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= 0.829 K(o=2.9,f=-3.4) USER MOD Set 1.2: B 81 LYS NZ :NH3+ 161:sc= 2.12 (180deg=-0.225) USER MOD Set 2.1: B 63 THR OG1 : rot -92:sc= 1.18 USER MOD Set 2.2: B 66 SER OG : rot -83:sc= 2.14 USER MOD Set 2.3: B 71 GLN : amide:sc= 0.84 K(o=3.3,f=-1.4!) USER MOD Set 2.4: B 75 GLN : amide:sc= -0.856! C(o=3.3!,f=-6.1!) USER MOD Set 3.1: B 72 GLN : amide:sc= 1.2 K(o=2.5,f=-3.3) USER MOD Set 3.2: B 73 GLN : amide:sc= 1.3 K(o=2.5,f=-0.59) USER MOD Single : A 12 GLN : amide:sc= 0.822 K(o=0.82,f=-0.78) USER MOD Single : A 14 HIS : no HD1:sc= -0.821 K(o=-0.82,f=-5.6!) USER MOD Single : A 15 THR OG1 : rot 97:sc= 1.15 USER MOD Single : A 18 SER OG : rot 70:sc= 1.26 USER MOD Single : A 19 ASN : amide:sc= 1.49 K(o=1.5,f=-5.6!) USER MOD Single : A 20 THR OG1 : rot -66:sc= 1.26 USER MOD Single : A 23 THR OG1 : rot 93:sc= 1.23 USER MOD Single : B 51 SER OG : rot 30:sc= 0.285 USER MOD Single : B 53 SER OG : rot -98:sc= 1.17 USER MOD Single : B 55 SER OG : rot 180:sc= 0.0524 USER MOD Single : B 58 GLN : amide:sc= 1.17 K(o=1.2,f=-0.00086) USER MOD Single : B 65 LYS NZ :NH3+ -175:sc= 0 (180deg=-0.0253) USER MOD Single : B 68 SER OG : rot -136:sc= 1.93 USER MOD Single : B 69 SER OG : rot 180:sc= 0 USER MOD Single : B 74 GLN : amide:sc= 1.05 K(o=1,f=-0.66) USER MOD Single : B 82 SER OG : rot -53:sc= 1.2 USER MOD Single : B 83 ASN : amide:sc= -2.58! C(o=-2.6!,f=-8.4!) USER MOD Single : B 85 GLN : amide:sc= 0.877 K(o=0.88,f=-0.035) USER MOD Single : B 87 MET CE :methyl 136:sc= -1.66 (180deg=-4.21!) USER MOD Single : B 92 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 93 GLN :FLIP amide:sc= -0.997 F(o=-1.5,f=-1) USER MOD Single : B 95 THR OG1 : rot 75:sc= 1.02 USER MOD Single : B 97 LYS NZ :NH3+ 167:sc= 1.33 (180deg=1.12) USER MOD Single : B 98 TYR OH : rot 98:sc= 1.08 USER MOD ----------------------------------------------------------------- ATOM 65 N GLU A 6 12.558 -9.473 -3.676 1.00 10.00 N ATOM 66 CA GLU A 6 11.267 -8.918 -4.049 1.00 10.00 C ATOM 67 C GLU A 6 10.236 -9.150 -2.953 1.00 10.00 C ATOM 68 O GLU A 6 9.652 -8.184 -2.499 1.00 10.00 O ATOM 69 CB GLU A 6 10.786 -9.464 -5.397 1.00 10.00 C ATOM 70 CG GLU A 6 9.493 -8.819 -5.911 1.00 10.00 C ATOM 71 CD GLU A 6 9.567 -7.304 -6.118 1.00 10.00 C ATOM 72 OE1 GLU A 6 10.601 -6.803 -6.604 1.00 10.00 O ATOM 73 OE2 GLU A 6 8.567 -6.593 -5.894 1.00 10.00 O ATOM 0 HA GLU A 6 11.392 -7.841 -4.166 1.00 10.00 H new ATOM 0 HB2 GLU A 6 11.572 -9.316 -6.138 1.00 10.00 H new ATOM 0 HB3 GLU A 6 10.631 -10.539 -5.307 1.00 10.00 H new ATOM 0 HG2 GLU A 6 9.222 -9.288 -6.857 1.00 10.00 H new ATOM 0 HG3 GLU A 6 8.691 -9.036 -5.206 1.00 10.00 H new ATOM 80 N ARG A 7 10.022 -10.397 -2.512 1.00 10.00 N ATOM 81 CA ARG A 7 8.953 -10.694 -1.544 1.00 10.00 C ATOM 82 C ARG A 7 9.148 -9.960 -0.214 1.00 10.00 C ATOM 83 O ARG A 7 8.195 -9.356 0.283 1.00 10.00 O ATOM 84 CB ARG A 7 8.783 -12.208 -1.350 1.00 10.00 C ATOM 85 CG ARG A 7 7.314 -12.648 -1.446 1.00 10.00 C ATOM 86 CD ARG A 7 6.320 -11.973 -0.486 1.00 10.00 C ATOM 87 NE ARG A 7 6.667 -12.085 0.939 1.00 10.00 N ATOM 88 CZ ARG A 7 6.650 -13.136 1.739 1.00 10.00 C ATOM 89 NH1 ARG A 7 6.515 -14.369 1.303 1.00 10.00 N ATOM 90 NH2 ARG A 7 6.770 -12.924 3.020 1.00 10.00 N ATOM 0 H ARG A 7 10.566 -11.208 -2.805 1.00 10.00 H new ATOM 0 HA ARG A 7 8.023 -10.312 -1.966 1.00 10.00 H new ATOM 0 HB2 ARG A 7 9.368 -12.736 -2.103 1.00 10.00 H new ATOM 0 HB3 ARG A 7 9.183 -12.494 -0.377 1.00 10.00 H new ATOM 0 HG2 ARG A 7 6.973 -12.471 -2.466 1.00 10.00 H new ATOM 0 HG3 ARG A 7 7.271 -13.724 -1.277 1.00 10.00 H new ATOM 0 HD2 ARG A 7 6.246 -10.917 -0.746 1.00 10.00 H new ATOM 0 HD3 ARG A 7 5.333 -12.410 -0.641 1.00 10.00 H new ATOM 0 HE ARG A 7 6.968 -11.215 1.378 1.00 10.00 H new ATOM 0 HH11 ARG A 7 6.417 -14.549 0.304 1.00 10.00 H new ATOM 0 HH12 ARG A 7 6.508 -15.146 1.964 1.00 10.00 H new ATOM 0 HH21 ARG A 7 6.872 -11.972 3.372 1.00 10.00 H new ATOM 0 HH22 ARG A 7 6.761 -13.710 3.670 1.00 10.00 H new ATOM 104 N ALA A 8 10.360 -9.976 0.334 1.00 10.00 N ATOM 105 CA ALA A 8 10.668 -9.228 1.559 1.00 10.00 C ATOM 106 C ALA A 8 10.600 -7.708 1.346 1.00 10.00 C ATOM 107 O ALA A 8 10.095 -7.011 2.237 1.00 10.00 O ATOM 108 CB ALA A 8 12.066 -9.641 2.053 1.00 10.00 C ATOM 0 H ALA A 8 11.149 -10.498 -0.048 1.00 10.00 H new ATOM 0 HA ALA A 8 9.916 -9.471 2.309 1.00 10.00 H new ATOM 0 HB1 ALA A 8 12.307 -9.092 2.963 1.00 10.00 H new ATOM 0 HB2 ALA A 8 12.077 -10.711 2.261 1.00 10.00 H new ATOM 0 HB3 ALA A 8 12.805 -9.413 1.285 1.00 10.00 H new ATOM 114 N LEU A 9 11.045 -7.175 0.189 1.00 10.00 N ATOM 115 CA LEU A 9 10.980 -5.728 0.002 1.00 10.00 C ATOM 116 C LEU A 9 9.546 -5.261 -0.325 1.00 10.00 C ATOM 117 O LEU A 9 9.141 -4.210 0.175 1.00 10.00 O ATOM 118 CB LEU A 9 12.180 -5.178 -0.802 1.00 10.00 C ATOM 119 CG LEU A 9 12.014 -4.546 -2.188 1.00 10.00 C ATOM 120 CD1 LEU A 9 11.834 -5.629 -3.239 1.00 10.00 C ATOM 121 CD2 LEU A 9 10.976 -3.425 -2.267 1.00 10.00 C ATOM 0 H LEU A 9 11.435 -7.704 -0.592 1.00 10.00 H new ATOM 0 HA LEU A 9 11.149 -5.209 0.945 1.00 10.00 H new ATOM 0 HB2 LEU A 9 12.662 -4.430 -0.173 1.00 10.00 H new ATOM 0 HB3 LEU A 9 12.885 -6.002 -0.916 1.00 10.00 H new ATOM 0 HG LEU A 9 12.942 -4.017 -2.405 1.00 10.00 H new ATOM 0 HD11 LEU A 9 11.717 -5.168 -4.220 1.00 10.00 H new ATOM 0 HD12 LEU A 9 12.709 -6.279 -3.245 1.00 10.00 H new ATOM 0 HD13 LEU A 9 10.947 -6.218 -3.007 1.00 10.00 H new ATOM 0 HD21 LEU A 9 10.931 -3.042 -3.286 1.00 10.00 H new ATOM 0 HD22 LEU A 9 9.998 -3.814 -1.982 1.00 10.00 H new ATOM 0 HD23 LEU A 9 11.258 -2.620 -1.589 1.00 10.00 H new ATOM 133 N LEU A 10 8.766 -6.062 -1.066 1.00 10.00 N ATOM 134 CA LEU A 10 7.322 -5.935 -1.327 1.00 10.00 C ATOM 135 C LEU A 10 6.571 -5.854 -0.002 1.00 10.00 C ATOM 136 O LEU A 10 5.752 -4.957 0.173 1.00 10.00 O ATOM 137 CB LEU A 10 6.903 -7.156 -2.167 1.00 10.00 C ATOM 138 CG LEU A 10 5.431 -7.538 -2.286 1.00 10.00 C ATOM 139 CD1 LEU A 10 4.630 -6.512 -3.068 1.00 10.00 C ATOM 140 CD2 LEU A 10 5.313 -8.869 -3.024 1.00 10.00 C ATOM 0 H LEU A 10 9.157 -6.879 -1.535 1.00 10.00 H new ATOM 0 HA LEU A 10 7.084 -5.025 -1.878 1.00 10.00 H new ATOM 0 HB2 LEU A 10 7.278 -6.997 -3.178 1.00 10.00 H new ATOM 0 HB3 LEU A 10 7.430 -8.021 -1.764 1.00 10.00 H new ATOM 0 HG LEU A 10 5.034 -7.598 -1.272 1.00 10.00 H new ATOM 0 HD11 LEU A 10 3.589 -6.830 -3.125 1.00 10.00 H new ATOM 0 HD12 LEU A 10 4.688 -5.546 -2.566 1.00 10.00 H new ATOM 0 HD13 LEU A 10 5.037 -6.423 -4.075 1.00 10.00 H new ATOM 0 HD21 LEU A 10 4.262 -9.145 -3.111 1.00 10.00 H new ATOM 0 HD22 LEU A 10 5.746 -8.773 -4.020 1.00 10.00 H new ATOM 0 HD23 LEU A 10 5.846 -9.641 -2.469 1.00 10.00 H new ATOM 152 N ASP A 11 6.899 -6.743 0.942 1.00 10.00 N ATOM 153 CA ASP A 11 6.373 -6.699 2.300 1.00 10.00 C ATOM 154 C ASP A 11 6.634 -5.370 3.025 1.00 10.00 C ATOM 155 O ASP A 11 5.676 -4.714 3.453 1.00 10.00 O ATOM 156 CB ASP A 11 6.815 -7.928 3.111 1.00 10.00 C ATOM 157 CG ASP A 11 5.980 -9.172 2.821 1.00 10.00 C ATOM 158 OD1 ASP A 11 4.771 -9.040 2.511 1.00 10.00 O ATOM 159 OD2 ASP A 11 6.541 -10.287 2.950 1.00 10.00 O ATOM 0 H ASP A 11 7.542 -7.517 0.778 1.00 10.00 H new ATOM 0 HA ASP A 11 5.288 -6.746 2.211 1.00 10.00 H new ATOM 0 HB2 ASP A 11 7.861 -8.142 2.893 1.00 10.00 H new ATOM 0 HB3 ASP A 11 6.752 -7.696 4.174 1.00 10.00 H new ATOM 164 N GLN A 12 7.899 -4.931 3.148 1.00 10.00 N ATOM 165 CA GLN A 12 8.155 -3.630 3.784 1.00 10.00 C ATOM 166 C GLN A 12 7.597 -2.436 2.994 1.00 10.00 C ATOM 167 O GLN A 12 7.263 -1.422 3.604 1.00 10.00 O ATOM 168 CB GLN A 12 9.632 -3.475 4.205 1.00 10.00 C ATOM 169 CG GLN A 12 10.662 -3.352 3.090 1.00 10.00 C ATOM 170 CD GLN A 12 10.764 -1.992 2.403 1.00 10.00 C ATOM 171 OE1 GLN A 12 11.162 -0.996 2.977 1.00 10.00 O ATOM 172 NE2 GLN A 12 10.446 -1.923 1.131 1.00 10.00 N ATOM 0 H GLN A 12 8.727 -5.434 2.830 1.00 10.00 H new ATOM 0 HA GLN A 12 7.579 -3.620 4.709 1.00 10.00 H new ATOM 0 HB2 GLN A 12 9.712 -2.592 4.839 1.00 10.00 H new ATOM 0 HB3 GLN A 12 9.900 -4.334 4.820 1.00 10.00 H new ATOM 0 HG2 GLN A 12 11.641 -3.601 3.501 1.00 10.00 H new ATOM 0 HG3 GLN A 12 10.435 -4.101 2.332 1.00 10.00 H new ATOM 0 HE21 GLN A 12 10.112 -2.754 0.643 1.00 10.00 H new ATOM 0 HE22 GLN A 12 10.533 -1.038 0.631 1.00 10.00 H new ATOM 181 N LEU A 13 7.412 -2.559 1.674 1.00 10.00 N ATOM 182 CA LEU A 13 6.863 -1.497 0.839 1.00 10.00 C ATOM 183 C LEU A 13 5.332 -1.417 0.939 1.00 10.00 C ATOM 184 O LEU A 13 4.810 -0.310 1.048 1.00 10.00 O ATOM 185 CB LEU A 13 7.367 -1.705 -0.609 1.00 10.00 C ATOM 186 CG LEU A 13 7.215 -0.506 -1.571 1.00 10.00 C ATOM 187 CD1 LEU A 13 7.755 0.795 -0.967 1.00 10.00 C ATOM 188 CD2 LEU A 13 7.983 -0.815 -2.863 1.00 10.00 C ATOM 0 H LEU A 13 7.643 -3.407 1.156 1.00 10.00 H new ATOM 0 HA LEU A 13 7.215 -0.529 1.195 1.00 10.00 H new ATOM 0 HB2 LEU A 13 8.422 -1.977 -0.567 1.00 10.00 H new ATOM 0 HB3 LEU A 13 6.835 -2.555 -1.037 1.00 10.00 H new ATOM 0 HG LEU A 13 6.152 -0.362 -1.766 1.00 10.00 H new ATOM 0 HD11 LEU A 13 7.626 1.609 -1.681 1.00 10.00 H new ATOM 0 HD12 LEU A 13 7.210 1.025 -0.052 1.00 10.00 H new ATOM 0 HD13 LEU A 13 8.814 0.678 -0.738 1.00 10.00 H new ATOM 0 HD21 LEU A 13 7.885 0.023 -3.553 1.00 10.00 H new ATOM 0 HD22 LEU A 13 9.036 -0.973 -2.631 1.00 10.00 H new ATOM 0 HD23 LEU A 13 7.574 -1.714 -3.323 1.00 10.00 