13 ILE B 91 -4.025 -0.931 -4.126 1.00 10.00 H new ATOM 0 HG21 ILE B 91 -7.455 -2.481 -4.131 1.00 10.00 H new ATOM 0 HG22 ILE B 91 -7.343 -3.074 -2.457 1.00 10.00 H new ATOM 0 HG23 ILE B 91 -7.499 -1.330 -2.774 1.00 10.00 H new ATOM 0 HD11 ILE B 91 -5.225 -0.259 -6.150 1.00 10.00 H new ATOM 0 HD12 ILE B 91 -5.180 -2.033 -6.016 1.00 10.00 H new ATOM 0 HD13 ILE B 91 -6.669 -1.148 -5.610 1.00 10.00 H new ATOM 1412 N LYS B 92 -5.006 -3.947 -0.551 1.00 10.00 N ATOM 1413 CA LYS B 92 -5.358 -4.879 0.517 1.00 10.00 C ATOM 1414 C LYS B 92 -5.074 -4.290 1.898 1.00 10.00 C ATOM 1415 O LYS B 92 -6.007 -4.153 2.684 1.00 10.00 O ATOM 1416 CB LYS B 92 -4.631 -6.218 0.309 1.00 10.00 C ATOM 1417 CG LYS B 92 -5.061 -7.311 1.297 1.00 10.00 C ATOM 1418 CD LYS B 92 -6.521 -7.777 1.184 1.00 10.00 C ATOM 1419 CE LYS B 92 -6.870 -8.256 -0.227 1.00 10.00 C ATOM 1420 NZ LYS B 92 -8.219 -8.846 -0.300 1.00 10.00 N ATOM 0 H LYS B 92 -4.326 -4.332 -1.207 1.00 10.00 H new ATOM 0 HA LYS B 92 -6.432 -5.061 0.472 1.00 10.00 H new ATOM 0 HB2 LYS B 92 -4.813 -6.567 -0.707 1.00 10.00 H new ATOM 0 HB3 LYS B 92 -3.557 -6.057 0.403 1.00 10.00 H new ATOM 0 HG2 LYS B 92 -4.412 -8.175 1.159 1.00 10.00 H new ATOM 0 HG3 LYS B 92 -4.893 -6.945 2.310 1.00 10.00 H new ATOM 0 HD2 LYS B 92 -6.698 -8.585 1.894 1.00 10.00 H new ATOM 0 HD3 LYS B 92 -7.184 -6.958 1.462 1.00 10.00 H new ATOM 0 HE2 LYS B 92 -6.805 -7.417 -0.920 1.00 10.00 H new ATOM 0 HE3 LYS B 92 -6.135 -8.994 -0.550 1.00 10.00 H new ATOM 0 HZ1 LYS B 92 -8.410 -9.156 -1.274 1.00 10.00 H new ATOM 0 HZ2 LYS B 92 -8.276 -9.663 0.340 1.00 10.00 H new ATOM 0 HZ3 LYS B 92 -8.924 -8.136 -0.018 1.00 10.00 H new ATOM 1434 N GLN B 93 -3.820 -3.933 2.211 1.00 10.00 N ATOM 1435 CA GLN B 93 -3.474 -3.441 3.545 1.00 10.00 C ATOM 1436 C GLN B 93 -4.062 -2.045 3.798 1.00 10.00 C ATOM 1437 O GLN B 93 -4.449 -1.775 4.922 1.00 10.00 O ATOM 1438 CB GLN B 93 -1.955 -3.481 3.808 1.00 10.00 C ATOM 1439 CG GLN B 93 -1.585 -3.857 5.263 1.00 10.00 C ATOM 1440 CD GLN B 93 -2.177 -2.991 6.380 1.00 10.00 C ATOM 1441 OE1 GLN B 93 -3.126 -3.369 7.047 1.00 10.00 O ATOM 1442 NE2 GLN B 93 -1.622 -1.829 6.659 1.00 10.00 