USER MOD reduce.3.24.130724 H: found=0, std=0, add=665, rem=0, adj=17 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= 0.686 K(o=2.8,f=-4.9!) USER MOD Set 1.2: B 81 LYS NZ :NH3+ 154:sc= 2.16 (180deg=-0.32) USER MOD Set 2.1: B 63 THR OG1 : rot -67:sc= 1.14 USER MOD Set 2.2: B 75 GLN : amide:sc= 0.382 K(o=1.5,f=-5.1) USER MOD Set 3.1: B 72 GLN : amide:sc= 1.79 K(o=4.6,f=-3.5!) USER MOD Set 3.2: B 73 GLN : amide:sc= 1.6 K(o=4.6,f=-0.28) USER MOD Set 3.3: B 74 GLN : amide:sc= 1.26 K(o=4.6,f=2.3) USER MOD Set 4.1: B 66 SER OG : rot -87:sc= 2.03 USER MOD Set 4.2: B 71 GLN : amide:sc= 0.404 K(o=2.4,f=-0.32) USER MOD Set 5.1: A 18 SER OG : rot -96:sc= 2.08 USER MOD Set 5.2: B 93 GLN : amide:sc= -0.0033 K(o=2.1,f=0.67) USER MOD Single : A 12 GLN : amide:sc= 0.971 K(o=0.97,f=-1.2) USER MOD Single : A 14 HIS : no HD1:sc= -0.672 K(o=-0.67,f=-6.7!) USER MOD Single : A 15 THR OG1 : rot 98:sc= 1.16 USER MOD Single : A 19 ASN : amide:sc= 1.38 K(o=1.4,f=-4.3!) USER MOD Single : A 20 THR OG1 : rot -66:sc= 1.26 USER MOD Single : A 23 THR OG1 : rot 95:sc= 1.13 USER MOD Single : B 51 SER OG : rot 27:sc= 0.231 USER MOD Single : B 53 SER OG : rot -94:sc= 1.07 USER MOD Single : B 55 SER OG : rot 180:sc= 0.0287 USER MOD Single : B 58 GLN : amide:sc= 0.439 K(o=0.44,f=-0.6) USER MOD Single : B 65 LYS NZ :NH3+ -144:sc= 0.945 (180deg=0.317) USER MOD Single : B 68 SER OG : rot -166:sc= 1.22 USER MOD Single : B 69 SER OG : rot 180:sc= 0 USER MOD Single : B 82 SER OG : rot -82:sc= 1.21 USER MOD Single : B 83 ASN : amide:sc= -2.82 K(o=-2.8,f=-9.3!) USER MOD Single : B 85 GLN : amide:sc= 0.755 K(o=0.76,f=-0.054) USER MOD Single : B 87 MET CE :methyl 180:sc= -0.514 (180deg=-0.514) USER MOD Single : B 92 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 95 THR OG1 : rot -9:sc= 0.589 USER MOD Single : B 97 LYS NZ :NH3+ -166:sc= 1.28 (180deg=1.1) USER MOD Single : B 98 TYR OH : rot 111:sc= 1.1 USER MOD ----------------------------------------------------------------- ATOM 65 N GLU A 6 12.357 -9.568 -3.738 1.00 10.00 N ATOM 66 CA GLU A 6 11.052 -9.005 -4.022 1.00 10.00 C ATOM 67 C GLU A 6 10.098 -9.214 -2.857 1.00 10.00 C ATOM 68 O GLU A 6 9.537 -8.237 -2.391 1.00 10.00 O ATOM 69 CB GLU A 6 10.475 -9.591 -5.304 1.00 10.00 C ATOM 70 CG GLU A 6 9.175 -8.910 -5.770 1.00 10.00 C ATOM 71 CD GLU A 6 9.316 -7.406 -6.058 1.00 10.00 C ATOM 72 OE1 GLU A 6 10.391 -6.961 -6.511 1.00 10.00 O ATOM 73 OE2 GLU A 6 8.322 -6.665 -5.881 1.00 10.00 O ATOM 0 HA GLU A 6 11.177 -7.932 -4.164 1.00 10.00 H new ATOM 0 HB2 GLU A 6 11.220 -9.511 -6.096 1.00 10.00 H new ATOM 0 HB3 GLU A 6 10.283 -10.653 -5.153 1.00 10.00 H new ATOM 0 HG2 GLU A 6 8.821 -9.409 -6.672 1.00 10.00 H new ATOM 0 HG3 GLU A 6 8.411 -9.052 -5.006 1.00 10.00 H new ATOM 80 N ARG A 7 9.889 -10.447 -2.379 1.00 10.00 N ATOM 81 CA ARG A 7 8.865 -10.699 -1.354 1.00 10.00 C ATOM 82 C ARG A 7 9.144 -9.922 -0.071 1.00 10.00 C ATOM 83 O ARG A 7 8.242 -9.267 0.438 1.00 10.00 O ATOM 84 CB ARG A 7 8.701 -12.219 -1.137 1.00 10.00 C ATOM 85 CG ARG A 7 7.280 -12.653 -0.727 1.00 10.00 C ATOM 86 CD ARG A 7 6.977 -12.494 0.763 1.00 10.00 C ATOM 87 NE ARG A 7 7.856 -13.360 1.566 1.00 10.00 N ATOM 88 CZ ARG A 7 8.752 -12.991 2.465 1.00 10.00 C ATOM 89 NH1 ARG A 7 8.809 -11.776 2.948 1.00 10.00 N ATOM 90 NH2 ARG A 7 9.642 -13.854 2.901 1.00 10.00 N ATOM 0 H ARG A 7 10.405 -11.274 -2.679 1.00 10.00 H new ATOM 0 HA ARG A 7 7.905 -10.322 -1.707 1.00 10.00 H new ATOM 0 HB2 ARG A 7 8.975 -12.737 -2.056 1.00 10.00 H new ATOM 0 HB3 ARG A 7 9.403 -12.542 -0.368 1.00 10.00 H new ATOM 0 HG2 ARG A 7 6.556 -12.070 -1.297 1.00 10.00 H new ATOM 0 HG3 ARG A 7 7.138 -13.697 -1.005 1.00 10.00 H new ATOM 0 HD2 ARG A 7 7.114 -11.454 1.058 1.00 10.00 H new ATOM 0 HD3 ARG A 7 5.934 -12.746 0.956 1.00 10.00 H new ATOM 0 HE ARG A 7 7.763 -14.364 1.410 1.00 10.00 H new ATOM 0 HH11 ARG A 7 8.145 -11.070 2.632 1.00 10.00 H new ATOM 0 HH12 ARG A 7 9.518 -11.535 3.641 1.00 10.00 H new ATOM 0 HH21 ARG A 7 9.642 -14.810 2.546 1.00 10.00 H new ATOM 0 HH22 ARG A 7 10.333 -13.568 3.595 1.00 10.00 H new ATOM 104 N ALA A 8 10.392 -9.933 0.400 1.00 10.00 N ATOM 105 CA ALA A 8 10.784 -9.162 1.581 1.00 10.00 C ATOM 106 C ALA A 8 10.708 -7.642 1.352 1.00 10.00 C ATOM 107 O ALA A 8 10.250 -6.924 2.253 1.00 10.00 O ATOM 108 CB ALA A 8 12.190 -9.605 1.977 1.00 10.00 C ATOM 0 H ALA A 8 11.151 -10.469 -0.020 1.00 10.00 H new ATOM 0 HA ALA A 8 10.082 -9.361 2.391 1.00 10.00 H new ATOM 0 HB1 ALA A 8 12.513 -9.048 2.856 1.00 10.00 H new ATOM 0 HB2 ALA A 8 12.185 -10.671 2.204 1.00 10.00 H new ATOM 0 HB3 ALA A 8 12.878 -9.413 1.153 1.00 10.00 H new ATOM 114 N LEU A 9 11.101 -7.136 0.168 1.00 10.00 N ATOM 115 CA LEU A 9 11.042 -5.690 -0.063 1.00 10.00 C ATOM 116 C LEU A 9 9.612 -5.201 -0.358 1.00 10.00 C ATOM 117 O LEU A 9 9.239 -4.121 0.091 1.00 10.00 O ATOM 118 CB LEU A 9 12.231 -5.202 -0.919 1.00 10.00 C ATOM 119 CG LEU A 9 12.063 -4.606 -2.323 1.00 10.00 C ATOM 120 CD1 LEU A 9 11.763 -5.709 -3.321 1.00 10.00 C ATOM 121 CD2 