H new ATOM 200 N HIS A 14 4.590 -2.548 0.961 1.00 10.00 N ATOM 201 CA HIS A 14 3.142 -2.487 1.236 1.00 10.00 C ATOM 202 C HIS A 14 2.864 -2.115 2.697 1.00 10.00 C ATOM 203 O HIS A 14 1.888 -1.409 2.957 1.00 10.00 O ATOM 204 CB HIS A 14 2.397 -3.753 0.758 1.00 10.00 C ATOM 205 CG HIS A 14 2.512 -4.990 1.620 1.00 10.00 C ATOM 206 ND1 HIS A 14 2.058 -5.107 2.931 1.00 10.00 N ATOM 207 CD2 HIS A 14 3.015 -6.192 1.215 1.00 10.00 C ATOM 208 CE1 HIS A 14 2.336 -6.367 3.304 1.00 10.00 C ATOM 209 NE2 HIS A 14 2.903 -7.049 2.291 1.00 10.00 N ATOM 0 H HIS A 14 4.958 -3.485 0.797 1.00 10.00 H new ATOM 0 HA HIS A 14 2.725 -1.677 0.637 1.00 10.00 H new ATOM 0 HB2 HIS A 14 1.340 -3.506 0.661 1.00 10.00 H new ATOM 0 HB3 HIS A 14 2.759 -4.002 -0.240 1.00 10.00 H new ATOM 0 HD2 HIS A 14 3.421 -6.427 0.242 1.00 10.00 H new ATOM 0 HE1 HIS A 14 2.133 -6.777 4.282 1.00 10.00 H new ATOM 0 HE2 HIS A 14 3.197 -8.025 2.315 1.00 10.00 H new ATOM 217 N THR A 15 3.779 -2.481 3.615 1.00 10.00 N ATOM 218 CA THR A 15 3.778 -2.022 5.014 1.00 10.00 C ATOM 219 C THR A 15 3.914 -0.512 5.082 1.00 10.00 C ATOM 220 O THR A 15 3.042 0.142 5.646 1.00 10.00 O ATOM 221 CB THR A 15 4.876 -2.666 5.871 1.00 10.00 C ATOM 222 OG1 THR A 15 4.833 -4.067 5.789 1.00 10.00 O ATOM 223 CG2 THR A 15 4.699 -2.319 7.347 1.00 10.00 C ATOM 0 H THR A 15 4.550 -3.113 3.401 1.00 10.00 H new ATOM 0 HA THR A 15 2.819 -2.336 5.427 1.00 10.00 H new ATOM 0 HB THR A 15 5.821 -2.281 5.487 1.00 10.00 H new ATOM 0 HG1 THR A 15 5.483 -4.376 5.123 1.00 10.00 H new ATOM 0 HG21 THR A 15 5.492 -2.789 7.929 1.00 10.00 H new ATOM 0 HG22 THR A 15 4.748 -1.238 7.475 1.00 10.00 H new ATOM 0 HG23 THR A 15 3.731 -2.682 7.693 1.00 10.00 H new ATOM 231 N LEU A 16 4.967 0.062 4.475 1.00 10.00 N ATOM 232 CA LEU A 16 5.158 1.507 4.363 1.00 10.00 C ATOM 233 C LEU A 16 3.882 2.185 3.865 1.00 10.00 C ATOM 234 O LEU A 16 3.400 3.118 4.498 1.00 10.00 O ATOM 235 CB LEU A 16 6.318 1.772 3.380 1.00 10.00 C ATOM 236 CG LEU A 16 6.562 3.259 3.031 1.00 10.00 C ATOM 237 CD1 LEU A 16 7.521 3.927 4.027 1.00 10.00 C ATOM 238 CD2 LEU A 16 7.073 3.338 1.596 1.00 10.00 C ATOM 0 H LEU A 16 5.717 -0.478 4.044 1.00 10.00 H new ATOM 0 HA LEU A 16 5.395 1.920 5.344 1.00 10.00 H new ATOM 0 HB2 LEU A 16 7.234 1.361 3.805 1.00 10.00 H new ATOM 0 HB3 LEU A 16 6.122 1.227 2.457 1.00 10.00 H new ATOM 0 HG LEU A 16 5.626 3.813 3.109 1.00 10.00 H new ATOM 0 HD11 LEU A 16 7.667 4.970 3.748 1.00 10.00 H new ATOM 0 HD12 LEU A 16 7.098 3.876 5.030 1.00 10.00 H new ATOM 0 HD13 LEU A 16 8.480 3.410 4.011 1.00 10.00 H new ATOM 0 HD21 LEU A 16 7.251 4.380 1.330 1.00 10.00 H new ATOM 0 HD22 LEU A 16 8.004 2.777 1.510 1.00 10.00 H new ATOM 0 HD23 LEU A 16 6.330 2.914 0.921 1.00 10.00 H new ATOM 250 N LEU A 17 3.310 1.707 2.759 1.00 10.00 N ATOM 251 CA LEU A 17 2.083 2.289 2.216 1.00 10.00 C ATOM 252 C LEU A 17 0.845 2.142 3.103 1.00 10.00 C ATOM 253 O LEU A 17 -0.096 2.908 2.930 1.00 10.00 O ATOM 254 CB LEU A 17 1.838 1.698 0.836 1.00 10.00 C ATOM 255 CG LEU A 17 2.760 2.244 -0.284 1.00 10.00 C ATOM 256 CD1 LEU A 17 3.002 1.213 -1.388 1.00 10.00 C ATOM 257 CD2 LEU A 17 2.301 3.542 -0.937 1.00 10.00 C ATOM 0 H LEU A 17 3.676 0.920 2.223 1.00 10.00 H new ATOM 0 HA LEU A 17 2.243 3.366 2.163 1.00 10.00 H new ATOM 0 HB2 LEU A 17 1.962 0.617 0.893 1.00 10.00 H new ATOM 0 HB3 LEU A 17 0.801 1.885 0.556 1.00 10.00 H new ATOM 0 HG LEU A 17 3.684 2.462 0.251 1.00 10.00 H new ATOM 0 HD11 LEU A 17 3.653 1.642 -2.150 1.00 10.00 H new ATOM 0 HD12 LEU A 17 3.475 0.328 -0.962 1.00 10.00 H new ATOM 0 HD13 LEU A 17 2.050 0.934 -1.840 1.00 10.00 H new ATOM 0 HD21 LEU A 17 3.016 3.835 -1.705 1.00 10.00 H new ATOM 0 HD22 LEU A 17 1.321 3.394 -1.391 1.00 10.00 H new ATOM 0 HD23 LEU A 17 2.237 4.326 -0.183 1.00 10.00 H new ATOM 269 N SER A 18 0.839 1.227 4.070 1.00 10.00 N ATOM 270 CA SER A 18 -0.362 0.837 4.826 1.00 10.00 C ATOM 271 C SER A 18 -0.173 0.949 6.344 1.00 10.00 C ATOM 272 O SER A 18 -0.976 0.429 7.114 1.00 10.00 O ATOM 273 CB SER A 18 -0.756 -0.591 4.436 1.00 10.00 C ATOM 274 OG SER A 18 -0.617 -0.826 3.055 1.00 10.00 O ATOM 0 H SER A 18 1.678 0.725 4.359 1.00 10.00 H new ATOM 0 HA SER A 18 -1.160 1.532 4.567 1.00 10.00 H new ATOM 0 HB2 SER A 18 -0.137 -1.299 4.987 1.00 10.00 H new ATOM 0 HB3 SER A 18 -1.789 -0.774 4.731 1.00 10.00 H new ATOM 0 HG SER A 18 0.334 -0.843 2.820 1.00 10.00 H new ATOM 280 N ASN A 19 0.883 1.650 6.757 1.00 10.00 N ATOM 281 CA ASN A 19 1.473 1.797 8.095 1.00 10.00 C ATOM 282 C ASN A 19 0.531 2.301 9.216 1.00 10.00 C ATOM 283 O ASN A 19 0.930 2.322 10.376 1.00 10.00 O ATOM 284 CB ASN A 19 2.669 2.745 7.907 1.00 10.00 C ATOM 285 CG ASN A 19 2.200 4.178 7.631 1.00 10.00 C ATOM 286 OD1 ASN A 19 1.620 4.864 8.464 1.00 10.00 O ATOM 287 ND2 ASN A 19 2.378 4.659 6.425 1.00 10.00 N ATOM 0 H ASN A 19 1.413 2.198 6.079 1.00 10.00 H new ATOM 0 HA ASN A 19 1.746 0.806 8.458 1.00 10.00 H new ATOM 0 HB2 ASN A 19 3.293 2.729 8.800 1.00 10.00 H new ATOM 0 HB3 ASN A 19 3.287 2.396 7.080 1.00 10.00 H new ATOM 0 HD21 ASN A 19 2.036 5.591 6.192 1.00 10.00 H new ATOM 0 HD22 ASN A 19 2.859 4.101 5.719 1.00 10.00 H new ATOM 294 N THR A 20 -0.688 2.713 8.849 1.00 10.00 N ATOM 295 CA THR A 20 -1.846 3.301 9.567 1.00 10.00 C ATOM 296 C THR A 20 -2.163 4.731 9.104 1.00 10.00 C ATOM 297 O THR A 20 -3.309 5.159 9.252 1.00 10.00 O ATOM 298 CB THR A 20 -1.833 3.237 11.110 1.00 10.00 C ATOM 299 OG1 THR A 20 -0.673 3.811 11.662 1.00 10.00 O ATOM 300 CG2 THR A 20 -1.997 1.808 11.632 1.00 10.00 C ATOM 0 H THR A 20 -0.933 2.628 7.863 1.00 10.00 H new ATOM 0 HA THR A 20 -2.647 2.623 9.273 1.00 10.00 H new ATOM 0 HB THR A 20 -2.693 3.825 11.432 1.00 10.00 H new ATOM 0 HG1 THR A 20 0.109 3.279 11.405 1.00 10.00 H new ATOM 0 HG21 THR A 20 -1.982 1.815 12.722 1.00 10.00 H new ATOM 0 HG22 THR A 20 -2.947 1.401 11.285 1.00 10.00 H new ATOM 0 HG23 THR A 20 -1.180 1.189 11.261 1.00 10.00 H new ATOM 308 N ASP A 21 -1.239 5.440 8.432 1.00 10.00 N ATOM 309 CA ASP A 21 -1.558 6.731 7.808 1.00 10.00 C ATOM 310 C ASP A 21 -2.615 6.619 6.678 1.00 10.00 C ATOM 311 O ASP A 21 -2.780 5.594 6.006 1.00 10.00 O ATOM 312 CB ASP A 21 -0.260 7.403 7.317 1.00 10.00 C ATOM 313 CG ASP A 21 -0.464 8.821 6.759 1.00 10.00 C ATOM 314 OD1 ASP A 21 -1.382 9.537 7.238 1.00 10.00 O ATOM 315 OD2 ASP A 21 0.238 9.184 5.793 1.00 10.00 O ATOM 0 H ASP A 21 -0.272 5.141 8.309 1.00 10.00 H new ATOM 0 HA ASP A 21 -2.020 7.361 8.568 1.00 10.00 H new ATOM 0 HB2 ASP A 21 0.449 7.447 8.143 1.00 10.00 H new ATOM 0 HB3 ASP A 21 0.190 6.780 6.544 1.00 10.00 H new ATOM 320 N ALA A 22 -3.322 7.722 6.461 1.00 10.00 N ATOM 321 CA ALA A 22 -4.225 7.975 5.343 1.00 10.00 C ATOM 322 C ALA A 22 -4.208 9.450 4.869 1.00 10.00 C ATOM 323 O ALA A 22 -4.905 9.772 3.915 1.00 10.00 O ATOM 324 CB ALA A 22 -5.650 7.542 5.742 1.00 10.00 C ATOM 0 H ALA A 22 -3.277 8.514 7.102 1.00 10.00 H new ATOM 0 HA ALA A 22 -3.877 7.387 4.494 1.00 10.00 H new ATOM 0 HB1 ALA A 22 -6.332 7.727 4.912 1.00 10.00 H new ATOM 0 HB2 ALA A 22 -5.653 6.479 5.984 1.00 10.00 H new ATOM 0 HB3 ALA A 22 -5.973 8.113 6.612 1.00 10.00 H new ATOM 330 N THR A 23 -3.393 10.320 5.470 1.00 10.00 N ATOM 331 CA THR A 23 -3.417 11.783 5.311 1.00 10.00 C ATOM 332 C THR A 23 -3.501 12.296 3.877 1.00 10.00 C ATOM 333 O THR A 23 -4.456 12.989 3.548 1.00 10.00 O ATOM 334 CB THR A 23 -2.262 12.419 6.090 1.00 10.00 C ATOM 335 OG1 THR A 23 -2.199 11.925 7.414 1.00 10.00 O ATOM 336 CG2 THR A 23 -2.401 13.936 6.182 1.00 10.00 C ATOM 0 H THR A 23 -2.662 10.013 6.112 1.00 10.00 H new ATOM 0 HA THR A 23 -4.366 12.105 5.740 1.00 10.00 H new ATOM 0 HB THR A 23 -1.358 12.160 5.539 1.00 10.00 H new ATOM 0 HG1 THR A 23 -1.582 11.165 7.450 1.00 10.00 H new ATOM 0 HG21 THR A 23 -1.560 14.345 6.743 1.00 10.00 H new ATOM 0 HG22 THR A 23 -2.410 14.362 5.179 1.00 10.00 H new ATOM 0 HG23 THR A 23 -3.332 14.186 6.690 1.00 10.00 H new ATOM 344 N GLY A 24 -2.519 11.959 3.035 1.00 10.00 N ATOM 345 CA GLY A 24 -2.588 12.186 1.590 1.00 10.00 C ATOM 346 C GLY A 24 -2.732 10.881 0.801 1.00 10.00 C ATOM 347 O GLY A 24 -3.104 10.903 -0.372 1.00 10.00 O ATOM 0 H GLY A 24 -1.650 11.519 3.339 1.00 10.00 H new ATOM 0 HA2 GLY A 24 -3.433 12.837 1.367 1.00 10.00 H new ATOM 0 HA3 GLY A 24 -1.688 12.708 1.263 1.00 10.00 H new ATOM 351 N LEU A 25 -2.482 9.747 1.462 1.00 10.00 N ATOM 352 CA LEU A 25 -2.787 8.418 0.928 1.00 10.00 C ATOM 353 C LEU A 25 -4.265 8.257 0.576 1.00 10.00 C ATOM 354 O LEU A 25 -4.555 7.526 -0.369 1.00 10.00 O ATOM 355 CB LEU A 25 -2.346 7.347 1.936 1.00 10.00 C ATOM 356 CG LEU A 25 -0.845 7.043 1.895 1.00 10.00 C ATOM 357 CD1 LEU A 25 -0.314 6.688 3.283 1.00 10.00 C ATOM 358 CD2 LEU A 25 -0.629 5.882 0.929 1.00 10.00 C ATOM 0 H LEU A 25 -2.059 9.726 2.390 1.00 10.00 H new ATOM 0 HA LEU A 25 -2.232 8.295 -0.002 1.00 10.00 H new ATOM 0 HB2 LEU A 25 -2.614 7.674 2.941 1.00 10.00 H new ATOM 0 HB3 LEU A 25 -2.899 6.428 1.742 1.00 10.00 H new ATOM 0 HG LEU A 25 -0.300 7.926 1.560 1.00 10.00 H new ATOM 0 HD11 LEU A 25 0.754 6.477 3.221 1.00 10.00 H new ATOM 0 HD12 LEU A 25 -0.480 7.525 3.961 1.00 10.00 H new ATOM 0 HD13 LEU A 25 -0.836 5.808 3.658 1.00 10.00 H new ATOM 0 HD21 LEU A 25 0.433 5.643 0.879 1.00 10.00 H new ATOM 0 HD22 LEU A 25 -1.181 5.010 1.279 1.00 10.00 H new ATOM 0 HD23 LEU A 25 -0.984 6.163 -0.062 1.00 10.00 H new ATOM 370 N