N ATOM 0 H GLN B 93 -3.036 -3.977 1.561 1.00 10.00 H new ATOM 0 HA GLN B 93 -3.930 -4.123 4.263 1.00 10.00 H new ATOM 0 HB2 GLN B 93 -1.496 -4.200 3.129 1.00 10.00 H new ATOM 0 HB3 GLN B 93 -1.529 -2.505 3.575 1.00 10.00 H new ATOM 0 HG2 GLN B 93 -1.894 -4.888 5.435 1.00 10.00 H new ATOM 0 HG3 GLN B 93 -0.499 -3.830 5.354 1.00 10.00 H new ATOM 0 HE21 GLN B 93 -0.828 -1.498 6.111 1.00 10.00 H new ATOM 0 HE22 GLN B 93 -1.987 -1.260 7.423 1.00 10.00 H new ATOM 1451 N ARG B 94 -4.212 -1.169 2.788 1.00 10.00 N ATOM 1452 CA ARG B 94 -4.956 0.092 2.910 1.00 10.00 C ATOM 1453 C ARG B 94 -6.374 -0.211 3.402 1.00 10.00 C ATOM 1454 O ARG B 94 -6.805 0.316 4.425 1.00 10.00 O ATOM 1455 CB ARG B 94 -5.028 0.887 1.583 1.00 10.00 C ATOM 1456 CG ARG B 94 -3.761 1.569 1.031 1.00 10.00 C ATOM 1457 CD ARG B 94 -3.012 2.439 2.032 1.00 10.00 C ATOM 1458 NE ARG B 94 -3.856 3.491 2.618 1.00 10.00 N ATOM 1459 CZ ARG B 94 -3.778 4.006 3.834 1.00 10.00 C ATOM 1460 NH1 ARG B 94 -2.873 3.578 4.671 1.00 10.00 N ATOM 1461 NH2 ARG B 94 -4.599 4.940 4.218 1.00 10.00 N ATOM 0 H ARG B 94 -3.817 -1.320 1.860 1.00 10.00 H new ATOM 0 HA ARG B 94 -4.419 0.718 3.623 1.00 10.00 H new ATOM 0 HB2 ARG B 94 -5.392 0.205 0.814 1.00 10.00 H new ATOM 0 HB3 ARG B 94 -5.786 1.660 1.708 1.00 10.00 H new ATOM 0 HG2 ARG B 94 -3.083 0.799 0.662 1.00 10.00 H new ATOM 0 HG3 ARG B 94 -4.041 2.184 0.175 1.00 10.00 H new ATOM 0 HD2 ARG B 94 -2.618 1.809 2.830 1.00 10.00 H new ATOM 0 HD3 ARG B 94 -2.157 2.899 1.537 1.00 10.00 H new ATOM 0 HE ARG B 94 -4.588 3.868 2.016 1.00 10.00 H new ATOM 0 HH11 ARG B 94 -2.223 2.844 4.388 1.00 10.00 H new ATOM 0 HH12 ARG B 94 -2.815 3.977 5.608 1.00 10.00 H new ATOM 0 HH21 ARG B 94 -5.315 5.284 3.578 1.00 10.00 H new ATOM 0 HH22 ARG B 94 -4.527 5.327 5.159 1.00 10.00 H new ATOM 1475 N THR B 95 -7.087 -1.102 2.702 1.00 10.00 N ATOM 1476 CA THR B 95 -8.428 -1.538 3.109 1.00 10.00 C ATOM 1477 C THR B 95 -8.423 -2.187 4.504 1.00 10.00 C ATOM 1478 O THR B 95 -9.291 -1.886 5.321 1.00 10.00 O ATOM 1479 CB THR B 95 -9.099 -2.479 2.088 1.00 10.00 C ATOM 1480 OG1 THR B 95 -8.806 -2.190 0.741 1.00 10.00 O ATOM 1481 CG2 THR B 95 -10.614 -2.322 2.170 1.00 10.00 C ATOM 0 H THR B 95 -6.753 -1.539 1.843 1.00 10.00 H new ATOM 0 HA THR B 95 -9.025 -0.627 3.150 1.00 10.00 H new ATOM 0 HB THR B 95 -8.722 -3.468 2.347 1.00 10.00 H new ATOM 0 HG1 THR B 95 -7.955 -2.608 0.494 1.00 10.00 H new ATOM 0 HG21 THR B 95 -11.088 -2.987 1.448 1.00 10.00 H new ATOM 0 HG22 THR B 95 -10.952 -2.576 3.175 1.00 10.00 H new ATOM 0 HG23 THR B 95 -10.886 -1.290 1.946 1.00 10.00 H new ATOM 1489 N ALA B 96 -7.431 -3.044 4.802 1.00 10.00 N ATOM 1490 CA ALA B 96 -7.244 -3.662 6.120 1.00 10.00 C ATOM 1491 C ALA B 96 -7.050 -2.628 7.244 1.00 10.00 C ATOM 1492 O ALA B 96 -7.742 -2.702 8.262 1.00 10.00 O ATOM 1493 CB ALA B 96 -6.108 -4.683 6.056 1.00 10.00 C ATOM 0 H ALA B 96 -6.727 -3.329 4.121 1.00 10.00 H new ATOM 0 HA ALA B 96 -8.163 -4.188 6.380 1.00 10.00 H new ATOM 0 HB1 ALA B 96 -5.973 -5.139 7.037 1.00 10.00 H new ATOM 0 HB2 ALA B 96 -6.354 -5.456 5.327 1.00 10.00 H new ATOM 0 HB3 ALA B 96 -5.186 -4.183 5.758 1.00 10.00 H new ATOM 1499 N LYS B 97 -6.175 -1.623 7.050 1.00 10.00 N ATOM 1500 CA LYS B 97 -5.972 -0.503 7.975 1.00 10.00 C ATOM 1501 C LYS B 97 -7.290 0.227 8.234 1.00 10.00 C ATOM 1502 O LYS B 97 -7.571 0.589 9.375 1.00 10.00 O ATOM 1503 CB LYS B 97 -4.796 0.398 7.505 1.00 10.00 C ATOM 1504 CG LYS B 97 -5.163 1.797 6.994 1.00 10.00 C ATOM 1505 CD LYS B 97 -5.362 2.790 8.140 1.00 10.00 C ATOM 1506 CE LYS B 97 -6.377 3.866 7.758 1.00 10.00 C ATOM 1507 NZ LYS B 97 -6.482 4.862 8.838 1.00 10.00 N ATOM 0 H LYS B 97 -5.578 -1.571 6.225 1.00 10.00 H new ATOM 0 HA LYS B 97 -5.661 -0.878 8.950 1.00 10.00 H new ATOM 0 HB2 LYS B 97 -4.100 0.511 8.336 1.00 10.00 H new ATOM 0 HB3 LYS B 97 -4.262 -0.125 6.712 1.00 10.00 H new ATOM 0 HG2 LYS B 97 -4.376 2.159 6.332 1.00 10.00 H new ATOM 0 HG3 LYS B 97 -6.076 1.739 6.402 1.00 10.00 H new ATOM 0 HD2 LYS B 97 -5.704 2.261 9.030 1.00 10.00 H new ATOM 0 HD3 LYS B 97 -4.410 3.256 8.392 1.00 10.00 H new ATOM 0 HE2 LYS B 97 -6.073 4.352 6.831 1.00 10.00 H new ATOM 0 HE3 LYS B 97 -7.351 3.411 7.575 1.00 10.00 H new ATOM 0 HZ1 LYS B 97 -7.162 5.600 8.565 1.00 10.00 H new ATOM 0 HZ2 LYS B 97 -6.808 4.397 9.709 1.00 