LEU A 9 11.073 -3.437 -2.402 1.00 10.00 C ATOM 0 H LEU A 9 11.450 -7.688 -0.615 1.00 10.00 H new ATOM 0 HA LEU A 9 11.227 -5.137 0.858 1.00 10.00 H new ATOM 0 HB2 LEU A 9 12.752 -4.451 -0.325 1.00 10.00 H new ATOM 0 HB3 LEU A 9 12.906 -6.051 -1.023 1.00 10.00 H new ATOM 0 HG LEU A 9 13.015 -4.148 -2.590 1.00 10.00 H new ATOM 0 HD11 LEU A 9 11.645 -5.278 -4.315 1.00 10.00 H new ATOM 0 HD12 LEU A 9 12.585 -6.424 -3.331 1.00 10.00 H new ATOM 0 HD13 LEU A 9 10.843 -6.218 -3.035 1.00 10.00 H new ATOM 0 HD21 LEU A 9 11.016 -3.077 -3.429 1.00 10.00 H new ATOM 0 HD22 LEU A 9 10.087 -3.773 -2.080 1.00 10.00 H new ATOM 0 HD23 LEU A 9 11.411 -2.629 -1.753 1.00 10.00 H new ATOM 133 N LEU A 10 8.782 -6.032 -1.005 1.00 10.00 N ATOM 134 CA LEU A 10 7.332 -5.900 -1.212 1.00 10.00 C ATOM 135 C LEU A 10 6.631 -5.787 0.148 1.00 10.00 C ATOM 136 O LEU A 10 5.822 -4.881 0.327 1.00 10.00 O ATOM 137 CB LEU A 10 6.869 -7.144 -2.001 1.00 10.00 C ATOM 138 CG LEU A 10 5.372 -7.473 -2.093 1.00 10.00 C ATOM 139 CD1 LEU A 10 4.606 -6.439 -2.898 1.00 10.00 C ATOM 140 CD2 LEU A 10 5.219 -8.834 -2.783 1.00 10.00 C ATOM 0 H LEU A 10 9.138 -6.886 -1.433 1.00 10.00 H new ATOM 0 HA LEU A 10 7.081 -5.002 -1.776 1.00 10.00 H new ATOM 0 HB2 LEU A 10 7.243 -7.041 -3.020 1.00 10.00 H new ATOM 0 HB3 LEU A 10 7.367 -8.010 -1.565 1.00 10.00 H new ATOM 0 HG LEU A 10 4.965 -7.482 -1.082 1.00 10.00 H new ATOM 0 HD11 LEU A 10 3.552 -6.715 -2.935 1.00 10.00 H new ATOM 0 HD12 LEU A 10 4.709 -5.462 -2.427 1.00 10.00 H new ATOM 0 HD13 LEU A 10 5.006 -6.397 -3.911 1.00 10.00 H new ATOM 0 HD21 LEU A 10 4.161 -9.087 -2.858 1.00 10.00 H new ATOM 0 HD22 LEU A 10 5.653 -8.786 -3.782 1.00 10.00 H new ATOM 0 HD23 LEU A 10 5.734 -9.598 -2.200 1.00 10.00 H new ATOM 152 N ASP A 11 6.983 -6.657 1.096 1.00 10.00 N ATOM 153 CA ASP A 11 6.505 -6.600 2.478 1.00 10.00 C ATOM 154 C ASP A 11 6.806 -5.271 3.171 1.00 10.00 C ATOM 155 O ASP A 11 5.866 -4.618 3.635 1.00 10.00 O ATOM 156 CB ASP A 11 6.982 -7.828 3.270 1.00 10.00 C ATOM 157 CG ASP A 11 6.123 -9.075 3.008 1.00 10.00 C ATOM 158 OD1 ASP A 11 4.888 -8.919 2.835 1.00 10.00 O ATOM 159 OD2 ASP A 11 6.699 -10.189 3.036 1.00 10.00 O ATOM 0 H ASP A 11 7.620 -7.435 0.922 1.00 10.00 H new ATOM 0 HA ASP A 11 5.416 -6.641 2.446 1.00 10.00 H new ATOM 0 HB2 ASP A 11 8.018 -8.044 3.008 1.00 10.00 H new ATOM 0 HB3 ASP A 11 6.964 -7.597 4.335 1.00 10.00 H new ATOM 164 N GLN A 12 8.067 -4.807 3.212 1.00 10.00 N ATOM 165 CA GLN A 12 8.327 -3.485 3.805 1.00 10.00 C ATOM 166 C GLN A 12 7.697 -2.336 3.002 1.00 10.00 C ATOM 167 O GLN A 12 7.317 -1.327 3.601 1.00 10.00 O ATOM 168 CB GLN A 12 9.823 -3.288 4.118 1.00 10.00 C ATOM 169 CG GLN A 12 10.797 -3.211 2.947 1.00 10.00 C ATOM 170 CD GLN A 12 10.897 -1.858 2.256 1.00 10.00 C ATOM 171 OE1 GLN A 12 11.296 -0.857 2.830 1.00 10.00 O ATOM 172 NE2 GLN A 12 10.540 -1.791 0.993 1.00 10.00 N ATOM 0 H GLN A 12 8.887 -5.301 2.860 1.00 10.00 H new ATOM 0 HA GLN A 12 7.815 -3.455 4.767 1.00 10.00 H new ATOM 0 HB2 GLN A 12 9.925 -2.370 4.697 1.00 10.00 H new ATOM 0 HB3 GLN A 12 10.140 -4.108 4.762 1.00 10.00 H new ATOM 0 HG2 GLN A 12 11.788 -3.489 3.305 1.00 10.00 H new ATOM 0 HG3 GLN A 12 10.505 -3.955 2.206 1.00 10.00 H new ATOM 0 HE21 GLN A 12 10.207 -2.627 0.512 1.00 10.00 H new ATOM 0 HE22 GLN A 12 10.596 -0.903 0.493 1.00 10.00 H new ATOM 181 N LEU A 13 7.488 -2.488 1.686 1.00 10.00 N ATOM 182 CA LEU A 13 6.905 -1.440 0.845 1.00 10.00 C ATOM 183 C LEU A 13 5.381 -1.351 1.012 1.00 10.00 C ATOM 184 O LEU A 13 4.853 -0.237 1.087 1.00 10.00 O ATOM 185 CB LEU A 13 7.352 -1.668 -0.609 1.00 10.00 C ATOM 186 CG LEU A 13 7.230 -0.476 -1.577 1.00 10.00 C ATOM 187 CD1 LEU A 13 7.879 0.786 -1.002 1.00 10.00 C ATOM 188 CD2 LEU A 13 7.957 -0.837 -2.872 1.00 10.00 C ATOM 0 H LEU A 13 7.719 -3.342 1.178 1.00 10.00 H new ATOM 0 HA LEU A 13 7.273 -0.464 1.163 1.00 10.00 H new ATOM 0 HB2 LEU A 13 8.394 -1.988 -0.596 1.00 10.00 H new ATOM 0 HB3 LEU A 13 6.770 -2.495 -1.016 1.00 10.00 H new ATOM 0 HG LEU A 13 6.172 -0.275 -1.746 1.00 10.00 H new ATOM 0 HD11 LEU A 13 7.773 1.606 -1.713 1.00 10.00 H new ATOM 0 HD12 LEU A 13 7.389 1.052 -0.065 1.00 10.00 H new ATOM 0 HD13 LEU A 13 8.937 0.600 -0.818 1.00 10.00 H new ATOM 0 HD21 LEU A 13 7.884 -0.006 -3.574 1.00 10.00 H new ATOM 0 HD22 LEU A 13 9.006 -1.038 -2.656 1.00 10.00 H new ATOM 0 HD23 LEU A 13 7.500 -1.724 -3.311 1.00 10.00 H new ATOM 200 N HIS A 14 4.659 -2.477 1.118 1.00 10.00 N ATOM 201 CA HIS A 14 3.224 -2.429 1.448 1.00 10.00 C ATOM 202 C HIS A 14 2.997 -2.072 2.921 1.00 10.00 C ATOM 203 O HIS A 14 2.028 -1.374 3.229 1.00 10.00 O ATOM 204 CB HIS A 14 2.457 -3.672 0.994 1.00 10.00 C ATOM 205 CG HIS A 14 2.590 -4.904 1.853 1.00 10.00 C ATOM 206 ND1 HIS A 14 2.123 -5.036 3.161 1.00 10.00 N ATOM 207 CD2 HIS A 14 3.120 -6.094 1.452 1.00 10.00 C ATOM 208 CE1 HIS A 14 2.421 -6.287 3.530 1.00 10.00 C ATOM 209 NE2 HIS A 14 3.033 -6.946 2.531 1.00 10.00 N ATOM 0 H HIS A 14 5.035 -3.416 0.983 1.00 10.00 H new ATOM 0 HA HIS A 14 2.793 -1.616 0.863 1.00 10.00 H new ATOM 0 HB2 HIS A 14 1.400 -3.415 0.931 1.00 10.00 H new ATOM 0 HB3 HIS A 14 2.785 -3.924 -0.015 1.00 10.00 H new ATOM 0 HD2 HIS A 14 3.528 -6.324 0.479 1.00 10.00 H new ATOM 0 HE1 HIS A 14 2.200 -6.710 4.499 1.00 10.00 H new ATOM 0 HE2 HIS A 14 3.373 -7.907 2.566 1.00 10.00 H new ATOM 217 N THR A 15 3.940 -2.421 3.818 1.00 10.00 N ATOM 218 CA THR A 15 3.957 -1.947 5.214 1.00 10.00 C ATOM 219 C THR A 15 4.065 -0.433 5.248 1.00 10.00 C ATOM 220 O THR A 15 3.201 0.223 5.818 1.00 10.00 O ATOM 221 CB THR A 15 5.089 -2.569 6.046 1.00 10.00 C ATOM 222 OG1 THR A 15 5.043 -3.972 5.976 1.00 10.00 O ATOM 223 CG2 THR A 15 4.946 -2.222 7.532 1.00 10.00 C ATOM 0 H THR A 15 4.716 -3.044 3.592 1.00 10.00 H new ATOM 0 HA THR A 15 3.018 -2.266 5.666 1.00 10.00 H new ATOM 0 HB THR A 15 6.019 -2.173 5.638 1.00 10.00 H new ATOM 0 HG1 THR A 15 5.686 -4.287 5.307 1.00 10.00 H new ATOM 0 HG21 THR A 15 5.763 -2.677 8.092 1.00 10.00 H new ATOM 0 HG22 THR A 15 4.979 -1.140 7.658 1.00 10.00 H new ATOM 0 HG23 THR A 15 3.995 -2.602 7.904 1.00 10.00 H new ATOM 231 N LEU A 16 5.084 0.136 4.589 1.00 10.00 N ATOM 232 CA LEU A 16 5.249 1.580 4.417 1.00 10.00 C ATOM 233 C LEU A 16 3.951 2.236 3.938 1.00 10.00 C ATOM 234 O LEU A 16 3.514 3.201 4.556 1.00 10.00 O ATOM 235 CB LEU A 16 6.389 1.828 3.416 1.00 10.00 C ATOM 236 CG LEU A 16 6.613 3.300 3.020 1.00 10.00 C ATOM 237 CD1 LEU A 16 7.538 4.009 4.006 1.00 10.00 C ATOM 238 CD2 LEU A 16 7.138 3.355 1.587 1.00 10.00 C ATOM 0 H LEU A 16 5.829 -0.408 4.154 1.00 10.00 H new ATOM 0 HA LEU A 16 5.497 2.031 5.378 1.00 10.00 H new ATOM 0 HB2 LEU A 16 7.314 1.439 3.841 1.00 10.00 H new ATOM 0 HB3 LEU A 16 6.187 1.253 2.512 1.00 10.00 H new ATOM 0 HG LEU A 16 5.665 3.836 3.062 1.00 10.00 H new ATOM 0 HD11 LEU A 16 7.674 5.045 3.696 1.00 10.00 H new ATOM 0 HD12 LEU A 16 7.096 3.983 5.002 1.00 10.00 H new ATOM 0 HD13 LEU A 16 8.505 3.506 4.024 1.00 10.00 H new ATOM 0 HD21 LEU A 16 7.299 4.394 1.298 1.00 10.00 H new ATOM 0 HD22 LEU A 16 8.080 2.810 1.523 1.00 10.00 H new ATOM 0 HD23 LEU A 16 6.410 2.901 0.915 1.00 10.00 H new ATOM 250 N LEU A 17 3.319 1.737 2.874 1.00 10.00 N ATOM 251 CA LEU A 17 2.074 2.322 2.379 1.00 10.00 C ATOM 252 C LEU A 17 0.858 2.157 3.320 1.00 10.00 C ATOM 253 O LEU A 17 -0.116 2.905 3.197 1.00 10.00 O ATOM 254 CB LEU A 17 1.788 1.796 0.981 1.00 10.00 C ATOM 255 CG LEU A 17 2.669 2.367 -0.155 1.00 10.00 C ATOM 256 CD1 LEU A 17 2.913 1.336 -1.256 1.00 10.00 C ATOM 257 CD2 LEU A 17 2.122 3.623 -0.826 1.00 10.00 C ATOM 0 H LEU A 17 3.648 0.932 2.341 1.00 10.00 H new ATOM 0 HA LEU A 17 2.229 3.400 2.344 1.00 10.00 H new ATOM 0 HB2 LEU A 17 1.903 0.712 0.992 1.00 10.00 H new ATOM 0 HB3 LEU A 17 0.745 2.004 0.743 1.00 10.00 H new ATOM 0 HG LEU A 17 3.594 2.632 0.358 1.00 10.00 H new ATOM 0 HD11 LEU A 17 3.536 1.776 -2.035 1.00 10.00 H new ATOM 0 HD12 LEU A 17 3.418 0.467 -0.835 1.00 10.00 H new ATOM 0 HD13 LEU A 17 1.959 1.029 -1.685 1.00 10.00 H new ATOM 0 HD21 LEU A 17 2.809 3.946 -1.608 1.00 10.00 H new ATOM 0 HD22 LEU A 17 1.148 3.406 -1.266 1.00 10.00 H new ATOM 0 HD23 LEU A 17 2.017 4.415 -0.085 1.00 10.00 H new ATOM 269 N SER A 18 0.892 1.235 4.285 1.00 10.00 N ATOM 270 CA SER A 18 -0.277 0.875 5.098 1.00 10.00 C ATOM 271 C SER A 18 -0.038 0.997 6.611 1.00 10.00 C ATOM 272 O SER A 18 -0.877 0.605 7.418 1.00 10.00 O ATOM 273 CB SER A 18 -0.780 -0.502 4.688 1.00 10.00 C ATOM 274 OG SER A 18 0.192 -1.492 4.987 1.00 10.00 O ATOM 0 H SER A 18 1.734 0.713 4.527 1.00 10.00 H new ATOM 0 HA SER A 18 -1.060 1.606 4.894 1.00 10.00 H new ATOM 0 HB2 SER A 18 -1.710 -0.727 5.210 1.00 10.00 H new ATOM 0 HB3 SER A 18 -1.003 -0.512 3.621 1.00 10.00 H new ATOM 0 HG SER A 18 0.730 -1.673 4.189 1.00 10.00 H new ATOM 280 N ASN A 19 1.077 1.633 6.987 1.00 10.00 N ATOM 281 CA ASN A 19 1.687 1.832 8.312 1.00 10.00 C ATOM 282 C ASN A 19 0.781 2.347 9.456 1.00 10.00 C ATOM 283 O ASN A 19 1.231 2.390 10.601 1.00 10.00 O ATOM 284 CB ASN A 19 2.855 2.807 8.052 1.00 10.00 C ATOM 285 CG ASN A 19 2.350 4.217 7.744 1.00 10.00 C ATOM 286 OD1 ASN A 19 1.751 4.904 8.558 1.00 10.00 O ATOM 287 ND2 ASN A 19 2.525 4.696 6.533 1.00 10.00 N ATOM 0 H ASN A 19 1.652 2.081 6.274 1.00 10.00 H new ATOM 0 HA ASN A 19 1.974 0.855 8.700 1.00 10.00 H new ATOM 0 HB2 ASN A 19 3.508 2.836 8.925 1.00 10.00 H new ATOM 0 HB3 ASN A 19 3.455 2.444 7.217 1.00 10.00 H new ATOM 0 HD21 ASN A 19 2.165 5.619 6.293 1.00 10.00 H new ATOM 0 HD22 ASN A 19 3.021 4.144 5.833 1.00 10.00 H new ATOM 294 N THR A 20 -0.443 2.782 9.119 1.00 10.00 N ATOM 295 CA THR A 20 -1.579 3.357 9.869 1.00 10.00 C ATOM 296 C THR A 20 -1.976 4.761 9.390 1.00 10.00 C ATOM 297 O THR A 20 -3.122 5.137 9.636 1.00 10.00 O ATOM 298 CB THR A 20 -1.509 3.336 11.414 1.00 10.00 C ATOM 299 OG1 THR A 20 -0.330 3.930 11.889 1.00 10.00 O ATOM 300 CG2 THR A 20 -1.657 1.917 11.985 1.00 10.00 C ATOM 0 H THR A 20 -0.704 2.728 8.135 1.00 10.00 H new ATOM 0 HA THR A 20 -2.359 2.639 9.617 1.00 10.00 H new ATOM 0 HB THR A 