GLU A 26 -5.160 9.007 1.238 1.00 10.00 N ATOM 371 CA GLU A 26 -6.565 9.129 0.859 1.00 10.00 C ATOM 372 C GLU A 26 -6.731 9.385 -0.642 1.00 10.00 C ATOM 373 O GLU A 26 -7.637 8.794 -1.232 1.00 10.00 O ATOM 374 CB GLU A 26 -7.291 10.177 1.729 1.00 10.00 C ATOM 375 CG GLU A 26 -6.866 11.648 1.541 1.00 10.00 C ATOM 376 CD GLU A 26 -7.407 12.327 0.268 1.00 10.00 C ATOM 377 OE1 GLU A 26 -8.547 12.041 -0.167 1.00 10.00 O ATOM 378 OE2 GLU A 26 -6.658 13.129 -0.336 1.00 10.00 O ATOM 0 H GLU A 26 -4.917 9.553 2.065 1.00 10.00 H new ATOM 0 HA GLU A 26 -7.047 8.171 1.056 1.00 10.00 H new ATOM 0 HB2 GLU A 26 -8.360 10.103 1.529 1.00 10.00 H new ATOM 0 HB3 GLU A 26 -7.143 9.911 2.776 1.00 10.00 H new ATOM 0 HG2 GLU A 26 -7.198 12.219 2.408 1.00 10.00 H new ATOM 0 HG3 GLU A 26 -5.777 11.696 1.525 1.00 10.00 H new ATOM 385 N GLU A 27 -5.846 10.177 -1.284 1.00 10.00 N ATOM 386 CA GLU A 27 -5.891 10.383 -2.737 1.00 10.00 C ATOM 387 C GLU A 27 -5.677 9.094 -3.522 1.00 10.00 C ATOM 388 O GLU A 27 -6.463 8.748 -4.403 1.00 10.00 O ATOM 389 CB GLU A 27 -4.888 11.435 -3.225 1.00 10.00 C ATOM 390 CG GLU A 27 -4.982 11.592 -4.763 1.00 10.00 C ATOM 391 CD GLU A 27 -4.796 13.014 -5.285 1.00 10.00 C ATOM 392 OE1 GLU A 27 -5.511 13.910 -4.764 1.00 10.00 O ATOM 393 OE2 GLU A 27 -4.033 13.180 -6.264 1.00 10.00 O ATOM 0 H GLU A 27 -5.094 10.681 -0.814 1.00 10.00 H new ATOM 0 HA GLU A 27 -6.900 10.749 -2.928 1.00 10.00 H new ATOM 0 HB2 GLU A 27 -5.089 12.391 -2.742 1.00 10.00 H new ATOM 0 HB3 GLU A 27 -3.877 11.142 -2.943 1.00 10.00 H new ATOM 0 HG2 GLU A 27 -4.230 10.952 -5.224 1.00 10.00 H new ATOM 0 HG3 GLU A 27 -5.955 11.227 -5.090 1.00 10.00 H new ATOM 400 N ILE A 28 -4.580 8.406 -3.212 1.00 10.00 N ATOM 401 CA ILE A 28 -4.161 7.226 -3.945 1.00 10.00 C ATOM 402 C ILE A 28 -5.163 6.089 -3.657 1.00 10.00 C ATOM 403 O ILE A 28 -5.418 5.256 -4.526 1.00 10.00 O ATOM 404 CB ILE A 28 -2.736 6.816 -3.514 1.00 10.00 C ATOM 405 CG1 ILE A 28 -1.740 7.976 -3.260 1.00 10.00 C ATOM 406 CG2 ILE A 28 -2.132 5.910 -4.602 1.00 10.00 C ATOM 407 CD1 ILE A 28 -1.485 8.950 -4.415 1.00 10.00 C ATOM 0 H ILE A 28 -3.959 8.656 -2.443 1.00 10.00 H new ATOM 0 HA ILE A 28 -4.144 7.435 -5.015 1.00 10.00 H new ATOM 0 HB ILE A 28 -2.867 6.319 -2.553 1.00 10.00 H new ATOM 0 HG12 ILE A 28 -2.102 8.551 -2.408 1.00 10.00 H new ATOM 0 HG13 ILE A 28 -0.784 7.542 -2.968 1.00 10.00 H new ATOM 0 HG21 ILE A 28 -1.125 5.613 -4.310 1.00 10.00 H new ATOM 0 HG22 ILE A 28 -2.752 5.022 -4.721 1.00 10.00 H new ATOM 0 HG23 ILE A 28 -2.091 6.453 -5.546 1.00 10.00 H new ATOM 0 HD11 ILE A 28 -0.770 9.709 -4.099 1.00 10.00 H new ATOM 0 HD12 ILE A 28 -1.082 8.405 -5.269 1.00 10.00 H new ATOM 0 HD13 ILE A 28 -2.421 9.430 -4.700 1.00 10.00 H new ATOM 419 N ASP A 29 -5.778 6.100 -2.465 1.00 10.00 N ATOM 420 CA ASP A 29 -6.870 5.215 -2.086 1.00 10.00 C ATOM 421 C ASP A 29 -8.144 5.529 -2.899 1.00 10.00 C ATOM 422 O ASP A 29 -8.696 4.618 -3.527 1.00 10.00 O ATOM 423 CB ASP A 29 -7.143 5.346 -0.568 1.00 10.00 C ATOM 424 CG ASP A 29 -6.031 4.853 0.367 1.00 10.00 C ATOM 425 OD1 ASP A 29 -5.296 3.901 0.047 1.00 10.00 O ATOM 426 OD2 ASP A 29 -5.999 5.350 1.522 1.00 10.00 O ATOM 0 H ASP A 29 -5.515 6.747 -1.722 1.00 10.00 H new ATOM 0 HA ASP A 29 -6.581 4.188 -2.308 1.00 10.00 H new ATOM 0 HB2 ASP A 29 -7.338 6.395 -0.345 1.00 10.00 H new ATOM 0 HB3 ASP A 29 -8.055 4.796 -0.335 1.00 10.00 H new ATOM 431 N ARG A 30 -8.630 6.787 -2.934 1.00 10.00 N ATOM 432 CA ARG A 30 -9.815 7.161 -3.734 1.00 10.00 C ATOM 433 C ARG A 30 -9.593 6.967 -5.239 1.00 10.00 C ATOM 434 O ARG A 30 -10.504 6.483 -5.909 1.00 10.00 O ATOM 435 CB ARG A 30 -10.355 8.564 -3.388 1.00 10.00 C ATOM 436 CG ARG A 30 -9.468 9.762 -3.764 1.00 10.00 C ATOM 437 CD ARG A 30 -10.073 11.127 -3.369 1.00 10.00 C ATOM 438 NE ARG A 30 -9.068 12.070 -2.844 1.00 10.00 N ATOM 439 CZ ARG A 30 -8.225 12.877 -3.476 1.00 10.00 C ATOM 440 NH1 ARG A 30 -8.139 12.964 -4.781 1.00 10.00 N ATOM 441 NH2 ARG A 30 -7.352 13.601 -2.831 1.00 10.00 N ATOM 0 H ARG A 30 -8.219 7.563 -2.416 1.00 10.00 H new ATOM 0 HA ARG A 30 -10.602 6.462 -3.450 1.00 10.00 H new ATOM 0 HB2 ARG A 30 -11.319 8.688 -3.881 1.00 10.00 H new ATOM 0 HB3 ARG A 30 -10.539 8.602 -2.314 1.00 10.00 H new ATOM 0 HG2 ARG A 30 -8.497 9.651 -3.281 1.00 10.00 H new ATOM 0 HG3 ARG A 30 -9.292 9.750 -4.840 1.00 10.00 H new ATOM 0 HD2 ARG A 30 -10.559 11.569 -4.239 1.00 10.00 H new ATOM 0 HD3 ARG A 30 -10.846 10.972 -2.617 1.00 10.00 H new ATOM 0 HE ARG A 30 -9.011 12.108 -1.826 1.00 10.00 H new ATOM 0 HH11 ARG A 30 -8.742 12.391 -5.371 1.00 10.00 H new ATOM 0 HH12 ARG A 30 -7.469 13.605 -5.206 1.00 10.00 H new ATOM 0 HH21 ARG A 30 -7.304 13.556 -1.813 1.00 10.00 H new ATOM 0 HH22 ARG A 30 -6.717 14.212 -3.345 1.00 10.00 H new ATOM 455 N ALA A 31 -8.388 7.245 -5.754 1.00 10.00 N ATOM 456 CA ALA A 31 -7.981 6.962 -7.136 1.00 10.00 C ATOM 457 C ALA A 31 -8.091 5.469 -7.516 1.00 10.00 C ATOM 458 O ALA A 31 -8.170 5.150 -8.701 1.00 10.00 O ATOM 459 CB ALA A 31 -6.554 7.474 -7.334 1.00 10.00 C ATOM 0 H ALA A 31 -7.649 7.685 -5.205 1.00 10.00 H new ATOM 0 HA ALA A 31 -8.671 7.480 -7.803 1.00 10.00 H new ATOM 0 HB1 ALA A 31 -6.234 7.272 -8.356 1.00 10.00 H new ATOM 0 HB2 ALA A 31 -6.524 8.548 -7.149 1.00 10.00 H new ATOM 0 HB3 ALA A 31 -5.886 6.967 -6.638 1.00 10.00 H new ATOM 465 N LEU A 32 -8.126 4.560 -6.529 1.00 10.00 N ATOM 466 CA LEU A 32 -8.282 3.111 -6.702 1.00 10.00 C ATOM 467 C LEU A 32 -9.572 2.588 -6.031 1.00 10.00 C ATOM 468 O LEU A 32 -9.751 1.380 -5.871 1.00 10.00 O ATOM 469 CB LEU A 32 -6.990 2.412 -6.222 1.00 10.00 C ATOM 470 CG LEU A 32 -5.686 2.938 -6.848 1.00 10.00 C ATOM 471 CD1 LEU A 32 -4.504 2.385 -6.042 1.00 10.00 C ATOM 472 CD2 LEU A 32 -5.548 2.534 -8.315 1.00 10.00 C ATOM 0 H LEU A 32 -8.043 4.828 -5.548 1.00 10.00 H new ATOM 0 HA LEU A 32 -8.413 2.871 -7.757 1.00 10.00 H new ATOM 0 HB2 LEU A 32 -6.921 2.516 -5.139 1.00 10.00 H new ATOM 0 HB3 LEU A 32 -7.072 1.346 -6.436 1.00 10.00 H new ATOM 0 HG LEU A 32 -5.701 4.027 -6.816 1.00 10.00 H new ATOM 0 HD11 LEU A 32 -3.570 2.747 -6.471 1.00 10.00 H new ATOM 0 HD12 LEU A 32 -4.581 2.719 -5.007 1.00 10.00 H new ATOM 0 HD13 LEU A 32 -4.520 1.296 -6.074 1.00 10.00 H new ATOM 0 HD21 LEU A 32 -4.613 2.927 -8.714 1.00 10.00 H new ATOM 0 HD22 LEU A 32 -5.548 1.447 -8.395 1.00 10.00 H new ATOM 0 HD23 LEU A 32 -6.385 2.939 -8.884 1.00 10.00 H new ATOM 484 N GLY A 33 -10.491 3.480 -5.630 1.00 10.00 N ATOM 485 CA GLY A 33 -11.789 3.157 -5.038 1.00 10.00 C ATOM 486 C GLY A 33 -11.751 2.502 -3.652 1.00 10.00 C ATOM 487 O GLY A 33 -12.790 2.050 -3.169 1.00 10.00 O ATOM 0 H GLY A 33 -10.340 4.485 -5.715 1.00 10.00 H new ATOM 0 HA2 GLY A 33 -12.373 4.075 -4.968 1.00 10.00 H new ATOM 0 HA3 GLY A 33 -12.321 2.492 -5.718 1.00 10.00 H new ATOM 491 N ILE A 34 -10.585 2.437 -2.999 1.00 10.00 N ATOM 492 CA ILE A 34 -10.340 1.648 -1.780 1.00 10.00 C ATOM 493 C ILE A 34 -11.376 1.886 -0.662 1.00 10.00 C ATOM 494 O ILE A 34 -11.878 0.889 -0.136 1.00 10.00 O ATOM 495 CB ILE A 34 -8.869 1.762 -1.317 1.00 10.00 C ATOM 496 CG1 ILE A 34 -7.936 1.382 -2.487 1.00 10.00 C ATOM 497 CG2 ILE A 34 -8.634 0.853 -0.103 1.00 10.00 C ATOM 498 CD1 ILE A 34 -6.452 1.266 -2.160 1.00 10.00 C ATOM 0 H ILE A 34 -9.759 2.947 -3.312 1.00 10.00 H new ATOM 0 HA ILE A 34 -10.495 0.603 -2.049 1.00 10.00 H new ATOM 0 HB ILE A 34 -8.651 2.787 -1.018 1.00 10.00 H new ATOM 0 HG12 ILE A 34 -8.271 0.429 -2.896 1.00 10.00 H new ATOM 0 HG13 ILE A 34 -8.055 2.126 -3.275 1.00 10.00 H new ATOM 0 HG21 ILE A 34 -7.596 0.937 0.219 1.00 10.00 H new ATOM 0 HG22 ILE A 34 -9.292 1.156 0.711 1.00 10.00 H new ATOM 0 HG23 ILE A 34 -8.847 -0.181 -0.376 1.00 10.00 H new ATOM 0 HD11 ILE A 34 -5.901 0.995 -3.061 1.00 10.00 H new ATOM 0 HD12 ILE A 34 -6.086 2.222 -1.785 1.00 10.00 H new ATOM 0 HD13 ILE A 34 -6.306 0.498 -1.400 1.00 10.00 H new ATOM 510 N PRO A 35 -11.773 3.125 -0.313 1.00 10.00 N ATOM 511 CA PRO A 35 -12.827 3.375 0.672 1.00 10.00 C ATOM 512 C PRO A 35 -14.190 2.742 0.336 1.00 10.00 C ATOM 513 O PRO A 35 -14.986 2.526 1.246 1.00 10.00 O ATOM 514 CB PRO A 35 -12.916 4.895 0.803 1.00 10.00 C ATOM 515 CG PRO A 35 -11.504 5.353 0.441 1.00 10.00 C ATOM 516 CD PRO A 35 -11.178 4.398 -0.706 1.00 10.00 C ATOM 0 HA PRO A 35 -12.566 2.892 1.614 1.00 10.00 H new ATOM 0 HB2 PRO A 35 -13.662 5.315 0.129 1.00 10.00 H new ATOM 0 HB3 PRO A 35 -13.192 5.198 1.813 1.00 10.00 H new ATOM 0 HG2 PRO A 35 -11.475 6.397 0.130 1.00 10.00 H new ATOM 0 HG3 PRO A 35 -10.810 5.250 1.275 1.00 10.00 H new ATOM 0 HD2 PRO A 35 -11.594 4.755 -1.648 1.00 10.00 H new ATOM 0 HD3 PRO A 35 -10.101 4.304 -0.848 1.00 10.00 H new ATOM 524 N GLU A 36 -14.463 2.410 -0.938 1.00 10.00 N ATOM 525 CA GLU A 36 -15.630 1.610 -1.327 1.00 10.00 C ATOM 526 C GLU A 36 -15.312 0.113 -1.347 1.00 10.00 C ATOM 527 O GLU A 36 -16.169 -0.686 -0.984 1.00 10.00 O ATOM 528 CB GLU A 36 -16.218 2.113 -2.662 1.00 10.00 C ATOM 529 CG GLU A 36 -17.441 1.320 -3.171 1.00 10.00 C ATOM 530 CD GLU A 36 -18.595 1.164 -2.168 1.00 10.00 C ATOM 531 OE1 GLU A 36 -18.698 1.991 -1.227 1.00 10.00 O ATOM 532 OE2 GLU A 36 -19.382 0.198 -2.338 1.00 10.00 O ATOM 0 H GLU A 36 -13.878 2.691 -1.725 1.00 10.00 H new ATOM 0 HA GLU A 36 -16.401 1.742 -0.567 1.00 10.00 H new ATOM 0 HB2 GLU A 36 -16.503 3.159 -2.546 1.00 10.00 H new ATOM 0 HB3 GLU A 36 -15.438 2.078 -3.422 1.00 10.00 H new ATOM 0 HG2 GLU A 36 -17.824 1.812 -4.065 1.00 10.00 H new ATOM 0 HG3 GLU A 36 -17.108 0.327 -3.472 1.00 10.00 H new ATOM 539 N LEU A 37 -14.079 -0.304 -1.674 1.00 10.00 N ATOM 540 CA LEU A 37 -13.638 -1.699 -1.514 1.00 10.00 C ATOM 541 C LEU A 37 -13.702 -2.165 -0.040 1.00 10.00 C ATOM 542 O LEU A 37 -13.939 -3.348 0.227 1.00 10.00 O ATOM 543 CB LEU A 37 -12.226 -1.901 -2.095 1.00 10.00 C ATOM 544 CG LEU A 37 -12.042 -1.477 -3.566 1.00 10.00 C ATOM 545 CD1 LEU A 37 -10.590 -1.747 -3.983 1.00 10.00 C ATOM 546 CD2 LEU A 37 -12.966 -2.216 -4.539 1.00 10.00 C ATOM 0 H LEU A 37 -13.362 0.313 -2.055 1.00 10.00 H new ATOM 0 HA LEU A 37 -14.333 -2.321 -2.077 1.00 10.00 H new ATOM 0 HB2 LEU A 37 -11.518 -1.342 -1.483 1.00 10.00 H new ATOM 0 HB3 LEU A 37 -11.963 -2.955 -2.004 1.00 10.00 H new ATOM 0 HG LEU A 37 -12.296 -0.418 -3.619 1.00 10.00 H new ATOM 0 HD11 LEU A 37 -10.449 -1.451 -5.022 1.00 10.00 H new ATOM 0 HD12 LEU A 37 -9.916 -1.173 -3.347 1.00 10.00 H new ATOM 0 HD13 LEU A 37 -10.372 -2.810 -3.876 1.00 10.00 H new ATOM 0 HD21 LEU A 37 -12.780 -1.866 -5.554 1.00 10.00 H new ATOM 0 HD22 LEU A 37 -12.771 -3.287 -4.483 1.00 10.00 H new ATOM 0 HD23 LEU A 37 -14.005 -2.022 -4.273 1.00 10.00 H new ATOM 558 N VAL A 38 -13.557 -1.227 0.903 1.00 10.00 N ATOM 559 CA VAL A 38 -13.810 -1.389 2.340 1.00 10.00 C ATOM 560 C VAL A 38 -15.271 -1.799 2.572 1.00 10.00 C ATOM 561 O VAL A 38 -15.527 -2.851 3.152 1.00 10.00 O ATOM 562 CB VAL A 38 -13.458 -0.095 3.096 1.00 10.00 C ATOM 563 CG1 VAL A 38 -14.019 -0.007 4.519 1.00 10.00 C ATOM 564 CG2 VAL A 38 -11.939 0.084 3.179 1.00 10.00 C ATOM 0 H VAL A 38 -13.243 -0.284 0.672 1.00 10.00 H new ATOM 0 HA VAL A 38 -13.172 -2.182 2.730 1.00 10.00 H new ATOM 0 HB VAL A 38 -13.929 0.696 2.512 1.00 10.00 H new ATOM 0 HG11 VAL A 38 -13.719 0.939 4.971 1.00 10.00 H new ATOM 0 HG12 VAL A 38 -15.107 -0.064 4.485 1.00 10.00 H new ATOM 0 HG13 VAL A 38 -13.631 -0.833 5.115 1.00 10.00 H new ATOM 0 HG21 VAL A 38 -11.710 1.004 3.717 1.00 10.00 H new ATOM 0 HG22 VAL A 38 -11.501 -0.763 3.707 1.00 10.00 H new ATOM 0 HG23 VAL A 38 -11.524 0.139 2.173 1.00 10.00 H new ATOM 765 N SER B 51 12.327 -9.263 -9.791 1.00 10.00 N ATOM 766 CA SER B 51 12.043 -8.268 -8.775 1.00 10.00 C ATOM 767 C SER B 51 11.599 -7.009 -9.519 1.00 10.00 C ATOM 768 O SER B 51 12.379 -6.415 -10.267 1.00 10.00 O ATOM 769 CB SER B 51 13.259 -8.018 -7.862 1.00 10.00 C ATOM 770 OG SER B 51 14.400 -7.522 -8.557 1.00 10.00 O ATOM 0 HA SER B 51 11.256 -8.608 -8.101 1.00 10.00 H new ATOM 0 HB2 SER B 51 12.979 -7.307 -7.085 1.00 10.00 H new ATOM 0 HB3 SER B 51 13.525 -8.949 -7.361 1.00 10.00 H new ATOM 0 HG SER B 51 14.109 -6.991 -9.327 1.00 10.00 H new ATOM 776 N ILE B 52 10.310 -6.661 -9.409 1.00 10.00 N ATOM 777 CA ILE B 52 9.714 -5.481 -10.045 1.00 10.00 C ATOM 778 C ILE B 52 9.771 -4.237 -9.141 1.00 10.00 C ATOM 779 O ILE B 52 9.404 -3.157 -9.589 1.00 10.00 O ATOM 780 CB ILE B 52 8.277 -5.746 -10.577 1.00 10.00 C ATOM 781 CG1 ILE B 52 7.790 -7.220 -10.592 1.00 10.00 C ATOM 782 CG2 ILE B 52 8.209 -5.204 -12.013 1.00 10.00 C ATOM 783 CD1 ILE B 52 7.244 -7.733 -9.248 1.00 10.00 C ATOM 0 H ILE B 52 9.640 -7.204 -8.864 1.00 10.00 H new ATOM 0 HA ILE B 52 10.332 -5.267 -10.917 1.00 10.00 H new ATOM 0 HB ILE B 52 7.613 -5.246 -9.871 1.00 10.00 H new ATOM 0 HG12 ILE B 52 7.011 -7.323 -11.348 1.00 10.00 H new ATOM 0 HG13 ILE B 52 8.618 -7.858 -10.899 1.00 10.00 H new ATOM 0 HG21 ILE B 52 7.212 -5.373 -12.419 1.00 10.00 H new ATOM 0 HG22 ILE B 52 8.422 -4.135 -12.009 1.00 10.00 H new ATOM 0 HG23 ILE B 52 8.945 -5.718 -12.631 1.00 10.00 H new ATOM 0 HD11 ILE B 52 6.928 -8.771 -9.356 1.00 10.00 H new ATOM 0 HD12 ILE B 52 8.024 -7.668 -8.490 1.00 10.00 H new ATOM 0 HD13 ILE B 52 6.392 -7.124 -8.945 1.00 10.00 H new ATOM 795 N SER B 53 10.235 -4.359 -7.883 1.00 10.00 N ATOM 796 CA SER B 53 10.402 -3.218 -6.959 1.00 10.00 C ATOM 797 C SER B 53 11.831 -2.870 -6.475 1.00 10.00 C ATOM 798 O SER B 53 11.914 -1.999 -5.621 1.00 10.00 O ATOM 799 CB SER B 53 9.420 -3.277 -5.772 1.00 10.00 C ATOM 800 OG SER B 53 9.493 -4.443 -4.979 1.00 10.00 O ATOM 0 H SER B 53 10.506 -5.254 -7.476 1.00 10.00 H new ATOM 0 HA SER B 53 10.155 -2.381 -7.612 1.00 10.00 H new ATOM 0 HB2 SER B 53 9.598 -2.412 -5.133 1.00 10.00 H new ATOM 0 HB3 SER B 53 8.405 -3.184 -6.158 1.00 10.00 H new ATOM 0 HG SER B 53 8.795 -5.072 -5.257 1.00 10.00 H new ATOM 806 N PRO B 54 12.979 -3.365 -6.995 1.00 10.00 N ATOM 807 CA PRO B 54 14.312 -2.906 -6.537 1.00 10.00 C ATOM 808 C PRO B 54 14.581 -1.419 -6.871 1.00 10.00 C ATOM 809 O PRO B 54 15.446 -0.781 -6.278 1.00 10.00 O ATOM 810 CB PRO B 54 15.325 -3.822 -7.219 1.00 10.00 C ATOM 811 CG PRO B 54 14.617 -4.122 -8.534 1.00 10.00 C ATOM 812 CD PRO B 54 13.156 -4.262 -8.121 1.00 10.00 C ATOM 0 HA PRO B 54 14.381 -2.963 -5.451 1.00 10.00 H new ATOM 0 HB2 PRO B 54 16.286 -3.331 -7.372 1.00 10.00 H new ATOM 0 HB3 PRO B 54 15.518 -4.725 -6.640 1.00 10.00 H new ATOM 0 HG2 PRO B 54 14.755 -3.319 -9.258 1.00 10.00 H new ATOM 0 HG3 PRO B 54 14.994 -5.035 -8.995 1.00 10.00 H new ATOM 0 HD2 PRO B 54 12.490 -3.996 -8.942 1.00 10.00 H new ATOM 0 HD3 PRO B 54 12.925 -5.290 -7.843 1.00 10.00 H new ATOM 820 N SER B 55 13.840 -0.862 -7.834 1.00 10.00 N ATOM 821 CA SER B 55 13.762 0.564 -8.176 1.00 10.00 C ATOM 822 C SER B 55 12.829 1.308 -7.212 1.00 10.00 C ATOM 823 O SER B 55 13.243 2.253 -6.545 1.00 10.00 O ATOM 824 CB SER B 55 13.295 0.667 -9.630 1.00 10.00 C ATOM 825 OG SER B 55 12.087 -0.060 -9.799 1.00 10.00 O ATOM 0 H SER B 55 13.241 -1.429 -8.434 1.00 10.00 H new ATOM 0 HA SER B 55 14.738 1.039 -8.075 1.00 10.00 H new ATOM 0 HB2 SER B 55 13.142 1.712 -9.899 1.00 10.00 H new ATOM 0 HB3 SER B 55 14.063 0.275 -10.297 1.00 10.00 H new ATOM 0 HG SER B 55 11.791 0.010 -10.731 1.00 10.00 H new ATOM 831 N ALA B 56 11.586 0.853 -7.074 1.00 10.00 N ATOM 832 CA ALA B 56 10.600 1.351 -6.116 1.00 10.00 C ATOM 833 C ALA B 56 11.068 1.264 -4.642 1.00 10.00 C ATOM 834 O ALA B 56 10.696 2.088 -3.814 1.00 10.00 O ATOM 835 CB ALA B 56 9.312 0.551 -6.372 1.00 10.00 C ATOM 0 H ALA B 56 11.222 0.095 -7.651 1.00 10.00 H new ATOM 0 HA ALA B 56 10.438 2.418 -6.267 1.00 10.00 H new ATOM 0 HB1 ALA B 56 8.535 0.881 -5.682 1.00 10.00 H new ATOM 0 HB2 ALA B 56 8.980 0.714 -7.397 1.00 10.00 H new ATOM 0 HB3 ALA B 56 9.506 -0.510 -6.218 1.00 10.00 H new ATOM 841 N LEU B 57 11.973 0.333 -4.326 1.00 10.00 N ATOM 842 CA LEU B 57 12.715 0.198 -3.075 1.00 10.00 C ATOM 843 C LEU B 57 13.531 1.447 -2.754 1.00 10.00 C ATOM 844 O LEU B 57 13.742 1.744 -1.583 1.00 10.00 O ATOM 845 CB LEU B 57 13.648 -1.019 -3.251 1.00 10.00 C ATOM 846 CG LEU B 57 14.785 -1.261 -2.241 1.00 10.00 C ATOM 847 CD1 LEU B 57 14.249 -1.556 -0.839 1.00 10.00 C ATOM 848 CD2 LEU B 57 15.650 -2.415 -2.769 1.00 10.00 C ATOM 0 H LEU B 57 12.223 -0.400 -4.990 1.00 10.00 H new ATOM 0 HA LEU B 57 12.024 0.064 -2.243 1.00 10.00 H new ATOM 0 HB2 LEU B 57 13.022 -1.911 -3.256 1.00 10.00 H new ATOM 0 HB3 LEU B 57 14.101 -0.942 -4.239 1.00 10.00 H new ATOM 0 HG LEU B 57 15.388 -0.358 -2.146 1.00 10.00 H new ATOM 0 HD11 LEU B 57 15.084 -1.721 -0.158 1.00 10.00 H new ATOM 0 HD12 LEU B 57 13.657 -0.710 -0.490 1.00 10.00 H new ATOM 0 HD13 LEU B 57 13.624 -2.448 -0.869 1.00 10.00 H new ATOM 0 HD21 LEU B 57 16.465 -2.608 -2.071 1.00 10.00 H new ATOM 0 HD22 LEU B 57 15.038 -3.312 -2.869 1.00 10.00 H new ATOM 0 HD23 LEU B 57 16.062 -2.146 -3.742 1.00 10.00 H new ATOM 860 N GLN B 58 13.988 2.162 -3.784 1.00 10.00 N ATOM 861 CA GLN B 58 14.590 3.474 -3.641 1.00 10.00 C ATOM 862 C GLN B 58 13.496 4.550 -3.760 1.00 10.00 C ATOM 863 O GLN B 58 13.229 5.288 -2.812 1.00 10.00 O ATOM 864 CB GLN B 58 15.687 3.637 -4.718 1.00 10.00 C ATOM 865 CG GLN B 58 16.802 2.585 -4.560 1.00 10.00 C ATOM 866 CD GLN B 58 17.547 2.363 -5.874 1.00 10.00 C ATOM 867 OE1 GLN B 58 18.391 3.151 -6.267 1.00 10.00 O ATOM 868 NE2 GLN B 58 17.274 1.293 -6.597 1.00 10.00 N ATOM 0 H GLN B 58 13.946 1.836 -4.749 1.00 10.00 H new ATOM 0 HA GLN B 58 15.057 3.586 -2.662 1.00 10.00 H new ATOM 0 HB2 GLN B 58 15.241 3.548 -5.708 1.00 10.00 H new ATOM 0 HB3 GLN B 58 16.117 4.636 -4.651 1.00 10.00 H new ATOM 0 HG2 GLN B 58 17.504 2.909 -3.792 1.00 10.00 H new ATOM 0 HG3 GLN B 58 16.371 1.643 -4.221 1.00 10.00 H new ATOM 0 HE21 GLN B 58 16.570 0.628 -6.278 1.00 10.00 H new ATOM 0 HE22 GLN B 58 17.767 1.131 -7.475 1.00 10.00 H new ATOM 877 N ASP B 59 12.804 4.595 -4.908 1.00 10.00 N ATOM 878 CA ASP B 59 11.912 5.710 -5.256 1.00 10.00 C ATOM 879 C ASP B 59 10.521 5.712 -4.629 1.00 10.00 C ATOM 880 O ASP B 59 10.049 6.775 -4.237 1.00 10.00 O ATOM 881 CB ASP B 59 11.760 5.755 -6.791 1.00 10.00 C ATOM 882 CG ASP B 59 11.811 7.198 -7.266 1.00 10.00 C ATOM 883 OD1 ASP B 59 12.772 7.904 -6.894 1.00 10.00 O ATOM 884 OD2 ASP B 59 10.827 7.663 -7.870 1.00 10.00 O ATOM 0 H ASP B 59 12.847 3.864 -5.618 1.00 10.00 H new ATOM 0 HA ASP B 59 12.399 6.590 -4.837 1.00 10.00 H new ATOM 0 HB2 ASP B 59 12.556 5.178 -7.262 1.00 10.00 H new ATOM 0 HB3 ASP B 59 10.816 5.297 -7.087 1.00 10.00 H new ATOM 889 N LEU B 60 9.841 4.565 -4.526 1.00 10.00 N ATOM 890 CA LEU B 60 8.501 4.511 -3.941 1.00 10.00 C ATOM 891 C LEU B 60 8.642 4.647 -2.421 1.00 10.00 C ATOM 892 O LEU B 60 7.885 5.367 -1.777 1.00 10.00 O ATOM 893 CB LEU B 60 7.784 3.223 -4.373 1.00 10.00 C ATOM 894 CG LEU B 60 6.257 3.343 -4.504 1.00 10.00 C ATOM 895 CD1 LEU B 60 5.707 2.036 -5.085 1.00 10.00 C ATOM 896 CD2 LEU B 60 5.555 3.628 -3.185 1.00 10.00 C ATOM 0 H LEU B 60 10.198 3.663 -4.841 1.00 10.00 H new ATOM 0 HA LEU B 60 7.878 5.331 -4.299 1.00 10.00 H new ATOM 0 HB2 LEU B 60 8.192 2.902 -5.331 1.00 10.00 H new ATOM 0 HB3 LEU B 60 8.011 2.439 -3.651 1.00 10.00 H new ATOM 0 HG LEU B 60 6.060 4.192 -5.158 1.00 10.00 H new ATOM 0 HD11 LEU B 60 4.624 2.109 -5.183 1.00 10.00 H new ATOM 0 HD12 LEU B 60 6.149 1.859 -6.066 1.00 10.00 H new ATOM 0 HD13 LEU B 60 5.957 1.209 -4.420 1.00 10.00 H new ATOM 0 HD21 LEU B 60 4.480 3.700 -3.353 1.00 10.00 H new ATOM 0 HD22 LEU B 60 5.759 2.820 -2.482 1.00 10.00 H new ATOM 0 HD23 LEU B 60 5.922 4.568 -2.773 1.00 10.00 H new ATOM 908 N LEU B 61 9.691 4.009 -1.876 1.00 10.00 N ATOM 909 CA LEU B 61 10.132 4.173 -0.496 1.00 10.00 C ATOM 910 C LEU B 61 10.358 5.658 -0.192 1.00 10.00 C ATOM 911 O LEU B 61 9.714 6.173 0.710 1.00 10.00 O ATOM 912 CB LEU B 61 11.348 3.263 -0.244 1.00 10.00 C ATOM 913 CG LEU B 61 11.755 3.147 1.235 1.00 10.00 C ATOM 914 CD1 LEU B 61 10.686 2.485 2.103 1.00 10.00 C ATOM 915 CD2 LEU B 61 13.058 2.357 1.411 1.00 10.00 C ATOM 0 H LEU B 61 10.265 3.350 -2.403 1.00 10.00 H new ATOM 0 HA LEU B 61 9.366 3.853 0.210 1.00 10.00 H new ATOM 0 HB2 LEU B 61 11.127 2.267 -0.627 1.00 10.00 H new ATOM 0 HB3 LEU B 61 12.196 3.643 -0.814 1.00 10.00 H new ATOM 0 HG LEU B 61 11.890 4.177 1.564 1.00 10.00 H new ATOM 0 HD11 LEU B 61 11.035 2.434 3.134 1.00 10.00 H new ATOM 0 HD12 LEU B 61 9.768 3.071 2.059 1.00 10.00 H new ATOM 0 HD13 LEU B 61 10.491 1.477 1.735 1.00 10.00 H new ATOM 0 HD21 LEU B 61 13.308 2.299 2.470 1.00 10.00 H new ATOM 0 HD22 LEU B 61 12.930 1.350 1.013 1.00 10.00 H new ATOM 0 HD23 LEU B 61 13.863 2.859 0.875 1.00 10.00 H new ATOM 927 N ARG B 62 11.169 6.378 -0.981 1.00 10.00 N ATOM 928 CA ARG B 62 11.347 7.829 -0.935 1.00 10.00 C ATOM 929 C ARG B 62 10.005 8.581 -1.015 1.00 10.00 C ATOM 930 O ARG B 62 9.752 9.468 -0.197 1.00 10.00 O ATOM 931 CB ARG B 62 12.297 8.159 -2.098 1.00 10.00 C ATOM 932 CG ARG B 62 12.530 9.638 -2.372 1.00 10.00 C ATOM 933 CD ARG B 62 13.012 9.963 -3.802 1.00 10.00 C ATOM 934 NE ARG B 62 12.071 9.604 -4.882 1.00 10.00 N ATOM 935 CZ ARG B 62 10.790 9.908 -5.021 1.00 10.00 C ATOM 936 NH1 ARG B 62 10.157 10.739 -4.231 1.00 10.00 N ATOM 937 NH2 ARG B 62 10.056 9.394 -5.976 1.00 10.00 N ATOM 0 H ARG B 62 11.744 5.940 -1.701 1.00 10.00 H new ATOM 0 HA ARG B 62 11.771 8.156 0.014 1.00 10.00 H new ATOM 0 HB2 ARG B 62 13.261 7.691 -1.897 1.00 10.00 H new ATOM 0 HB3 ARG B 62 11.902 7.700 -3.004 1.00 10.00 H new ATOM 0 HG2 ARG B 62 11.602 10.178 -2.185 1.00 10.00 H new ATOM 0 HG3 ARG B 62 13.266 10.013 -1.661 1.00 10.00 H new ATOM 0 HD2 ARG B 62 13.220 11.031 -3.864 1.00 10.00 H new ATOM 0 HD3 ARG B 62 13.955 9.444 -3.977 1.00 10.00 H new ATOM 0 HE ARG B 62 12.467 9.038 -5.632 1.00 10.00 H new ATOM 0 HH11 ARG B 62 10.653 11.189 -3.461 1.00 10.00 H new ATOM 0 HH12 ARG B 62 9.168 10.936 -4.385 1.00 10.00 H new ATOM 0 HH21 ARG B 62 10.469 8.739 -6.640 1.00 10.00 H new ATOM 0 HH22 ARG B 62 9.072 9.649 -6.056 1.00 10.00 H new ATOM 951 N THR B 63 9.155 8.217 -1.978 1.00 10.00 N ATOM 952 CA THR B 63 7.827 8.801 -2.273 1.00 10.00 C ATOM 953 C THR B 63 6.820 8.744 -1.132 1.00 10.00 C ATOM 954 O THR B 63 5.884 9.550 -1.161 1.00 10.00 O ATOM 955 CB THR B 63 7.275 8.173 -3.581 1.00 10.00 C ATOM 956 OG1 THR B 63 7.644 9.008 -4.655 1.00 10.00 O ATOM 957 CG2 THR B 63 5.802 7.836 -3.758 1.00 10.00 C ATOM 0 H THR B 63 9.383 7.457 -2.619 1.00 10.00 H new ATOM 0 HA THR B 63 7.980 9.872 -2.409 1.00 10.00 H new ATOM 0 HB THR B 63 7.724 7.181 -3.535 1.00 10.00 H new ATOM 0 HG1 THR B 63 6.929 9.656 -4.826 1.00 10.00 H new ATOM 0 HG21 THR B 63 5.643 7.408 -4.748 1.00 10.00 H new ATOM 0 HG22 THR B 63 5.500 7.116 -2.998 1.00 10.00 H new ATOM 0 HG23 THR B 63 5.206 8.743 -3.656 1.00 10.00 H new ATOM 965 N LEU B 64 7.010 7.846 -0.157 1.00 10.00 N ATOM 966 CA LEU B 64 6.223 7.814 1.076 1.00 10.00 C ATOM 967 C LEU B 64 7.032 8.059 2.361 1.00 10.00 C ATOM 968 O LEU B 64 6.439 8.440 3.373 1.00 10.00 O ATOM 969 CB LEU B 64 5.436 6.508 1.157 1.00 10.00 C ATOM 970 CG LEU B 64 3.932 6.748 1.368 1.00 10.00 C ATOM 971 CD1 LEU B 64 3.215 7.018 0.035 1.00 10.00 C ATOM 972 CD2 LEU B 64 3.379 5.491 2.001 1.00 10.00 C ATOM 0 H LEU B 64 7.721 7.116 -0.205 1.00 10.00 H new ATOM 0 HA LEU B 64 5.536 8.658 1.019 1.00 10.00 H new ATOM 0 HB2 LEU B 64 5.586 5.938 0.240 1.00 10.00 H new ATOM 0 HB3 LEU B 64 5.824 5.902 1.976 1.00 10.00 H new ATOM 0 HG LEU B 64 3.775 7.623 1.999 1.00 10.00 H new ATOM 0 HD11 LEU B 64 2.154 7.183 0.220 1.00 10.00 H new ATOM 0 HD12 LEU B 64 3.644 7.903 -0.436 1.00 10.00 H new ATOM 0 HD13 LEU B 64 3.339 6.160 -0.625 1.00 10.00 H new ATOM 0 HD21 LEU B 64 2.309 5.610 2.172 1.00 10.00 H new ATOM 0 HD22 LEU B 64 3.548 4.644 1.336 1.00 10.00 H new ATOM 0 HD23 LEU B 64 3.881 5.311 2.952 1.00 10.00 H new ATOM 984 N LYS B 65 8.363 7.870 2.345 1.00 10.00 N ATOM 985 CA LYS B 65 9.269 8.308 3.417 1.00 10.00 C ATOM 986 C LYS B 65 9.102 9.828 3.565 1.00 10.00 C ATOM 987 O LYS B 65 9.114 10.335 4.681 1.00 10.00 O ATOM 988 CB LYS B 65 10.728 7.911 3.122 1.00 10.00 C ATOM 989 CG LYS B 65 11.086 6.543 3.719 1.00 10.00 C ATOM 990 CD LYS B 65 12.578 6.220 3.522 1.00 10.00 C ATOM 991 CE LYS B 65 12.960 4.864 4.129 1.00 10.00 C ATOM 992 NZ LYS B 65 12.882 4.866 5.611 1.00 10.00 N ATOM 0 H LYS B 65 8.844 7.403 1.577 1.00 10.00 H new ATOM 0 HA LYS B 65 9.016 7.814 4.355 1.00 10.00 H new ATOM 0 HB2 LYS B 65 10.886 7.888 2.044 1.00 10.00 H new ATOM 0 HB3 LYS B 65 11.398 8.669 3.526 1.00 10.00 H new ATOM 0 HG2 LYS B 65 10.847 6.534 4.782 1.00 10.00 H new ATOM 0 HG3 LYS B 65 10.479 5.769 3.250 1.00 10.00 H new ATOM 0 HD2 LYS B 65 12.811 6.218 2.457 1.00 10.00 H new ATOM 0 HD3 LYS B 65 13.182 7.004 3.979 1.00 10.00 H new ATOM 0 HE2 LYS B 65 12.299 4.093 3.734 1.00 10.00 H new ATOM 0 HE3 LYS B 65 13.973 4.604 3.821 1.00 10.00 H new ATOM 0 HZ1 LYS B 65 13.230 3.957 5.978 1.00 10.00 H new ATOM 0 HZ2 LYS B 65 13.467 5.639 5.988 1.00 10.00 H new ATOM 0 HZ3 LYS B 65 11.894 5.004 5.906 1.00 10.00 H new ATOM 1006 N SER B 66 8.954 10.519 2.425 1.00 10.00 N ATOM 1007 CA SER B 66 8.500 11.903 2.358 1.00 10.00 C ATOM 1008 C SER B 66 6.987 11.775 2.670 1.00 10.00 C ATOM 1009 O SER B 66 6.269 11.183 1.867 1.00 10.00 O ATOM 1010 CB SER B 66 8.830 12.529 0.990 1.00 10.00 C ATOM 1011 OG SER B 66 8.545 11.702 -0.125 1.00 10.00 O ATOM 0 H SER B 66 9.152 10.117 1.509 1.00 10.00 H new ATOM 0 HA SER B 66 8.990 12.583 3.055 1.00 10.00 H new ATOM 0 HB2 SER B 66 8.271 13.459 0.887 1.00 10.00 H new ATOM 0 HB3 SER B 66 9.888 12.789 0.971 1.00 10.00 H new ATOM 0 HG SER B 66 9.292 11.086 -0.275 1.00 10.00 H new ATOM 1017 N PRO B 67 6.488 12.212 3.853 1.00 10.00 N ATOM 1018 CA PRO B 67 5.135 11.884 4.303 1.00 10.00 C ATOM 1019 C PRO B 67 3.985 12.270 3.389 1.00 10.00 C ATOM 1020 O PRO B 67 4.013 13.312 2.733 1.00 10.00 O ATOM 1021 CB PRO B 67 4.964 12.527 5.684 1.00 10.00 C ATOM 1022 CG PRO B 67 6.406 12.674 6.177 1.00 10.00 C ATOM 1023 CD PRO B 67 7.157 12.986 4.886 1.00 10.00 C ATOM 0 HA PRO B 67 5.067 10.796 4.313 1.00 10.00 H new ATOM 0 HB2 PRO B 67 4.459 13.491 5.621 1.00 10.00 H new ATOM 0 HB3 PRO B 67 4.372 11.900 6.350 1.00 10.00 H new ATOM 0 HG2 PRO B 67 6.506 13.474 6.910 1.00 10.00 H new ATOM 0 HG3 PRO B 67 6.770 11.762 6.650 1.00 10.00 H new ATOM 0 HD2 PRO B 67 7.125 14.052 4.661 1.00 10.00 H new ATOM 0 HD3 PRO B 67 8.208 12.709 4.966 1.00 10.00 H new ATOM 1031 N SER B 68 2.924 11.446 3.432 1.00 10.00 N ATOM 1032 CA SER B 68 1.757 11.531 2.551 1.00 10.00 C ATOM 1033 C SER B 68 1.068 12.893 2.574 1.00 10.00 C ATOM 1034 O SER B 68 0.501 13.285 1.569 1.00 10.00 O ATOM 1035 CB SER B 68 0.754 10.397 2.832 1.00 10.00 C ATOM 1036 OG SER B 68 -0.127 10.674 3.903 1.00 10.00 O ATOM 0 H SER B 68 2.857 10.681 4.103 1.00 10.00 H new ATOM 0 HA SER B 68 2.144 11.407 1.540 1.00 10.00 H new ATOM 0 HB2 SER B 68 0.170 10.208 1.931 1.00 10.00 H new ATOM 0 HB3 SER B 68 1.305 9.482 3.052 1.00 10.00 H new ATOM 0 HG SER B 68 -0.207 9.882 4.474 1.00 10.00 H new ATOM 1042 N SER B 69 1.182 13.648 3.674 1.00 10.00 N ATOM 1043 CA SER B 69 0.617 14.987 3.836 1.00 10.00 C ATOM 1044 C SER B 69 0.957 15.925 2.655 1.00 10.00 C ATOM 1045 O SER B 69 0.041 16.242 1.902 1.00 10.00 O ATOM 1046 CB SER B 69 0.955 15.551 5.228 1.00 10.00 C ATOM 1047 OG SER B 69 0.467 16.868 5.346 1.00 10.00 O ATOM 0 H SER B 69 1.687 13.330 4.501 1.00 10.00 H new ATOM 0 HA SER B 69 -0.470 14.911 3.797 1.00 10.00 H new ATOM 0 HB2 SER B 69 0.516 14.921 6.001 1.00 10.00 H new ATOM 0 HB3 SER B 69 2.034 15.539 5.382 1.00 10.00 H new ATOM 0 HG SER B 69 0.684 17.219 6.235 1.00 10.00 H new ATOM 1053 N PRO B 70 2.220 16.349 2.425 1.00 10.00 N ATOM 1054 CA PRO B 70 2.584 17.042 1.191 1.00 10.00 C ATOM 1055 C PRO B 70 2.587 16.114 -0.038 1.00 10.00 C ATOM 1056 O PRO B 70 2.451 16.600 -1.154 1.00 10.00 O ATOM 1057 CB PRO B 70 3.977 17.613 1.457 1.00 10.00 C ATOM 1058 CG PRO B 70 4.573 16.694 2.523 1.00 10.00 C ATOM 1059 CD PRO B 70 3.345 16.331 3.351 1.00 10.00 C ATOM 0 HA PRO B 70 1.854 17.815 0.949 1.00 10.00 H new ATOM 0 HB2 PRO B 70 4.584 17.616 0.552 1.00 10.00 H new ATOM 0 HB3 PRO B 70 3.923 18.644 