10.00 H new ATOM 0 HZ3 LYS B 97 -5.550 5.293 9.004 1.00 10.00 H new ATOM 1521 N TYR B 98 -8.112 0.414 7.195 1.00 10.00 N ATOM 1522 CA TYR B 98 -9.419 1.035 7.330 1.00 10.00 C ATOM 1523 C TYR B 98 -10.407 0.180 8.106 1.00 10.00 C ATOM 1524 O TYR B 98 -10.993 0.694 9.048 1.00 10.00 O ATOM 1525 CB TYR B 98 -10.023 1.364 5.975 1.00 10.00 C ATOM 1526 CG TYR B 98 -9.486 2.596 5.309 1.00 10.00 C ATOM 1527 CD1 TYR B 98 -9.586 3.835 5.961 1.00 10.00 C ATOM 1528 CD2 TYR B 98 -8.979 2.509 4.000 1.00 10.00 C ATOM 1529 CE1 TYR B 98 -9.153 4.994 5.309 1.00 10.00 C ATOM 1530 CE2 TYR B 98 -8.579 3.665 3.320 1.00 10.00 C ATOM 1531 CZ TYR B 98 -8.655 4.915 3.984 1.00 10.00 C ATOM 1532 OH TYR B 98 -8.220 6.052 3.382 1.00 10.00 O ATOM 0 H TYR B 98 -7.883 0.137 6.241 1.00 10.00 H new ATOM 0 HA TYR B 98 -9.243 1.952 7.892 1.00 10.00 H new ATOM 0 HB2 TYR B 98 -9.864 0.515 5.310 1.00 10.00 H new ATOM 0 HB3 TYR B 98 -11.100 1.478 6.095 1.00 10.00 H new ATOM 0 HD1 TYR B 98 -9.994 3.893 6.959 1.00 10.00 H new ATOM 0 HD2 TYR B 98 -8.898 1.546 3.518 1.00 10.00 H new ATOM 0 HE1 TYR B 98 -9.198 5.948 5.814 1.00 10.00 H new ATOM 0 HE2 TYR B 98 -8.218 3.606 2.304 1.00 10.00 H new ATOM 0 HH TYR B 98 -7.260 5.979 3.201 1.00 10.00 H new ATOM 1542 N VAL B 99 -10.641 -1.091 7.748 1.00 10.00 N ATOM 1543 CA VAL B 99 -11.581 -1.928 8.527 1.00 10.00 C ATOM 1544 C VAL B 99 -11.118 -2.089 9.983 1.00 10.00 C ATOM 1545 O VAL B 99 -11.941 -2.124 10.893 1.00 10.00 O ATOM 1546 CB VAL B 99 -11.885 -3.288 7.870 1.00 10.00 C ATOM 1547 CG1 VAL B 99 -12.496 -3.078 6.471 1.00 10.00 C ATOM 1548 CG2 VAL B 99 -10.649 -4.171 7.731 1.00 10.00 C ATOM 0 H VAL B 99 -10.210 -1.556 6.949 1.00 10.00 H new ATOM 0 HA VAL B 99 -12.528 -1.387 8.533 1.00 10.00 H new ATOM 0 HB VAL B 99 -12.589 -3.795 8.530 1.00 10.00 H new ATOM 0 HG11 VAL B 99 -12.706 -4.046 6.017 1.00 10.00 H new ATOM 0 HG12 VAL B 99 -13.422 -2.510 6.560 1.00 10.00 H new ATOM 0 HG13 VAL B 99 -11.792 -2.529 5.845 1.00 10.00 H new ATOM 0 HG21 VAL B 99 -10.927 -5.115 7.262 1.00 10.00 H new ATOM 0 HG22 VAL B 99 -9.907 -3.664 7.114 1.00 10.00 H new ATOM 0 HG23 VAL B 99 -10.229 -4.366 8.718 1.00 10.00 H new