20 -2.356 3.926 11.764 1.00 10.00 H new ATOM 0 HG1 THR A 20 0.441 3.387 11.621 1.00 10.00 H new ATOM 0 HG21 THR A 20 -1.601 1.955 13.073 1.00 10.00 H new ATOM 0 HG22 THR A 20 -2.620 1.503 11.685 1.00 10.00 H new ATOM 0 HG23 THR A 20 -0.855 1.285 11.602 1.00 10.00 H new ATOM 308 N ASP A 21 -1.133 5.505 8.660 1.00 10.00 N ATOM 309 CA ASP A 21 -1.564 6.800 8.121 1.00 10.00 C ATOM 310 C ASP A 21 -2.679 6.664 7.058 1.00 10.00 C ATOM 311 O ASP A 21 -2.813 5.671 6.330 1.00 10.00 O ATOM 312 CB ASP A 21 -0.379 7.610 7.549 1.00 10.00 C ATOM 313 CG ASP A 21 -0.805 9.022 7.086 1.00 10.00 C ATOM 314 OD1 ASP A 21 -1.631 9.651 7.796 1.00 10.00 O ATOM 315 OD2 ASP A 21 -0.422 9.445 5.970 1.00 10.00 O ATOM 0 H ASP A 21 -0.174 5.241 8.434 1.00 10.00 H new ATOM 0 HA ASP A 21 -1.980 7.347 8.967 1.00 10.00 H new ATOM 0 HB2 ASP A 21 0.399 7.698 8.308 1.00 10.00 H new ATOM 0 HB3 ASP A 21 0.056 7.070 6.708 1.00 10.00 H new ATOM 320 N ALA A 22 -3.473 7.725 6.959 1.00 10.00 N ATOM 321 CA ALA A 22 -4.468 7.997 5.930 1.00 10.00 C ATOM 322 C ALA A 22 -4.494 9.472 5.483 1.00 10.00 C ATOM 323 O ALA A 22 -5.151 9.782 4.498 1.00 10.00 O ATOM 324 CB ALA A 22 -5.836 7.551 6.447 1.00 10.00 C ATOM 0 H ALA A 22 -3.434 8.474 7.650 1.00 10.00 H new ATOM 0 HA ALA A 22 -4.198 7.431 5.038 1.00 10.00 H new ATOM 0 HB1 ALA A 22 -6.593 7.748 5.688 1.00 10.00 H new ATOM 0 HB2 ALA A 22 -5.811 6.484 6.667 1.00 10.00 H new ATOM 0 HB3 ALA A 22 -6.080 8.103 7.355 1.00 10.00 H new ATOM 330 N THR A 23 -3.736 10.366 6.127 1.00 10.00 N ATOM 331 CA THR A 23 -3.796 11.830 6.001 1.00 10.00 C ATOM 332 C THR A 23 -3.715 12.372 4.582 1.00 10.00 C ATOM 333 O THR A 23 -4.478 13.269 4.223 1.00 10.00 O ATOM 334 CB THR A 23 -2.683 12.469 6.851 1.00 10.00 C ATOM 335 OG1 THR A 23 -2.645 11.912 8.148 1.00 10.00 O ATOM 336 CG2 THR A 23 -2.836 13.985 6.993 1.00 10.00 C ATOM 0 H THR A 23 -3.020 10.071 6.791 1.00 10.00 H new ATOM 0 HA THR A 23 -4.789 12.102 6.359 1.00 10.00 H new ATOM 0 HB THR A 23 -1.757 12.258 6.317 1.00 10.00 H new ATOM 0 HG1 THR A 23 -1.982 11.191 8.175 1.00 10.00 H new ATOM 0 HG21 THR A 23 -2.022 14.377 7.603 1.00 10.00 H new ATOM 0 HG22 THR A 23 -2.806 14.448 6.007 1.00 10.00 H new ATOM 0 HG23 THR A 23 -3.789 14.211 7.471 1.00 10.00 H new ATOM 344 N GLY A 24 -2.780 11.848 3.792 1.00 10.00 N ATOM 345 CA GLY A 24 -2.699 12.099 2.352 1.00 10.00 C ATOM 346 C GLY A 24 -2.873 10.828 1.522 1.00 10.00 C ATOM 347 O GLY A 24 -3.237 10.899 0.350 1.00 10.00 O ATOM 0 H GLY A 24 -2.047 11.229 4.137 1.00 10.00 H new ATOM 0 HA2 GLY A 24 -3.465 12.821 2.069 1.00 10.00 H new ATOM 0 HA3 GLY A 24 -1.735 12.551 2.120 1.00 10.00 H new ATOM 351 N LEU A 25 -2.685 9.647 2.124 1.00 10.00 N ATOM 352 CA LEU A 25 -3.016 8.371 1.495 1.00 10.00 C ATOM 353 C LEU A 25 -4.488 8.273 1.103 1.00 10.00 C ATOM 354 O LEU A 25 -4.779 7.624 0.107 1.00 10.00 O ATOM 355 CB LEU A 25 -2.572 7.229 2.415 1.00 10.00 C ATOM 356 CG LEU A 25 -1.060 6.957 2.303 1.00 10.00 C ATOM 357 CD1 LEU A 25 -0.429 6.711 3.675 1.00 10.00 C ATOM 358 CD2 LEU A 25 -0.818 5.741 1.406 1.00 10.00 C ATOM 0 H LEU A 25 -2.298 9.554 3.063 1.00 10.00 H new ATOM 0 HA LEU A 25 -2.472 8.293 0.554 1.00 10.00 H new ATOM 0 HB2 LEU A 25 -2.821 7.476 3.447 1.00 10.00 H new ATOM 0 HB3 LEU A 25 -3.124 6.324 2.162 1.00 10.00 H new ATOM 0 HG LEU A 25 -0.593 7.841 1.868 1.00 10.00 H new ATOM 0 HD11 LEU A 25 0.638 6.523 3.556 1.00 10.00 H new ATOM 0 HD12 LEU A 25 -0.575 7.588 4.305 1.00 10.00 H new ATOM 0 HD13 LEU A 25 -0.900 5.846 4.142 1.00 10.00 H new ATOM 0 HD21 LEU A 25 0.253 5.552 1.330 1.00 10.00 H new ATOM 0 HD22 LEU A 25 -1.310 4.868 1.835 1.00 10.00 H new ATOM 0 HD23 LEU A 25 -1.224 5.935 0.413 1.00 10.00 H new ATOM 370 N GLU A 26 -5.382 8.993 1.796 1.00 10.00 N ATOM 371 CA GLU A 26 -6.797 9.150 1.447 1.00 10.00 C ATOM 372 C GLU A 26 -7.050 9.460 -0.044 1.00 10.00 C ATOM 373 O GLU A 26 -7.963 8.875 -0.626 1.00 10.00 O ATOM 374 CB GLU A 26 -7.467 10.161 2.406 1.00 10.00 C ATOM 375 CG GLU A 26 -6.807 11.559 2.502 1.00 10.00 C ATOM 376 CD GLU A 26 -7.403 12.561 1.517 1.00 10.00 C ATOM 377 OE1 GLU A 26 -8.613 12.858 1.633 1.00 10.00 O ATOM 378 OE2 GLU A 26 -6.698 12.994 0.583 1.00 10.00 O ATOM 0 H GLU A 26 -5.128 9.499 2.645 1.00 10.00 H new ATOM 0 HA GLU A 26 -7.275 8.180 1.586 1.00 10.00 H new ATOM 0 HB2 GLU A 26 -8.503 10.293 2.094 1.00 10.00 H new ATOM 0 HB3 GLU A 26 -7.488 9.723 3.404 1.00 10.00 H new ATOM 0 HG2 GLU A 26 -6.921 11.941 3.516 1.00 10.00 H new ATOM 0 HG3 GLU A 26 -5.737 11.465 2.315 1.00 10.00 H new ATOM 385 N GLU A 27 -6.234 10.306 -0.686 1.00 10.00 N ATOM 386 CA GLU A 27 -6.280 10.583 -2.129 1.00 10.00 C ATOM 387 C GLU A 27 -5.985 9.342 -2.978 1.00 10.00 C ATOM 388 O GLU A 27 -6.755 8.957 -3.851 1.00 10.00 O ATOM 389 CB GLU A 27 -5.260 11.685 -2.456 1.00 10.00 C ATOM 390 CG GLU A 27 -5.340 12.208 -3.901 1.00 10.00 C ATOM 391 CD GLU A 27 -6.588 13.067 -4.082 1.00 10.00 C ATOM 392 OE1 GLU A 27 -6.622 14.188 -3.521 1.00 10.00 O ATOM 393 OE2 GLU A 27 -7.592 12.552 -4.620 1.00 10.00 O ATOM 0 