1.807 1.00 10.00 H new ATOM 0 HG2 PRO B 70 5.045 15.814 2.086 1.00 10.00 H new ATOM 0 HG3 PRO B 70 5.332 17.200 3.119 1.00 10.00 H new ATOM 0 HD2 PRO B 70 3.459 15.348 3.808 1.00 10.00 H new ATOM 0 HD3 PRO B 70 3.195 17.044 4.161 1.00 10.00 H new ATOM 1067 N GLN B 71 2.743 14.788 0.145 1.00 10.00 N ATOM 1068 CA GLN B 71 2.947 13.804 -0.928 1.00 10.00 C ATOM 1069 C GLN B 71 1.666 13.173 -1.519 1.00 10.00 C ATOM 1070 O GLN B 71 1.737 12.185 -2.257 1.00 10.00 O ATOM 1071 CB GLN B 71 3.990 12.766 -0.453 1.00 10.00 C ATOM 1072 CG GLN B 71 5.406 13.376 -0.551 1.00 10.00 C ATOM 1073 CD GLN B 71 5.933 13.320 -1.985 1.00 10.00 C ATOM 1074 OE1 GLN B 71 5.392 13.883 -2.925 1.00 10.00 O ATOM 1075 NE2 GLN B 71 6.983 12.570 -2.235 1.00 10.00 N ATOM 0 H GLN B 71 2.730 14.363 1.072 1.00 10.00 H new ATOM 0 HA GLN B 71 3.334 14.345 -1.792 1.00 10.00 H new ATOM 0 HB2 GLN B 71 3.781 12.469 0.575 1.00 10.00 H new ATOM 0 HB3 GLN B 71 3.927 11.866 -1.064 1.00 10.00 H new ATOM 0 HG2 GLN B 71 5.384 14.411 -0.209 1.00 10.00 H new ATOM 0 HG3 GLN B 71 6.084 12.836 0.110 1.00 10.00 H new ATOM 0 HE21 GLN B 71 7.458 12.086 -1.473 1.00 10.00 H new ATOM 0 HE22 GLN B 71 7.323 12.472 -3.191 1.00 10.00 H new ATOM 1084 N GLN B 72 0.505 13.786 -1.237 1.00 10.00 N ATOM 1085 CA GLN B 72 -0.848 13.466 -1.723 1.00 10.00 C ATOM 1086 C GLN B 72 -0.970 13.214 -3.238 1.00 10.00 C ATOM 1087 O GLN B 72 -1.886 12.510 -3.664 1.00 10.00 O ATOM 1088 CB GLN B 72 -1.781 14.603 -1.230 1.00 10.00 C ATOM 1089 CG GLN B 72 -3.033 14.958 -2.070 1.00 10.00 C ATOM 1090 CD GLN B 72 -2.720 15.797 -3.316 1.00 10.00 C ATOM 1091 OE1 GLN B 72 -1.735 16.520 -3.393 1.00 10.00 O ATOM 1092 NE2 GLN B 72 -3.535 15.748 -4.355 1.00 10.00 N ATOM 0 H GLN B 72 0.487 14.589 -0.608 1.00 10.00 H new ATOM 0 HA GLN B 72 -1.140 12.500 -1.311 1.00 10.00 H new ATOM 0 HB2 GLN B 72 -2.120 14.341 -0.228 1.00 10.00 H new ATOM 0 HB3 GLN B 72 -1.179 15.507 -1.137 1.00 10.00 H new ATOM 0 HG2 GLN B 72 -3.527 14.036 -2.378 1.00 10.00 H new ATOM 0 HG3 GLN B 72 -3.738 15.503 -1.443 1.00 10.00 H new ATOM 0 HE21 GLN B 72 -4.365 15.156 -4.325 1.00 10.00 H new ATOM 0 HE22 GLN B 72 -3.334 16.302 -5.187 1.00 10.00 H new ATOM 1101 N GLN B 73 -0.099 13.797 -4.064 1.00 10.00 N ATOM 1102 CA GLN B 73 -0.215 13.690 -5.521 1.00 10.00 C ATOM 1103 C GLN B 73 -0.044 12.246 -6.033 1.00 10.00 C ATOM 1104 O GLN B 73 0.542 11.375 -5.394 1.00 10.00 O ATOM 1105 CB GLN B 73 0.807 14.608 -6.231 1.00 10.00 C ATOM 1106 CG GLN B 73 0.745 16.099 -5.861 1.00 10.00 C ATOM 1107 CD GLN B 73 1.594 16.411 -4.639 1.00 10.00 C ATOM 1108 OE1 GLN B 73 2.810 16.471 -4.720 1.00 10.00 O ATOM 1109 NE2 GLN B 73 0.995 16.590 -3.480 1.00 10.00 N ATOM 0 H GLN B 73 0.698 14.350 -3.748 1.00 10.00 H new ATOM 0 HA GLN B 73 -1.228 14.011 -5.763 1.00 10.00 H new ATOM 0 HB2 GLN B 73 1.809 14.241 -6.011 1.00 10.00 H new ATOM 0 HB3 GLN B 73 0.663 14.515 -7.307 1.00 10.00 H new ATOM 0 HG2 GLN B 73 1.088 16.698 -6.705 1.00 10.00 H new ATOM 0 HG3 GLN B 73 -0.289 16.383 -5.668 1.00 10.00 H new ATOM 0 HE21 GLN B 73 -0.022 16.539 -3.418 1.00 10.00 H new ATOM 0 HE22 GLN B 73 1.548 16.780 -2.644 1.00 10.00 H new ATOM 1118 N GLN B 74 -0.444 12.057 -7.296 1.00 10.00 N ATOM 1119 CA GLN B 74 -0.294 10.842 -8.103 1.00 10.00 C ATOM 1120 C GLN B 74 1.143 10.320 -8.237 1.00 10.00 C ATOM 1121 O GLN B 74 1.329 9.276 -8.855 1.00 10.00 O ATOM 1122 CB GLN B 74 -0.853 11.118 -9.518 1.00 10.00 C ATOM 1123 CG GLN B 74 -2.316 11.602 -9.532 1.00 10.00 C ATOM 1124 CD GLN B 74 -3.263 10.602 -8.875 1.00 10.00 C ATOM 1125 OE1 GLN B 74 -3.356 9.460 -9.285 1.00 10.00 O ATOM 1126 NE2 GLN B 74 -3.978 10.974 -7.827 1.00 10.00 N ATOM 0 H GLN B 74 -0.912 12.799 -7.816 1.00 10.00 H new ATOM 0 HA GLN B 74 -0.845 10.064 -7.575 1.00 10.00 H new ATOM 0 HB2 GLN B 74 -0.229 11.868 -10.004 1.00 10.00 H new ATOM 0 HB3 GLN B 74 -0.777 10.207 -10.111 1.00 10.00 H new ATOM 0 HG2 GLN B 74 -2.385 12.559 -9.014 1.00 10.00 H new ATOM 0 HG3 GLN B 74 -2.630 11.774 -10.562 1.00 10.00 H new ATOM 0 HE21 GLN B 74 -3.908 11.929 -7.475 1.00 10.00 H new ATOM 0 HE22 GLN B 74 -4.600 10.306 -7.371 1.00 10.00 H new ATOM 1135 N GLN B 75 2.156 10.987 -7.665 1.00 10.00 N ATOM 1136 CA GLN B 75 3.525 10.486 -7.616 1.00 10.00 C ATOM 1137 C GLN B 75 3.662 9.108 -6.989 1.00 10.00 C ATOM 1138 O GLN B 75 4.510 8.342 -7.443 1.00 10.00 O ATOM 1139 CB GLN B 75 4.466 11.481 -6.923 1.00 10.00 C ATOM 1140 CG GLN B 75 4.106 11.785 -5.460 1.00 10.00 C ATOM 1141 CD GLN B 75 4.985 11.178 -4.379 1.00 10.00 C ATOM 1142 OE1 GLN B 75 6.198 11.051 -4.505 1.00 10.00 O ATOM 1143 NE2 GLN B 75 4.379 10.771 -3.281 1.00 10.00 N ATOM 0 H GLN B 75 2.040 11.898 -7.221 1.00 10.00 H new ATOM 0 HA GLN B 75 3.821 10.379 -8.660 1.00 10.00 H new ATOM 0 HB2 GLN B 75 5.482 11.087 -6.960 1.00 10.00 H new ATOM 0 HB3 GLN B 75 4.466 12.415 -7.486 1.00 10.00 H new ATOM 0 HG2 GLN B 75 4.113 12.867 -5.330 1.00 10.00 H new ATOM 0 HG3 GLN B 75 3.083 11.450 -5.289 1.00 10.00 H new ATOM 0 HE21 GLN B 75 3.369 10.881 -3.185 1.00 10.00 H new ATOM 0 HE22 GLN B 75 4.920 10.346 -2.528 1.00 10.00 H new ATOM 1152 N VAL B 76 2.803 8.754 -6.013 1.00 10.00 N ATOM 1153 CA VAL B 76 2.839 7.384 -5.508 1.00 10.00 C ATOM 1154 C VAL B 76 2.339 6.469 -6.612 1.00 10.00 C ATOM 1155 O VAL B 76 3.020 5.508 -6.974 1.00 10.00 O ATOM 1156 CB VAL B 76 2.029 7.116 -4.229 1.00 10.00 C ATOM 1157 CG1 VAL B 76 2.578 5.847 -3.587 1.00 10.00 C ATOM 1158 CG2 VAL B 76 2.077 8.181 -3.150 1.00 10.00 C ATOM 0 H VAL B 76 2.112 9.368 -5.582 1.00 10.00 H new ATOM 0 HA VAL B 76 3.874 7.195 -5.225 1.00 10.00 H new ATOM 0 HB VAL B 76 0.994 7.066 -4.568 1.00 10.00 H new ATOM 0 HG11 VAL B 76 2.022 5.631 -2.675 1.00 10.00 H new ATOM 0 HG12 VAL B 76 2.474 5.014 -4.282 1.00 10.00 H new ATOM 0 HG13 VAL B 76 3.631 5.988 -3.345 1.00 10.00 H new ATOM 0 HG21 VAL B 76 1.465 7.869 -2.304 1.00 10.00 H new ATOM 0 HG22 VAL B 76 3.107 8.320 -2.821 1.00 10.00 H new ATOM 0 HG23 VAL B 76 1.694 9.120 -3.549 1.00 10.00 H new ATOM 1168 N LEU B 77 1.173 6.807 -7.170 1.00 10.00 N ATOM 1169 CA LEU B 77 0.464 5.982 -8.135 1.00 10.00 C ATOM 1170 C LEU B 77 1.340 5.745 -9.396 1.00 10.00 C ATOM 1171 O LEU B 77 1.408 4.637 -9.935 1.00 10.00 O ATOM 1172 CB LEU B 77 -0.908 6.613 -8.426 1.00 10.00 C ATOM 1173 CG LEU B 77 -2.038 5.568 -8.544 1.00 10.00 C ATOM 1174 CD1 LEU B 77 -3.404 6.253 -8.527 1.00 10.00 C ATOM 1175 CD2 LEU B 77 -1.909 4.737 -9.822 1.00 10.00 C ATOM 0 H LEU B 77 0.691 7.680 -6.955 1.00 10.00 H new ATOM 0 HA LEU B 77 0.272 4.989 -7.729 1.00 10.00 H new ATOM 0 HB2 LEU B 77 -1.154 7.318 -7.632 1.00 10.00 H new ATOM 0 HB3 LEU B 77 -0.850 7.184 -9.353 1.00 10.00 H new ATOM 0 HG LEU B 77 -1.949 4.901 -7.687 1.00 10.00 H new ATOM 0 HD11 LEU B 77 -4.189 5.501 -8.611 1.00 10.00 H new ATOM 0 HD12 LEU B 77 -3.525 6.801 -7.592 1.00 10.00 H new ATOM 0 HD13 LEU B 77 -3.474 6.946 -9.365 1.00 10.00 H new ATOM 0 HD21 LEU B 77 -2.722 4.013 -9.869 1.00 10.00 H new ATOM 0 HD22 LEU B 77 -1.958 5.394 -10.690 1.00 10.00 H new ATOM 0 HD23 LEU B 77 -0.954 4.211 -9.819 1.00 10.00 H new ATOM 1187 N ASN B 78 2.081 6.792 -9.796 1.00 10.00 N ATOM 1188 CA ASN B 78 3.031 6.768 -10.904 1.00 10.00 C ATOM 1189 C ASN B 78 4.218 5.825 -10.688 1.00 10.00 C ATOM 1190 O ASN B 78 4.738 5.296 -11.674 1.00 10.00 O ATOM 1191 CB ASN B 78 3.506 8.205 -11.188 1.00 10.00 C ATOM 1192 CG ASN B 78 4.288 8.302 -12.489 1.00 10.00 C ATOM 1193 OD1 ASN B 78 3.857 7.778 -13.510 1.00 10.00 O ATOM 1194 ND2 ASN B 78 5.443 8.929 -12.496 1.00 10.00 N ATOM 0 H ASN B 78 2.029 7.702 -9.339 1.00 10.00 H new ATOM 0 HA ASN B 78 2.507 6.364 -11.770 1.00 10.00 H new ATOM 0 HB2 ASN B 78 2.643 8.869 -11.234 1.00 10.00 H new ATOM 0 HB3 ASN B 78 4.130 8.550 -10.364 1.00 10.00 H new ATOM 0 HD21 ASN B 78 5.989 8.983 -13.356 1.00 10.00 H new ATOM 0 HD22 ASN B 78 5.793 9.362 -11.642 1.00 10.00 H new ATOM 1201 N ILE B 79 4.645 5.562 -9.450 1.00 10.00 N ATOM 1202 CA ILE B 79 5.669 4.537 -9.189 1.00 10.00 C ATOM 1203 C ILE B 79 5.000 3.175 -8.938 1.00 10.00 C ATOM 1204 O ILE B 79 5.423 2.173 -9.522 1.00 10.00 O ATOM 1205 CB ILE B 79 6.643 4.977 -8.073 1.00 10.00 C ATOM 1206 CG1 ILE B 79 7.284 6.362 -8.375 1.00 10.00 C ATOM 1207 CG2 ILE B 79 7.790 3.961 -7.919 1.00 10.00 C ATOM 1208 CD1 ILE B 79 7.640 7.122 -7.098 1.00 10.00 C ATOM 0 H ILE B 79 4.303 6.039 -8.616 1.00 10.00 H new ATOM 0 HA ILE B 79 6.294 4.418 -10.074 1.00 10.00 H new ATOM 0 HB ILE B 79 6.053 5.038 -7.158 1.00 10.00 H new ATOM 0 HG12 ILE B 79 8.183 6.222 -8.975 1.00 10.00 H new ATOM 0 HG13 ILE B 79 6.593 6.959 -8.971 1.00 10.00 H new ATOM 0 HG21 ILE B 79 8.464 4.290 -7.128 1.00 10.00 H new ATOM 0 HG22 ILE B 79 7.379 2.985 -7.663 1.00 10.00 H new ATOM 0 HG23 ILE B 79 8.340 3.888 -8.857 1.00 10.00 H new ATOM 0 HD11 ILE B 79 8.084 8.083 -7.358 1.00 10.00 H new ATOM 0 HD12 ILE B 79 6.738 7.287 -6.509 1.00 10.00 H new ATOM 0 HD13 ILE B 79 8.352 6.539 -6.514 1.00 10.00 H new ATOM 1220 N LEU B 80 3.916 3.155 -8.151 1.00 10.00 N ATOM 1221 CA LEU B 80 3.028 2.018 -7.864 1.00 10.00 C ATOM 1222 C LEU B 80 2.748 1.162 -9.100 1.00 10.00 C ATOM 1223 O LEU B 80 3.027 -0.035 -9.073 1.00 10.00 O ATOM 1224 CB LEU B 80 1.700 2.542 -7.289 1.00 10.00 C ATOM 1225 CG LEU B 80 1.573 2.618 -5.760 1.00 10.00 C ATOM 1226 CD1 LEU B 80 0.454 3.550 -5.284 1.00 10.00 C ATOM 1227 CD2 LEU B 80 1.179 1.238 -5.246 1.00 10.00 C ATOM 0 H LEU