H GLU A 27 -5.504 10.831 -0.204 1.00 10.00 H new ATOM 0 HA GLU A 27 -7.292 10.904 -2.374 1.00 10.00 H new ATOM 0 HB2 GLU A 27 -5.410 12.519 -1.771 1.00 10.00 H new ATOM 0 HB3 GLU A 27 -4.256 11.301 -2.275 1.00 10.00 H new ATOM 0 HG2 GLU A 27 -4.450 12.793 -4.134 1.00 10.00 H new ATOM 0 HG3 GLU A 27 -5.362 11.370 -4.598 1.00 10.00 H new ATOM 400 N ILE A 28 -4.850 8.717 -2.697 1.00 10.00 N ATOM 401 CA ILE A 28 -4.359 7.541 -3.420 1.00 10.00 C ATOM 402 C ILE A 28 -5.329 6.366 -3.205 1.00 10.00 C ATOM 403 O ILE A 28 -5.596 5.594 -4.125 1.00 10.00 O ATOM 404 CB ILE A 28 -2.940 7.169 -2.949 1.00 10.00 C ATOM 405 CG1 ILE A 28 -2.024 8.394 -2.700 1.00 10.00 C ATOM 406 CG2 ILE A 28 -2.296 6.264 -4.020 1.00 10.00 C ATOM 407 CD1 ILE A 28 -0.799 8.020 -1.879 1.00 10.00 C ATOM 0 H ILE A 28 -4.228 9.016 -1.945 1.00 10.00 H new ATOM 0 HA ILE A 28 -4.309 7.770 -4.484 1.00 10.00 H new ATOM 0 HB ILE A 28 -3.040 6.660 -1.990 1.00 10.00 H new ATOM 0 HG12 ILE A 28 -1.708 8.813 -3.655 1.00 10.00 H new ATOM 0 HG13 ILE A 28 -2.587 9.170 -2.182 1.00 10.00 H new ATOM 0 HG21 ILE A 28 -1.289 5.989 -3.706 1.00 10.00 H new ATOM 0 HG22 ILE A 28 -2.897 5.363 -4.144 1.00 10.00 H new ATOM 0 HG23 ILE A 28 -2.246 6.800 -4.968 1.00 10.00 H new ATOM 0 HD11 ILE A 28 -0.181 8.904 -1.725 1.00 10.00 H new ATOM 0 HD12 ILE A 28 -1.115 7.625 -0.913 1.00 10.00 H new ATOM 0 HD13 ILE A 28 -0.223 7.262 -2.410 1.00 10.00 H new ATOM 419 N ASP A 29 -5.910 6.281 -2.004 1.00 10.00 N ATOM 420 CA ASP A 29 -6.927 5.324 -1.615 1.00 10.00 C ATOM 421 C ASP A 29 -8.204 5.545 -2.440 1.00 10.00 C ATOM 422 O ASP A 29 -8.670 4.601 -3.085 1.00 10.00 O ATOM 423 CB ASP A 29 -7.219 5.448 -0.105 1.00 10.00 C ATOM 424 CG ASP A 29 -6.119 4.943 0.846 1.00 10.00 C ATOM 425 OD1 ASP A 29 -5.404 3.968 0.529 1.00 10.00 O ATOM 426 OD2 ASP A 29 -6.077 5.441 1.997 1.00 10.00 O ATOM 0 H ASP A 29 -5.664 6.915 -1.244 1.00 10.00 H new ATOM 0 HA ASP A 29 -6.563 4.316 -1.813 1.00 10.00 H new ATOM 0 HB2 ASP A 29 -7.412 6.497 0.121 1.00 10.00 H new ATOM 0 HB3 ASP A 29 -8.137 4.901 0.112 1.00 10.00 H new ATOM 431 N ARG A 30 -8.767 6.777 -2.485 1.00 10.00 N ATOM 432 CA ARG A 30 -9.942 7.057 -3.338 1.00 10.00 C ATOM 433 C ARG A 30 -9.649 6.849 -4.823 1.00 10.00 C ATOM 434 O ARG A 30 -10.488 6.280 -5.525 1.00 10.00 O ATOM 435 CB ARG A 30 -10.594 8.424 -3.050 1.00 10.00 C ATOM 436 CG ARG A 30 -9.752 9.660 -3.387 1.00 10.00 C ATOM 437 CD ARG A 30 -10.513 10.976 -3.147 1.00 10.00 C ATOM 438 NE ARG A 30 -9.596 12.099 -2.873 1.00 10.00 N ATOM 439 CZ ARG A 30 -9.248 12.567 -1.673 1.00 10.00 C ATOM 440 NH1 ARG A 30 -9.830 12.153 -0.580 1.00 10.00 N ATOM 441 NH2 ARG A 30 -8.268 13.423 -1.533 1.00 10.00 N ATOM 0 H ARG A 30 -8.432 7.578 -1.950 1.00 10.00 H new ATOM 0 HA ARG A 30 -10.689 6.313 -3.062 1.00 10.00 H new ATOM 0 HB2 ARG A 30 -11.528 8.483 -3.609 1.00 10.00 H new ATOM 0 HB3 ARG A 30 -10.853 8.464 -1.992 1.00 10.00 H new ATOM 0 HG2 ARG A 30 -8.845 9.653 -2.783 1.00 10.00 H new ATOM 0 HG3 ARG A 30 -9.440 9.610 -4.430 1.00 10.00 H new ATOM 0 HD2 ARG A 30 -11.121 11.209 -4.021 1.00 10.00 H new ATOM 0 HD3 ARG A 30 -11.197 10.852 -2.307 1.00 10.00 H new ATOM 0 HE ARG A 30 -9.187 12.565 -3.683 1.00 10.00 H new ATOM 0 HH11 ARG A 30 -10.571 11.454 -0.630 1.00 10.00 H new ATOM 0 HH12 ARG A 30 -9.543 12.528 0.324 1.00 10.00 H new ATOM 0 HH21 ARG A 30 -7.752 13.746 -2.352 1.00 10.00 H new ATOM 0 HH22 ARG A 30 -8.020 13.767 -0.605 1.00 10.00 H new ATOM 455 N ALA A 31 -8.450 7.215 -5.299 1.00 10.00 N ATOM 456 CA ALA A 31 -8.011 7.018 -6.682 1.00 10.00 C ATOM 457 C ALA A 31 -7.944 5.533 -7.113 1.00 10.00 C ATOM 458 O ALA A 31 -8.010 5.259 -8.308 1.00 10.00 O ATOM 459 CB ALA A 31 -6.649 7.691 -6.865 1.00 10.00 C ATOM 0 H ALA A 31 -7.745 7.666 -4.717 1.00 10.00 H new ATOM 0 HA ALA A 31 -8.761 7.474 -7.329 1.00 10.00 H new ATOM 0 HB1 ALA A 31 -6.310 7.552 -7.891 1.00 10.00 H new ATOM 0 HB2 ALA A 31 -6.738 8.757 -6.653 1.00 10.00 H new ATOM 0 HB3 ALA A 31 -5.928 7.244 -6.181 1.00 10.00 H new ATOM 465 N LEU A 32 -7.878 4.595 -6.159 1.00 10.00 N ATOM 466 CA LEU A 32 -7.977 3.147 -6.391 1.00 10.00 C ATOM 467 C LEU A 32 -9.267 2.540 -5.811 1.00 10.00 C ATOM 468 O LEU A 32 -9.378 1.320 -5.717 1.00 10.00 O ATOM 469 CB LEU A 32 -6.699 2.431 -5.917 1.00 10.00 C ATOM 470 CG LEU A 32 -5.401 2.938 -6.546 1.00 10.00 C ATOM 471 CD1 LEU A 32 -4.238 2.133 -5.953 1.00 10.00 C ATOM 472 CD2 LEU A 32 -5.382 2.779 -8.062 1.00 10.00 C ATOM 0 H LEU A 32 -7.750 4.829 -5.175 1.00 10.00 H new ATOM 0 HA LEU A 32 -8.053 2.986 -7.466 1.00 10.00 H new ATOM 0 HB2 LEU A 32 -6.624 2.533 -4.834 1.00 10.00 H new ATOM 0 HB3 LEU A 32 -6.797 1.367 -6.131 1.00 10.00 H new ATOM 0 HG LEU A 32 -5.314 4.003 -6.328 1.00 10.00 H new ATOM 0 HD11 LEU A 32 -3.299 2.477 -6.387 1.00 10.00 H new ATOM 0 HD12 LEU A 32 -4.212 2.274 -4.872 1.00 10.00 H new ATOM 0 HD13 LEU A 32 -4.376 1.075 -6.178 1.00 10.00 H new ATOM 0 HD21 LEU A 32 -4.438 3.155 -8.455 1.00 10.00 H new ATOM 0 HD22 LEU A 32 -5.488 1.725 -8.319 1.00 10.00 H new ATOM 0 HD23 LEU A 32 -6.207 3.343 -8.497 1.00 10.00 H new ATOM 484 N GLY A 33 -10.254 3.378 -5.461 1.00 10.00 N ATOM 485 CA GLY A 33 -11.556 2.962 -4.943 1.00 10.00 C ATOM 486 C GLY A 33 -11.503 2.233 -3.595 1.00 10.00 C ATOM 487 O GLY A 33 -12.471 1.564 -3.241 1.00 10.00 O ATOM 0 H GLY A 33 -10.161 4.391 -5.534 1.00 10.00 H new ATOM 0 HA2 GLY A 33 -12.190 3.843 -4.840 1.00 10.00 H new ATOM 0 HA3 GLY A 33 -12.032 2.310 -5.675 1.00 10.00 H new ATOM 491 N ILE A 34 -10.397 2.340 -2.838 1.00 10.00 N ATOM 492 CA ILE A 34 -10.117 1.549 -1.628 1.00 10.00 C ATOM 493 C ILE A 34 -11.275 1.590 -0.602 1.00 10.00 C ATOM 494 O ILE A 34 -11.759 0.516 -0.256 1.00 10.00 O ATOM 495 CB ILE A 34 -8.681 1.832 -1.116 1.00 10.00 C ATOM 496 CG1 ILE A 34 -7.680 1.468 -2.248 1.00 10.00 C ATOM 497 CG2 ILE A 34 -8.370 1.021 0.144 1.00 10.00 C ATOM 498 CD1 ILE A 34 -6.189 1.465 -1.897 1.00 10.00 C ATOM 0 H ILE A 34 -9.651 3.000 -3.059 1.00 10.00 H new ATOM 0 HA ILE A 34 -10.100 0.487 -1.872 1.00 10.00 H new ATOM 0 HB ILE A 34 -8.593 2.886 -0.854 1.00 10.00 H new ATOM 0 HG12 ILE A 34 -7.940 0.478 -2.622 1.00 10.00 H new ATOM 0 HG13 ILE A 34 -7.831 2.168 -3.069 1.00 10.00 H new ATOM 0 HG21 ILE A 34 -7.356 1.242 0.478 1.00 10.00 H new ATOM 0 HG22 ILE A 34 -9.077 1.285 0.931 1.00 10.00 H new ATOM 0 HG23 ILE A 34 -8.455 -0.043 -0.078 1.00 10.00 H new ATOM 0 HD11 ILE A 34 -5.608 1.194 -2.779 1.00 10.00 H new ATOM 0 HD12 ILE A 34 -5.893 2.458 -1.558 1.00 10.00 H new ATOM 0 HD13 ILE A 34 -6.003 0.741 -1.104 1.00 10.00 H new ATOM 510 N PRO A 35 -11.820 2.751 -0.194 1.00 10.00 N ATOM 511 CA PRO A 35 -13.044 2.841 0.609 1.00 10.00 C ATOM 512 C PRO A 35 -14.299 2.126 0.040 1.00 10.00 C ATOM 513 O PRO A 35 -15.145 1.686 0.813 1.00 10.00 O ATOM 514 CB PRO A 35 -13.316 4.341 0.753 1.00 10.00 C ATOM 515 CG PRO A 35 -11.910 4.929 0.745 1.00 10.00 C ATOM 516 CD PRO A 35 -11.172 4.044 -0.261 1.00 10.00 C ATOM 0 HA PRO A 35 -12.870 2.317 1.549 1.00 10.00 H new ATOM 0 HB2 PRO A 35 -13.922 4.725 -0.068 1.00 10.00 H new ATOM 0 HB3 PRO A 35 -13.848 4.571 1.676 1.00 10.00 H new ATOM 0 HG2 PRO A 35 -11.912 5.975 0.437 1.00 10.00 H new ATOM 0 HG3 PRO A 35 -11.450 4.888 1.732 1.00 10.00 H new ATOM 0 HD2 PRO A 35 -11.232 4.460 -1.267 1.00 10.00 H new ATOM 0 HD3 PRO A 35 -10.114 3.965 -0.011 1.00 10.00 H new ATOM 524 N GLU A 36 -14.420 1.965 -1.281 1.00 10.00 N ATOM 525 CA GLU A 36 -15.491 1.159 -1.885 1.00 10.00 C ATOM 526 C GLU A 36 -15.144 -0.340 -1.817 1.00 10.00 C ATOM 527 O GLU A 36 -15.998 -1.142 -1.473 1.00 10.00 O ATOM 528 CB GLU A 36 -15.765 1.593 -3.335 1.00 10.00 C ATOM 529 CG GLU A 36 -17.269 1.706 -3.651 1.00 10.00 C ATOM 530 CD GLU A 36 -18.053 0.403 -3.426 1.00 10.00 C ATOM 531 OE1 GLU A 36 -18.041 -0.465 -4.332 1.00 10.00 O ATOM 532 OE2 GLU A 36 -18.700 0.296 -2.361 1.00 10.00 O ATOM 0 H GLU A 36 -13.785 2.385 -1.959 1.00 10.00 H new ATOM 0 HA GLU A 36 -16.403 1.327 -1.312 1.00 10.00 H new ATOM 0 HB2 GLU A 36 -15.287 2.555 -3.518 1.00 10.00 H new ATOM 0 HB3 GLU A 36 -15.308 0.875 -4.017 1.00 10.00 H new ATOM 0 HG2 GLU A 36 -17.702 2.491 -3.031 1.00 10.00 H new ATOM 0 HG3 GLU A 36 -17.390 2.016 -4.689 1.00 10.00 H new ATOM 539 N LEU A 37 -13.885 -0.727 -2.065 1.00 10.00 N ATOM 540 CA LEU A 37 -13.398 -2.096 -1.834 1.00 10.00 C ATOM 541 C LEU A 37 -13.530 -2.539 -0.356 1.00 10.00 C ATOM 542 O LEU A 37 -13.847 -3.699 -0.092 1.00 10.00 O ATOM 543 CB LEU A 37 -11.954 -2.219 -2.346 1.00 10.00 C ATOM 544 CG LEU A 37 -11.787 -1.990 -3.865 1.00 10.00 C ATOM 545 CD1 LEU A 37 -10.300 -2.016 -4.222 1.00 10.00 C ATOM 546 CD2 LEU A 37 -12.507 -3.057 -4.699 1.00 10.00 C ATOM 0 H LEU A 37 -13.172 -0.097 -2.433 1.00 10.00 H new ATOM 0 HA LEU A 37 -14.033 -2.780 -2.397 1.00 10.00 H new ATOM 0 HB2 LEU A 37 -11.331 -1.500 -1.813 1.00 10.00 H new ATOM 0 HB3 LEU A 37 -11.578 -3.212 -2.098 1.00 10.00 H new ATOM 0 HG LEU A 37 -12.231 -1.022 -4.097 1.00 10.00 H new ATOM 0 HD11 LEU A 37 -10.180 -1.855 -5.293 1.00 10.00 H new ATOM 0 HD12 LEU A 37 -9.781 -1.228 -3.676 1.00 10.00 H new ATOM 0 HD13 LEU A 37 -9.878 -2.984 -3.951 1.00 10.00 H new ATOM 0 HD21 LEU A 37 -12.359 -2.851 -5.759 1.00 10.00 H new ATOM 0 HD22 LEU A 37 -12.102 -4.040 -4.460 1.00 10.00 H new ATOM 0 HD23 LEU A 37 -13.573 -3.039 -4.471 1.00 10.00 H new ATOM 558 N VAL A 38 -13.385 -1.596 0.588 1.00 10.00 N ATOM 559 CA VAL A 38 -13.671 -1.730 2.027 1.00 10.00 C ATOM 560 C VAL A 38 -15.144 -2.073 2.256 1.00 10.00 C ATOM 561 O VAL A 38 -15.431 -3.129 2.821 1.00 10.00 O ATOM 562 CB VAL A 38 -13.267 -0.437 2.761 1.00 10.00 C ATOM 563 CG1 VAL A 38 -13.901 -0.216 4.145 1.00 10.00 C ATOM 564 CG2 VAL A 38 -11.749 -0.369 2.936 1.00 10.00 C ATOM 0 H VAL A 38 -13.045 -0.663 0.354 1.00 10.00 H new ATOM 0 HA VAL A 38 -13.082 -2.551 2.435 1.00 10.00 H new ATOM 0 HB VAL A 38 -13.651 0.349 2.111 1.00 10.00 H new ATOM 0 HG11 VAL A 38 -13.543 0.725 4.563 1.00 10.00 H new ATOM 0 HG12 VAL A 38 -14.986 -0.179 4.047 1.00 10.00 H new ATOM 0 HG13 VAL A 38 -13.624 -1.036 4.807 1.00 10.00 H new ATOM 0 HG21 