B 80 3.613 3.997 -7.661 1.00 10.00 H new ATOM 0 HA LEU B 80 3.536 1.381 -7.140 1.00 10.00 H new ATOM 0 HB2 LEU B 80 1.529 3.541 -7.691 1.00 10.00 H new ATOM 0 HB3 LEU B 80 0.897 1.906 -7.663 1.00 10.00 H new ATOM 0 HG LEU B 80 2.531 2.984 -5.392 1.00 10.00 H new ATOM 0 HD11 LEU B 80 0.423 3.554 -4.194 1.00 10.00 H new ATOM 0 HD12 LEU B 80 0.644 4.561 -5.646 1.00 10.00 H new ATOM 0 HD13 LEU B 80 -0.502 3.199 -5.673 1.00 10.00 H new ATOM 0 HD21 LEU B 80 1.083 1.268 -4.161 1.00 10.00 H new ATOM 0 HD22 LEU B 80 0.226 0.944 -5.687 1.00 10.00 H new ATOM 0 HD23 LEU B 80 1.946 0.514 -5.523 1.00 10.00 H new ATOM 1239 N LYS B 81 2.218 1.756 -10.187 1.00 10.00 N ATOM 1240 CA LYS B 81 1.761 0.975 -11.347 1.00 10.00 C ATOM 1241 C LYS B 81 2.874 0.158 -12.050 1.00 10.00 C ATOM 1242 O LYS B 81 2.568 -0.706 -12.864 1.00 10.00 O ATOM 1243 CB LYS B 81 0.908 1.826 -12.317 1.00 10.00 C ATOM 1244 CG LYS B 81 1.589 2.460 -13.549 1.00 10.00 C ATOM 1245 CD LYS B 81 2.581 3.579 -13.219 1.00 10.00 C ATOM 1246 CE LYS B 81 3.220 4.074 -14.518 1.00 10.00 C ATOM 1247 NZ LYS B 81 4.185 5.176 -14.284 1.00 10.00 N ATOM 0 H LYS B 81 2.098 2.764 -10.284 1.00 10.00 H new ATOM 0 HA LYS B 81 1.100 0.209 -10.942 1.00 10.00 H new ATOM 0 HB2 LYS B 81 0.093 1.198 -12.678 1.00 10.00 H new ATOM 0 HB3 LYS B 81 0.457 2.632 -11.739 1.00 10.00 H new ATOM 0 HG2 LYS B 81 2.112 1.679 -14.102 1.00 10.00 H new ATOM 0 HG3 LYS B 81 0.819 2.857 -14.210 1.00 10.00 H new ATOM 0 HD2 LYS B 81 2.070 4.399 -12.714 1.00 10.00 H new ATOM 0 HD3 LYS B 81 3.348 3.213 -12.537 1.00 10.00 H new ATOM 0 HE2 LYS B 81 3.730 3.245 -15.009 1.00 10.00 H new ATOM 0 HE3 LYS B 81 2.439 4.415 -15.198 1.00 10.00 H new ATOM 0 HZ1 LYS B 81 4.818 5.263 -15.105 1.00 10.00 H new ATOM 0 HZ2 LYS B 81 3.667 6.068 -14.149 1.00 10.00 H new ATOM 0 HZ3 LYS B 81 4.747 4.970 -13.434 1.00 10.00 H new ATOM 1261 N SER B 82 4.152 0.428 -11.741 1.00 10.00 N ATOM 1262 CA SER B 82 5.310 -0.315 -12.256 1.00 10.00 C ATOM 1263 C SER B 82 5.534 -1.678 -11.583 1.00 10.00 C ATOM 1264 O SER B 82 6.132 -2.546 -12.206 1.00 10.00 O ATOM 1265 CB SER B 82 6.596 0.509 -12.151 1.00 10.00 C ATOM 1266 OG SER B 82 7.013 0.698 -10.816 1.00 10.00 O ATOM 0 H SER B 82 4.414 1.187 -11.111 1.00 10.00 H new ATOM 0 HA SER B 82 5.069 -0.506 -13.302 1.00 10.00 H new ATOM 0 HB2 SER B 82 7.389 0.010 -12.708 1.00 10.00 H new ATOM 0 HB3 SER B 82 6.440 1.481 -12.620 1.00 10.00 H new ATOM 0 HG SER B 82 6.271 1.064 -10.290 1.00 10.00 H new ATOM 1272 N ASN B 83 5.014 -1.911 -10.369 1.00 10.00 N ATOM 1273 CA ASN B 83 5.059 -3.216 -9.719 1.00 10.00 C ATOM 1274 C ASN B 83 3.626 -3.743 -9.505 1.00 10.00 C ATOM 1275 O ASN B 83 2.973 -3.324 -8.548 1.00 10.00 O ATOM 1276 CB ASN B 83 5.896 -3.166 -8.440 1.00 10.00 C ATOM 1277 CG ASN B 83 6.050 -4.548 -7.808 1.00 10.00 C ATOM 1278 OD1 ASN B 83 5.120 -5.333 -7.682 1.00 10.00 O ATOM 1279 ND2 ASN B 83 7.255 -4.866 -7.420 1.00 10.00 N ATOM 0 H ASN B 83 4.550 -1.192 -9.814 1.00 10.00 H new ATOM 0 HA ASN B 83 5.564 -3.932 -10.367 1.00 10.00 H new ATOM 0 HB2 ASN B 83 6.881 -2.758 -8.666 1.00 10.00 H new ATOM 0 HB3 ASN B 83 5.427 -2.490 -7.725 1.00 10.00 H new ATOM 0 HD21 ASN B 83 7.432 -5.781 -7.005 1.00 10.00 H new ATOM 0 HD22 ASN B 83 8.019 -4.200 -7.532 1.00 10.00 H new ATOM 1286 N PRO B 84 3.145 -4.665 -10.362 1.00 10.00 N ATOM 1287 CA PRO B 84 1.772 -5.170 -10.318 1.00 10.00 C ATOM 1288 C PRO B 84 1.401 -5.797 -8.973 1.00 10.00 C ATOM 1289 O PRO B 84 0.306 -5.560 -8.457 1.00 10.00 O ATOM 1290 CB PRO B 84 1.687 -6.197 -11.465 1.00 10.00 C ATOM 1291 CG PRO B 84 2.897 -5.896 -12.358 1.00 10.00 C ATOM 1292 CD PRO B 84 3.921 -5.349 -11.386 1.00 10.00 C ATOM 0 HA PRO B 84 1.058 -4.355 -10.435 1.00 10.00 H new ATOM 0 HB2 PRO B 84 1.722 -7.218 -11.084 1.00 10.00 H new ATOM 0 HB3 PRO B 84 0.753 -6.095 -12.018 1.00 10.00 H new ATOM 0 HG2 PRO B 84 3.259 -6.793 -12.861 1.00 10.00 H new ATOM 0 HG3 PRO B 84 2.653 -5.172 -13.135 1.00 10.00 H new ATOM 0 HD2 PRO B 84 4.523 -6.149 -10.956 1.00 10.00 H new ATOM 0 HD3 PRO B 84 4.609 -4.664 -11.882 1.00 10.00 H new ATOM 1300 N GLN B 85 2.327 -6.560 -8.372 1.00 10.00 N ATOM 1301 CA GLN B 85 2.107 -7.248 -7.107 1.00 10.00 C ATOM 1302 C GLN B 85 2.119 -6.284 -5.907 1.00 10.00 C ATOM 1303 O GLN B 85 1.285 -6.456 -5.015 1.00 10.00 O ATOM 1304 CB GLN B 85 3.135 -8.383 -6.957 1.00 10.00 C ATOM 1305 CG GLN B 85 2.988 -9.194 -5.659 1.00 10.00 C ATOM 1306 CD GLN B 85 1.630 -9.877 -5.511 1.00 10.00 C ATOM 1307 OE1 GLN B 85 1.466 -11.044 -5.820 1.00 10.00 O ATOM 1308 NE2 GLN B 85 0.626 -9.192 -4.992 1.00 10.00 N ATOM 0 H GLN B 85 3.257 -6.713 -8.761 1.00 10.00 H new ATOM 0 HA GLN B 85 1.108 -7.684 -7.117 1.00 10.00 H new ATOM 0 HB2 GLN B 85 3.042 -9.058 -7.807 1.00 10.00 H new ATOM 0 HB3 GLN B 85 4.138 -7.958 -6.996 1.00 10.00 H new ATOM 0 HG2 GLN B 85 3.771 -9.951 -5.624 1.00 10.00 H new ATOM 0 HG3 GLN B 85 3.146 -8.532 -4.808 1.00 10.00 H new ATOM 0 HE21 GLN B 85 0.756 -8.215 -4.731 1.00 10.00 H new ATOM 0 HE22 GLN B 85 -0.279 -9.641 -4.852 1.00 10.00 H new ATOM 1317 N LEU B 86 2.997 -5.269 -5.900 1.00 10.00 N ATOM 1318 CA LEU B 86 2.979 -4.171 -4.935 1.00 10.00 C ATOM 1319 C LEU B 86 1.701 -3.349 -5.121 1.00 10.00 C ATOM 1320 O LEU B 86 1.105 -2.969 -4.131 1.00 10.00 O ATOM 1321 CB LEU B 86 4.243 -3.297 -5.085 1.00 10.00 C ATOM 1322 CG LEU B 86 4.530 -2.216 -4.008 1.00 10.00 C ATOM 1323 CD1 LEU B 86 3.805 -0.898 -4.254 1.00 10.00 C ATOM 1324 CD2 LEU B 86 4.261 -2.616 -2.550 1.00 10.00 C ATOM 0 H LEU B 86 3.753 -5.192 -6.581 1.00 10.00 H new ATOM 0 HA LEU B 86 2.983 -4.576 -3.923 1.00 10.00 H new ATOM 0 HB2 LEU B 86 5.104 -3.964 -5.123 1.00 10.00 H new ATOM 0 HB3 LEU B 86 4.186 -2.795 -6.051 1.00 10.00 H new ATOM 0 HG LEU B 86 5.607 -2.097 -4.130 1.00 10.00 H new ATOM 0 HD11 LEU B 86 4.054 -0.192 -3.461 1.00 10.00 H new ATOM 0 HD12 LEU B 86 4.113 -0.487 -5.216 1.00 10.00 H new ATOM 0 HD13 LEU B 86 2.729 -1.071 -4.261 1.00 10.00 H new ATOM 0 HD21 LEU B 86 4.499 -1.779 -1.893 1.00 10.00 H new ATOM 0 HD22 LEU B 86 3.210 -2.882 -2.433 1.00 10.00 H new ATOM 0 HD23 LEU B 86 4.883 -3.472 -2.287 1.00 10.00 H new ATOM 1336 N MET B 87 1.216 -3.147 -6.350 1.00 10.00 N ATOM 1337 CA MET B 87 -0.086 -2.521 -6.608 1.00 10.00 C ATOM 1338 C MET B 87 -1.251 -3.304 -5.993 1.00 10.00 C ATOM 1339 O MET B 87 -2.039 -2.730 -5.240 1.00 10.00 O ATOM 1340 CB MET B 87 -0.284 -2.290 -8.120 1.00 10.00 C ATOM 1341 CG MET B 87 -0.542 -0.811 -8.404 1.00 10.00 C ATOM 1342 SD MET B 87 -2.122 -0.209 -7.754 1.00 10.00 S ATOM 1343 CE MET B 87 -2.013 1.504 -8.278 1.00 10.00 C ATOM 0 H MET B 87 1.717 -3.414 -7.198 1.00 10.00 H new ATOM 0 HA MET B 87 -0.084 -1.551 -6.111 1.00 10.00 H new ATOM 0 HB2 MET B 87 0.600 -2.622 -8.664 1.00 10.00 H new ATOM 0 HB3 MET B 87 -1.122 -2.887 -8.479 1.00 10.00 H new ATOM 0 HG2 MET B 87 0.267 -0.221 -7.973 1.00 10.00 H new ATOM 0 HG3 MET B 87 -0.516 -0.647 -9.481 1.00 10.00 H new ATOM 0 HE1 MET B 87 -2.969 1.818 -8.697 1.00 10.00 H new ATOM 0 HE2 MET B 87 -1.769 2.132 -7.421 1.00 10.00 H new ATOM 0 HE3 MET B 87 -1.235 1.604 -9.034 1.00 10.00 H new ATOM 1353 N ALA B 88 -1.349 -4.616 -6.249 1.00 10.00 N ATOM 1354 CA ALA B 88 -2.376 -5.430 -5.605 1.00 10.00 C ATOM 1355 C ALA B 88 -2.203 -5.485 -4.077 1.00 10.00 C ATOM 1356 O ALA B 88 -3.191 -5.333 -3.356 1.00 10.00 O ATOM 1357 CB ALA B 88 -2.386 -6.829 -6.217 1.00 10.00 C ATOM 0 H ALA B 88 -0.738 -5.125 -6.888 1.00 10.00 H new ATOM 0 HA ALA B 88 -3.342 -4.959 -5.786 1.00 10.00 H new ATOM 0 HB1 ALA B 88 -3.154 -7.432 -5.733 1.00 10.00 H new ATOM 0 HB2 ALA B 88 -2.599 -6.758 -7.284 1.00 10.00 H new ATOM 0 HB3 ALA B 88 -1.412 -7.297 -6.072 1.00 10.00 H new ATOM 1363 N ALA B 89 -0.973 -5.661 -3.578 1.00 10.00 N ATOM 1364 CA ALA B 89 -0.678 -5.641 -2.151 1.00 10.00 C ATOM 1365 C ALA B 89 -0.982 -4.282 -1.502 1.00 10.00 C ATOM 1366 O ALA B 89 -1.512 -4.273 -0.395 1.00 10.00 O ATOM 1367 CB ALA B 89 0.787 -6.036 -1.917 1.00 10.00 C ATOM 0 H ALA B 89 -0.153 -5.822 -4.163 1.00 10.00 H new ATOM 0 HA ALA B 89 -1.334 -6.368 -1.672 1.00 10.00 H new ATOM 0 HB1 ALA B 89 1.002 -6.019 -0.849 1.00 10.00 H new ATOM 0 HB2 ALA B 89 0.960 -7.039 -2.306 1.00 10.00 H new ATOM 0 HB3 ALA B 89 1.440 -5.330 -2.430 1.00 10.00 H new ATOM 1373 N PHE B 90 -0.722 -3.158 -2.190 1.00 10.00 N ATOM 1374 CA PHE B 90 -1.151 -1.816 -1.805 1.00 10.00 C ATOM 1375 C PHE B 90 -2.666 -1.815 -1.674 1.00 10.00 C ATOM 1376 O PHE B 90 -3.162 -1.634 -0.574 1.00 10.00 O ATOM 1377 CB PHE B 90 -0.679 -0.780 -2.834 1.00 10.00 C ATOM 1378 CG PHE B 90 -1.151 0.641 -2.559 1.00 10.00 C ATOM 1379 CD1 PHE B 90 -0.671 1.300 -1.420 1.00 10.00 C ATOM 1380 CD2 PHE B 90 -2.013 1.331 -3.438 1.00 10.00 C ATOM 1381 CE1 PHE B 90 -0.943 2.663 -1.209 1.00 10.00 C ATOM 1382 CE2 PHE B 90 -2.282 2.700 -3.222 1.00 10.00 C ATOM 1383 CZ PHE B 90 -1.709 3.372 -2.134 1.00 10.00 C ATOM 0 H PHE B 90 -0.188 -3.166 -3.059 1.00 10.00 H new ATOM 0 HA PHE B 90 -0.706 -1.542 -0.849 1.00 10.00 H new ATOM 0 HB2 PHE B 90 0.411 -0.788 -2.866 1.00 10.00 H new ATOM 0 HB3 PHE B 90 -1.029 -1.081 -3.821 1.00 10.00 H new ATOM 0 HD1 PHE B 90 -0.085 0.754 -0.695 1.00 10.00 H new ATOM 0 HD2 PHE B 90 -2.465 0.814 -4.272 1.00 10.00 H new ATOM 0 HE1 PHE B 90 -0.559 3.161 -0.331 1.00 10.00 H new ATOM 0 HE2 PHE B 90 -2.933 3.232 -3.899 1.00 10.00 H new ATOM 0 HZ PHE B 90 -1.860 4.434 -2.012 1.00 10.00 H