VAL A 38 -11.484 0.551 3.456 1.00 10.00 H new ATOM 0 HG22 VAL A 38 -11.411 -1.226 3.519 1.00 10.00 H new ATOM 0 HG23 VAL A 38 -11.269 -0.384 1.958 1.00 10.00 H new ATOM 765 N SER B 51 12.063 -9.500 -9.635 1.00 10.00 N ATOM 766 CA SER B 51 11.824 -8.450 -8.667 1.00 10.00 C ATOM 767 C SER B 51 11.346 -7.233 -9.452 1.00 10.00 C ATOM 768 O SER B 51 12.117 -6.652 -10.208 1.00 10.00 O ATOM 769 CB SER B 51 13.071 -8.176 -7.810 1.00 10.00 C ATOM 770 OG SER B 51 13.663 -9.384 -7.371 1.00 10.00 O ATOM 0 HA SER B 51 11.060 -8.739 -7.945 1.00 10.00 H new ATOM 0 HB2 SER B 51 13.795 -7.602 -8.389 1.00 10.00 H new ATOM 0 HB3 SER B 51 12.797 -7.567 -6.948 1.00 10.00 H new ATOM 0 HG SER B 51 13.451 -10.101 -8.004 1.00 10.00 H new ATOM 776 N ILE B 52 10.064 -6.887 -9.326 1.00 10.00 N ATOM 777 CA ILE B 52 9.436 -5.724 -9.959 1.00 10.00 C ATOM 778 C ILE B 52 9.505 -4.466 -9.088 1.00 10.00 C ATOM 779 O ILE B 52 9.125 -3.396 -9.569 1.00 10.00 O ATOM 780 CB ILE B 52 7.982 -5.986 -10.456 1.00 10.00 C ATOM 781 CG1 ILE B 52 7.498 -7.453 -10.459 1.00 10.00 C ATOM 782 CG2 ILE B 52 7.861 -5.420 -11.883 1.00 10.00 C ATOM 783 CD1 ILE B 52 6.939 -7.881 -9.097 1.00 10.00 C ATOM 0 H ILE B 52 9.410 -7.428 -8.760 1.00 10.00 H new ATOM 0 HA ILE B 52 10.036 -5.541 -10.850 1.00 10.00 H new ATOM 0 HB ILE B 52 7.337 -5.492 -9.729 1.00 10.00 H new ATOM 0 HG12 ILE B 52 6.729 -7.579 -11.221 1.00 10.00 H new ATOM 0 HG13 ILE B 52 8.327 -8.107 -10.731 1.00 10.00 H new ATOM 0 HG21 ILE B 52 6.851 -5.590 -12.257 1.00 10.00 H new ATOM 0 HG22 ILE B 52 8.068 -4.350 -11.869 1.00 10.00 H new ATOM 0 HG23 ILE B 52 8.578 -5.919 -12.535 1.00 10.00 H new ATOM 0 HD11 ILE B 52 6.611 -8.919 -9.148 1.00 10.00 H new ATOM 0 HD12 ILE B 52 7.715 -7.782 -8.338 1.00 10.00 H new ATOM 0 HD13 ILE B 52 6.093 -7.246 -8.835 1.00 10.00 H new ATOM 795 N SER B 53 9.959 -4.532 -7.819 1.00 10.00 N ATOM 796 CA SER B 53 10.178 -3.357 -6.953 1.00 10.00 C ATOM 797 C SER B 53 11.635 -3.007 -6.559 1.00 10.00 C ATOM 798 O SER B 53 11.777 -2.096 -5.748 1.00 10.00 O ATOM 799 CB SER B 53 9.271 -3.386 -5.709 1.00 10.00 C ATOM 800 OG SER B 53 9.347 -4.567 -4.938 1.00 10.00 O ATOM 0 H SER B 53 10.186 -5.415 -7.362 1.00 10.00 H new ATOM 0 HA SER B 53 9.896 -2.538 -7.614 1.00 10.00 H new ATOM 0 HB2 SER B 53 9.526 -2.539 -5.073 1.00 10.00 H new ATOM 0 HB3 SER B 53 8.238 -3.245 -6.028 1.00 10.00 H new ATOM 0 HG SER B 53 8.643 -5.188 -5.220 1.00 10.00 H new ATOM 806 N PRO B 54 12.738 -3.567 -7.124 1.00 10.00 N ATOM 807 CA PRO B 54 14.100 -3.158 -6.755 1.00 10.00 C ATOM 808 C PRO B 54 14.433 -1.696 -7.098 1.00 10.00 C ATOM 809 O PRO B 54 15.393 -1.154 -6.551 1.00 10.00 O ATOM 810 CB PRO B 54 15.036 -4.134 -7.470 1.00 10.00 C ATOM 811 CG PRO B 54 14.259 -4.471 -8.732 1.00 10.00 C ATOM 812 CD PRO B 54 12.817 -4.492 -8.237 1.00 10.00 C ATOM 0 HA PRO B 54 14.214 -3.197 -5.672 1.00 10.00 H new ATOM 0 HB2 PRO B 54 16.000 -3.679 -7.697 1.00 10.00 H new ATOM 0 HB3 PRO B 54 15.235 -5.020 -6.867 1.00 10.00 H new ATOM 0 HG2 PRO B 54 14.409 -3.725 -9.512 1.00 10.00 H new ATOM 0 HG3 PRO B 54 14.559 -5.433 -9.148 1.00 10.00 H new ATOM 0 HD2 PRO B 54 12.132 -4.198 -9.032 1.00 10.00 H new ATOM 0 HD3 PRO B 54 12.531 -5.496 -7.925 1.00 10.00 H new ATOM 820 N SER B 55 13.671 -1.068 -8.003 1.00 10.00 N ATOM 821 CA SER B 55 13.694 0.372 -8.296 1.00 10.00 C ATOM 822 C SER B 55 12.797 1.171 -7.333 1.00 10.00 C ATOM 823 O SER B 55 13.263 2.114 -6.701 1.00 10.00 O ATOM 824 CB SER B 55 13.209 0.587 -9.743 1.00 10.00 C ATOM 825 OG SER B 55 11.955 -0.056 -9.971 1.00 10.00 O ATOM 0 H SER B 55 12.993 -1.570 -8.576 1.00 10.00 H new ATOM 0 HA SER B 55 14.715 0.731 -8.168 1.00 10.00 H new ATOM 0 HB2 SER B 55 13.114 1.654 -9.942 1.00 10.00 H new ATOM 0 HB3 SER B 55 13.952 0.198 -10.439 1.00 10.00 H new ATOM 0 HG SER B 55 11.671 0.099 -10.896 1.00 10.00 H new ATOM 831 N ALA B 56 11.537 0.738 -7.195 1.00 10.00 N ATOM 832 CA ALA B 56 10.558 1.239 -6.227 1.00 10.00 C ATOM 833 C ALA B 56 11.082 1.200 -4.771 1.00 10.00 C ATOM 834 O ALA B 56 10.675 2.004 -3.938 1.00 10.00 O ATOM 835 CB ALA B 56 9.264 0.447 -6.406 1.00 10.00 C ATOM 0 H ALA B 56 11.157 -0.004 -7.782 1.00 10.00 H new ATOM 0 HA ALA B 56 10.368 2.295 -6.421 1.00 10.00 H new ATOM 0 HB1 ALA B 56 8.518 0.803 -5.695 1.00 10.00 H new ATOM 0 HB2 ALA B 56 8.891 0.584 -7.421 1.00 10.00 H new ATOM 0 HB3 ALA B 56 9.458 -0.611 -6.230 1.00 10.00 H new ATOM 841 N LEU B 57 12.034 0.315 -4.483 1.00 10.00 N ATOM 842 CA LEU B 57 12.817 0.242 -3.258 1.00 10.00 C ATOM 843 C LEU B 57 13.532 1.558 -2.939 1.00 10.00 C ATOM 844 O LEU B 57 13.699 1.888 -1.766 1.00 10.00 O ATOM 845 CB LEU B 57 13.817 -0.906 -3.464 1.00 10.00 C ATOM 846 CG LEU B 57 14.843 -1.196 -2.359 1.00 10.00 C ATOM 847 CD1 LEU B 57 14.181 -1.521 -1.030 1.00 10.00 C ATOM 848 CD2 LEU B 57 15.704 -2.377 -2.814 1.00 10.00 C ATOM 0 H LEU B 57 12.293 -0.417 -5.145 1.00 10.00 H new ATOM 0 HA LEU B 57 12.169 0.061 -2.401 1.00 10.00 H new ATOM 0 HB2 LEU B 57 13.244 -1.818 -3.631 1.00 10.00 H new ATOM 0 HB3 LEU