new ATOM 1393 N ILE B 91 -3.409 -2.111 -2.756 1.00 10.00 N ATOM 1394 CA ILE B 91 -4.879 -2.126 -2.744 1.00 10.00 C ATOM 1395 C ILE B 91 -5.409 -2.979 -1.586 1.00 10.00 C ATOM 1396 O ILE B 91 -6.215 -2.497 -0.778 1.00 10.00 O ATOM 1397 CB ILE B 91 -5.440 -2.543 -4.132 1.00 10.00 C ATOM 1398 CG1 ILE B 91 -5.135 -1.432 -5.160 1.00 10.00 C ATOM 1399 CG2 ILE B 91 -6.967 -2.774 -4.050 1.00 10.00 C ATOM 1400 CD1 ILE B 91 -5.430 -1.780 -6.626 1.00 10.00 C ATOM 0 H ILE B 91 -3.005 -2.346 -3.662 1.00 10.00 H new ATOM 0 HA ILE B 91 -5.243 -1.115 -2.563 1.00 10.00 H new ATOM 0 HB ILE B 91 -4.964 -3.473 -4.443 1.00 10.00 H new ATOM 0 HG12 ILE B 91 -5.713 -0.547 -4.893 1.00 10.00 H new ATOM 0 HG13 ILE B 91 -4.082 -1.163 -5.075 1.00 10.00 H new ATOM 0 HG21 ILE B 91 -7.344 -3.065 -5.030 1.00 10.00 H new ATOM 0 HG22 ILE B 91 -7.177 -3.565 -3.330 1.00 10.00 H new ATOM 0 HG23 ILE B 91 -7.458 -1.854 -3.731 1.00 10.00 H new ATOM 0 HD11 ILE B 91 -5.179 -0.929 -7.259 1.00 10.00 H new ATOM 0 HD12 ILE B 91 -4.832 -2.642 -6.923 1.00 10.00 H new ATOM 0 HD13 ILE B 91 -6.488 -2.016 -6.738 1.00 10.00 H new ATOM 1412 N LYS B 92 -4.922 -4.222 -1.453 1.00 10.00 N ATOM 1413 CA LYS B 92 -5.311 -5.143 -0.395 1.00 10.00 C ATOM 1414 C LYS B 92 -4.980 -4.606 0.994 1.00 10.00 C ATOM 1415 O LYS B 92 -5.893 -4.442 1.798 1.00 10.00 O ATOM 1416 CB LYS B 92 -4.643 -6.505 -0.630 1.00 10.00 C ATOM 1417 CG LYS B 92 -5.191 -7.597 0.306 1.00 10.00 C ATOM 1418 CD LYS B 92 -6.679 -7.848 0.020 1.00 10.00 C ATOM 1419 CE LYS B 92 -7.130 -9.208 0.550 1.00 10.00 C ATOM 1420 NZ LYS B 92 -8.379 -9.620 -0.112 1.00 10.00 N ATOM 0 H LYS B 92 -4.234 -4.615 -2.095 1.00 10.00 H new ATOM 0 HA LYS B 92 -6.394 -5.258 -0.431 1.00 10.00 H new ATOM 0 HB2 LYS B 92 -4.796 -6.808 -1.666 1.00 10.00 H new ATOM 0 HB3 LYS B 92 -3.567 -6.409 -0.482 1.00 10.00 H new ATOM 0 HG2 LYS B 92 -4.627 -8.520 0.169 1.00 10.00 H new ATOM 0 HG3 LYS B 92 -5.060 -7.294 1.345 1.00 10.00 H new ATOM 0 HD2 LYS B 92 -7.277 -7.061 0.480 1.00 10.00 H new ATOM 0 HD3 LYS B 92 -6.858 -7.798 -1.054 1.00 10.00 H new ATOM 0 HE2 LYS B 92 -6.353 -9.952 0.373 1.00 10.00 H new ATOM 0 HE3 LYS B 92 -7.281 -9.155 1.628 1.00 10.00 H new ATOM 0 HZ1 LYS B 92 -8.677 -10.546 0.255 1.00 10.00 H new ATOM 0 HZ2 LYS B 92 -9.121 -8.917 0.078 1.00 10.00 H new ATOM 0 HZ3 LYS B 92 -8.222 -9.689 -1.138 1.00 10.00 H new ATOM 1434 N GLN B 93 -3.702 -4.339 1.282 1.00 10.00 N ATOM 1435 CA GLN B 93 -3.254 -3.945 2.609 1.00 10.00 C ATOM 1436 C GLN B 93 -3.796 -2.555 2.965 1.00 10.00 C ATOM 1437 O GLN B 93 -4.125 -2.366 4.123 1.00 10.00 O ATOM 1438 CB GLN B 93 -1.724 -4.056 2.733 1.00 10.00 C ATOM 1439 CG GLN B 93 -1.089 -4.103 4.153 1.00 10.00 C ATOM 1440 CD GLN B 93 -2.014 -4.093 5.372 1.00 10.00 C ATOM 1441 OE1 GLN B 93 -2.018 -3.061 6.207 1.00 10.00 O flip ATOM 1442 NE2 GLN B 93 -2.733 -5.046 5.618 1.00 10.00 N flip ATOM 0 H GLN B 93 -2.951 -4.392 0.594 1.00 10.00 H new ATOM 0 HA GLN B 93 -3.663 -4.637 3.345 1.00 10.00 H new ATOM 0 HB2 GLN B 93 -1.414 -4.957 2.203 1.00 10.00 H new ATOM 0 HB3 GLN B 93 -1.288 -3.209 2.204 1.00 10.00 H new ATOM 0 HG2 GLN B 93 -0.475 -5.002 4.211 1.00 10.00 H new ATOM 0 HG3 GLN B 93 -0.415 -3.251 4.242 1.00 10.00 H new ATOM 0 HE21 GLN B 93 -2.746 -5.850 4.991 1.00 10.00 H new ATOM 0 HE22 GLN B 93 -3.321 -5.039 6.451 1.00 10.00 H new ATOM 1451 N ARG B 94 -3.991 -1.607 2.029 1.00 10.00 N ATOM 1452 CA ARG B 94 -4.719 -0.352 2.291 1.00 10.00 C ATOM 1453 C ARG B 94 -6.159 -0.647 2.712 1.00 10.00 C ATOM 1454 O ARG B 94 -6.623 -0.105 3.715 1.00 10.00 O ATOM 1455 CB ARG B 94 -4.732 0.559 1.050 1.00 10.00 C ATOM 1456 CG ARG B 94 -3.387 1.200 0.673 1.00 10.00 C ATOM 1457 CD ARG B 94 -2.770 2.105 1.732 1.00 10.00 C ATOM 1458 NE ARG B 94 -3.633 3.235 2.114 1.00 10.00 N ATOM 1459 CZ ARG B 94 -3.504 3.947 3.223 1.00 10.00 C ATOM 1460 NH1 ARG B 94 -2.482 3.792 4.026 1.00 10.00 N ATOM 1461 NH2 ARG B 94 -4.379 4.854 3.559 1.00 10.00 N ATOM 0 H ARG B 94 -3.649 -1.690 1.072 1.00 10.00 H new ATOM 0 HA ARG B 94 -4.199 0.164 3.098 1.00 10.00 H new ATOM 0 HB2 ARG B 94 -5.086 -0.024 0.199 1.00 10.00 H new ATOM 0 HB3 ARG B 94 -5.458 1.355 1.215 1.00 10.00 H new ATOM 0 HG2 ARG B 94 -2.678 0.405 0.442 1.00 10.00 H new ATOM 0 HG3 ARG B 94 -3.524 1.780 -0.240 1.00 10.00 H new ATOM 0 HD2 ARG B 94 -2.546 1.513 2.619 1.00 10.00 H new ATOM 0 HD3 ARG B 94 -1.821 2.492 1.360 1.00 10.00 H new ATOM 0 HE ARG B 94 -4.387 3.489 1.476 1.00 10.00 H new ATOM 0 HH11 ARG B 94 -1.758 3.108 3.804 1.00 10.00 H new ATOM 0 HH12 ARG B 94 -2.409 4.355 4.874 1.00 10.00 H new ATOM 0 HH21 ARG B 94 -5.187 5.029 2.962 1.00 10.00 H new ATOM 0 HH22 ARG B 94 -4.255 5.388 4.419 1.00 10.00 H new ATOM 1475 N THR B 95 -6.868 -1.511 1.979 1.00 10.00 N ATOM 1476 CA THR B 95 -8.229 -1.912 2.346 1.00 10.00 C ATOM 1477 C THR B 95 -8.274 -2.544 3.744 1.00 10.00 C ATOM 1478 O THR B 95 -9.115 -2.179 4.566 1.00 10.00 O ATOM 1479 CB THR B 95 -8.890 -2.875 1.328 1.00 10.00 C ATOM 1480 OG1 THR B 95 -8.639 -2.576 -0.026 1.00 10.00 O ATOM 1481 CG2 THR B 95 -10.412 -2.726 1.430 1.00 10.00 C ATOM 0 H THR B 95 -6.520 -1.947 1.125 1.00 10.00 H new ATOM 0 HA THR B 95 -8.805 -0.987 2.342 1.00 10.00 H new ATOM 0 HB THR B 95 -8.482 -3.854 1.578 1.00 10.00 H new ATOM 0 HG1 THR B 95 -7.722 -2.835 -0.253 1.00 10.00 H new ATOM 0 HG21 THR B 95 -10.892 -3.398 0.719 1.00 10.00 H new ATOM 0 HG22 THR B 95 -10.735 -2.976 2.440 1.00 10.00 H new ATOM 0 HG23 THR B 95 -10.693 -1.697 1.203 1.00 10.00 H new ATOM 1489 N ALA B 96 -7.339 -3.458 4.037 1.00 10.00 N ATOM 1490 CA ALA B 96 -7.147 -4.062 5.356 1.00 10.00 C ATOM 1491 C ALA B 96 -6.814 -3.026 6.440 1.00 10.00 C ATOM 1492 O ALA B 96 -7.446 -3.035 7.494 1.00 10.00 O ATOM 1493 CB ALA B 96 -6.067 -5.141 5.266 1.00 10.00 C ATOM 0 H ALA B 96 -6.679 -3.805 3.341 1.00 10.00 H new ATOM 0 HA ALA B 96 -8.090 -4.517 5.659 1.00 10.00 H new ATOM 0 HB1 ALA B 96 -5.922 -5.593 6.247 1.00 10.00 H new ATOM 0 HB2 ALA B 96 -6.377 -5.908 4.556 1.00 10.00 H new ATOM 0 HB3 ALA B 96 -5.132 -4.693 4.931 1.00 10.00 H new ATOM 1499 N LYS B 97 -5.890 -2.087 6.165 1.00 10.00 N ATOM 1500 CA LYS B 97 -5.549 -0.954 7.036 1.00 10.00 C ATOM 1501 C LYS B 97 -6.798 -0.200 7.419 1.00 10.00 C ATOM 1502 O LYS B 97 -7.001 0.055 8.598 1.00 10.00 O ATOM 1503 CB LYS B 97 -4.422 -0.063 6.444 1.00 10.00 C ATOM 1504 CG LYS B 97 -4.739 1.387 6.037 1.00 10.00 C ATOM 1505 CD LYS B 97 -4.739 2.330 7.243 1.00 10.00 C ATOM 1506 CE LYS B 97 -5.638 3.549 7.044 1.00 10.00 C ATOM 1507 NZ LYS B 97 -5.661 4.426 8.236 1.00 10.00 N ATOM 0 H LYS B 97 -5.345 -2.099 5.303 1.00 10.00 H new ATOM 0 HA LYS B 97 -5.119 -1.342 7.960 1.00 10.00 H new ATOM 0 HB2 LYS B 97 -3.615 -0.028 7.176 1.00 10.00 H new ATOM 0 HB3 LYS B 97 -4.032 -0.572 5.563 1.00 10.00 H new ATOM 0 HG2 LYS B 97 -4.004 1.729 5.309 1.00 10.00 H new ATOM 0 HG3 LYS B 97 -5.713 1.423 5.548 1.00 10.00 H new ATOM 0 HD2 LYS B 97 -5.068 1.782 8.126 1.00 10.00 H new ATOM 0 HD3 LYS B 97 -3.720 2.664 7.437 1.00 10.00 H new ATOM 0 HE2 LYS B 97 -5.290 4.119 6.182 1.00 10.00 H new ATOM 0 HE3 LYS B 97 -6.652 3.218 6.819 1.00 10.00 H new ATOM 0 HZ1 LYS B 97 -6.096 5.338 7.988 1.00 10.00 H new ATOM 0 HZ2 LYS B 97 -6.215 3.972 8.990 1.00 10.00 H new ATOM 0 HZ3 LYS B 97 -4.689 4.585 8.568 1.00 10.00 H new ATOM 1521 N TYR B 98 -7.671 0.124 6.458 1.00 10.00 N ATOM 1522 CA TYR B 98 -8.935 0.782 6.768 1.00 10.00 C ATOM 1523 C TYR B 98 -9.781 -0.049 7.739 1.00 10.00 C ATOM 1524 O TYR B 98 -10.031 0.409 8.845 1.00 10.00 O ATOM 1525 CB TYR B 98 -9.703 1.143 5.502 1.00 10.00 C ATOM 1526 CG TYR B 98 -9.175 2.351 4.764 1.00 10.00 C ATOM 1527 CD1 TYR B 98 -9.125 3.589 5.422 1.00 10.00 C ATOM 1528 CD2 TYR B 98 -8.819 2.247 3.409 1.00 10.00 C ATOM 1529 CE1 TYR B 98 -8.732 4.731 4.709 1.00 10.00 C ATOM 1530 CE2 TYR B 98 -8.476 3.389 2.669 1.00 10.00 C ATOM 1531 CZ TYR B 98 -8.445 4.646 3.325 1.00 10.00 C ATOM 1532 OH TYR B 98 -8.124 5.774 2.650 1.00 10.00 O ATOM 0 H TYR B 98 -7.522 -0.060 5.466 1.00 10.00 H new ATOM 0 HA TYR B 98 -8.701 1.718 7.275 1.00 10.00 H new ATOM 0 HB2 TYR B 98 -9.687 0.287 4.828 1.00 10.00 H new ATOM 0 HB3 TYR B 98 -10.746 1.322 5.765 1.00 10.00 H new ATOM 0 HD1 TYR B 98 -9.387 3.662 6.467 1.00 10.00 H new ATOM 0 HD2 TYR B 98 -8.809 1.278 2.932 1.00 10.00 H new ATOM 0 HE1 TYR B 98 -8.648 5.680 5.218 1.00 10.00 H new ATOM 0 HE2 TYR B 98 -8.240 3.312 1.618 1.00 10.00 H new ATOM 0 HH TYR B 98 -7.150 5.839 2.566 1.00 10.00 H new ATOM 1542 N VAL B 99 -10.174 -1.281 7.389 1.00 10.00 N ATOM 1543 CA VAL B 99 -11.064 -2.066 8.271 1.00 10.00 C ATOM 1544 C VAL B 99 -10.441 -2.400 9.636 1.00 10.00 C ATOM 1545 O VAL B 99 -11.176 -2.659 10.588 1.00 10.00 O ATOM 1546 CB VAL B 99 -11.625 -3.324 7.582 1.00 10.00 C ATOM 1547 CG1 VAL B 99 -12.501 -2.950 6.377 1.00 10.00 C ATOM 1548 CG2 VAL B 99 -10.535 -4.286 7.106 1.00 10.00 C ATOM 0 H VAL B 99 -9.901 -1.751 6.526 1.00 10.00 H new ATOM 0 HA VAL B 99 -11.907 -1.406 8.475 1.00 10.00 H new ATOM 0 HB VAL B 99 -12.219 -3.830 8.343 1.00 10.00 H new ATOM 0 HG11 VAL B 99 -12.884 -3.857 5.910 1.00 10.00 H new ATOM 0 HG12 VAL B 99 -13.336 -2.334 6.711 1.00 10.00 H new ATOM 0 HG13 VAL B 99 -11.906 -2.393 5.654 1.00 10.00 H new ATOM 0 HG21 VAL B 99 -10.996 -5.151 6.630 1.00 10.00 H new ATOM 0 HG22 VAL B 99 -9.889 -3.778 6.389 1.00 10.00 H new ATOM 0 HG23 VAL B 99 -9.942 -4.615 7.959 1.00 10.00 H new