B 57 14.368 -0.704 -4.382 1.00 10.00 H new ATOM 0 HG LEU B 57 15.449 -0.304 -2.199 1.00 10.00 H new ATOM 0 HD11 LEU B 57 14.947 -1.719 -0.280 1.00 10.00 H new ATOM 0 HD12 LEU B 57 13.571 -0.676 -0.711 1.00 10.00 H new ATOM 0 HD13 LEU B 57 13.549 -2.402 -1.144 1.00 10.00 H new ATOM 0 HD21 LEU B 57 16.443 -2.605 -2.046 1.00 10.00 H new ATOM 0 HD22 LEU B 57 15.070 -3.248 -2.977 1.00 10.00 H new ATOM 0 HD23 LEU B 57 16.213 -2.120 -3.743 1.00 10.00 H new ATOM 860 N GLN B 58 13.953 2.315 -3.956 1.00 10.00 N ATOM 861 CA GLN B 58 14.433 3.685 -3.791 1.00 10.00 C ATOM 862 C GLN B 58 13.247 4.642 -3.935 1.00 10.00 C ATOM 863 O GLN B 58 12.980 5.458 -3.053 1.00 10.00 O ATOM 864 CB GLN B 58 15.520 4.025 -4.825 1.00 10.00 C ATOM 865 CG GLN B 58 16.849 3.274 -4.601 1.00 10.00 C ATOM 866 CD GLN B 58 16.764 1.773 -4.887 1.00 10.00 C ATOM 867 OE1 GLN B 58 17.191 0.942 -4.106 1.00 10.00 O ATOM 868 NE2 GLN B 58 16.197 1.394 -6.010 1.00 10.00 N ATOM 0 H GLN B 58 13.969 1.990 -4.923 1.00 10.00 H new ATOM 0 HA GLN B 58 14.879 3.788 -2.802 1.00 10.00 H new ATOM 0 HB2 GLN B 58 15.146 3.792 -5.822 1.00 10.00 H new ATOM 0 HB3 GLN B 58 15.711 5.098 -4.798 1.00 10.00 H new ATOM 0 HG2 GLN B 58 17.616 3.713 -5.239 1.00 10.00 H new ATOM 0 HG3 GLN B 58 17.169 3.421 -3.570 1.00 10.00 H new ATOM 0 HE21 GLN B 58 15.840 2.092 -6.662 1.00 10.00 H new ATOM 0 HE22 GLN B 58 16.114 0.401 -6.230 1.00 10.00 H new ATOM 877 N ASP B 59 12.549 4.548 -5.069 1.00 10.00 N ATOM 878 CA ASP B 59 11.530 5.495 -5.503 1.00 10.00 C ATOM 879 C ASP B 59 10.255 5.499 -4.666 1.00 10.00 C ATOM 880 O ASP B 59 9.943 6.533 -4.077 1.00 10.00 O ATOM 881 CB ASP B 59 11.242 5.274 -7.001 1.00 10.00 C ATOM 882 CG ASP B 59 12.299 5.963 -7.861 1.00 10.00 C ATOM 883 OD1 ASP B 59 13.509 5.750 -7.608 1.00 10.00 O ATOM 884 OD2 ASP B 59 11.938 6.878 -8.631 1.00 10.00 O ATOM 0 H ASP B 59 12.685 3.783 -5.730 1.00 10.00 H new ATOM 0 HA ASP B 59 11.938 6.493 -5.345 1.00 10.00 H new ATOM 0 HB2 ASP B 59 11.227 4.206 -7.220 1.00 10.00 H new ATOM 0 HB3 ASP B 59 10.254 5.664 -7.248 1.00 10.00 H new ATOM 889 N LEU B 60 9.538 4.372 -4.586 1.00 10.00 N ATOM 890 CA LEU B 60 8.261 4.320 -3.876 1.00 10.00 C ATOM 891 C LEU B 60 8.491 4.461 -2.364 1.00 10.00 C ATOM 892 O LEU B 60 7.692 5.072 -1.652 1.00 10.00 O ATOM 893 CB LEU B 60 7.538 3.027 -4.270 1.00 10.00 C ATOM 894 CG LEU B 60 6.076 2.868 -3.827 1.00 10.00 C ATOM 895 CD1 LEU B 60 5.244 4.149 -3.846 1.00 10.00 C ATOM 896 CD2 LEU B 60 5.396 1.881 -4.774 1.00 10.00 C ATOM 0 H LEU B 60 9.823 3.486 -5.005 1.00 10.00 H new ATOM 0 HA LEU B 60 7.618 5.154 -4.158 1.00 10.00 H new ATOM 0 HB2 LEU B 60 7.571 2.941 -5.356 1.00 10.00 H new ATOM 0 HB3 LEU B 60 8.105 2.188 -3.866 1.00 10.00 H new ATOM 0 HG LEU B 60 6.119 2.535 -2.790 1.00 10.00 H new ATOM 0 HD11 LEU B 60 4.229 3.928 -3.517 1.00 10.00 H new ATOM 0 HD12 LEU B 60 5.691 4.883 -3.176 1.00 10.00 H new ATOM 0 HD13 LEU B 60 5.218 4.551 -4.859 1.00 10.00 H new ATOM 0 HD21 LEU B 60 4.355 1.752 -4.479 1.00 10.00 H new ATOM 0 HD22 LEU B 60 5.439 2.266 -5.793 1.00 10.00 H new ATOM 0 HD23 LEU B 60 5.908 0.920 -4.727 1.00 10.00 H new ATOM 908 N LEU B 61 9.638 3.955 -1.893 1.00 10.00 N ATOM 909 CA LEU B 61 10.130 4.183 -0.544 1.00 10.00 C ATOM 910 C LEU B 61 10.310 5.684 -0.280 1.00 10.00 C ATOM 911 O LEU B 61 9.655 6.181 0.634 1.00 10.00 O ATOM 912 CB LEU B 61 11.401 3.354 -0.296 1.00 10.00 C ATOM 913 CG LEU B 61 11.842 3.279 1.180 1.00 10.00 C ATOM 914 CD1 LEU B 61 10.816 2.559 2.057 1.00 10.00 C ATOM 915 CD2 LEU B 61 13.164 2.522 1.304 1.00 10.00 C ATOM 0 H LEU B 61 10.254 3.367 -2.454 1.00 10.00 H new ATOM 0 HA LEU B 61 9.392 3.839 0.181 1.00 10.00 H new ATOM 0 HB2 LEU B 61 11.236 2.341 -0.664 1.00 10.00 H new ATOM 0 HB3 LEU B 61 12.215 3.778 -0.884 1.00 10.00 H new ATOM 0 HG LEU B 61 11.945 4.310 1.520 1.00 10.00 H new ATOM 0 HD11 LEU B 61 11.172 2.532 3.087 1.00 10.00 H new ATOM 0 HD12 LEU B 61 9.865 3.091 2.016 1.00 10.00 H new ATOM 0 HD13 LEU B 61 10.678 1.540 1.694 1.00 10.00 H new ATOM 0 HD21 LEU B 61 13.461 2.478 2.352 1.00 10.00 H new ATOM 0 HD22 LEU B 61 13.041 1.510 0.919 1.00 10.00 H new ATOM 0 HD23 LEU B 61 13.934 3.038 0.730 1.00 10.00 H new ATOM 927 N ARG B 62 11.113 6.436 -1.059 1.00 10.00 N ATOM 928 CA ARG B 62 11.268 7.888 -0.816 1.00 10.00 C ATOM 929 C ARG B 62 9.948 8.656 -0.964 1.00 10.00 C ATOM 930 O ARG B 62 9.695 9.572 -0.186 1.00 10.00 O ATOM 931 CB ARG B 62 12.434 8.523 -1.601 1.00 10.00 C ATOM 932 CG ARG B 62 12.185 8.784 -3.089 1.00 10.00 C ATOM 933 CD ARG B 62 13.345 9.543 -3.745 1.00 10.00 C ATOM 934 NE ARG B 62 13.052 9.771 -5.174 1.00 10.00 N ATOM 935 CZ ARG B 62 13.203 8.890 -6.159 1.00 10.00 C ATOM 936 NH1 ARG B 62 13.931 7.810 -5.996 1.00 10.00 N ATOM 937 NH2 ARG B 62 12.587 9.073 -7.302 1.00 10.00 N ATOM 0 H ARG B 62 11.654 6.075 -1.845 1.00 10.00 H new ATOM 0 HA ARG B 62 11.553 7.981 0.232 1.00 10.00 H new ATOM 0 HB2 ARG B 62 12.692 9.469 -1.126 1.00 10.00 H new ATOM 0 HB3 ARG B 62 13.304 7.873 -1.508 1.00 10.00 H new ATOM 0 HG2 ARG B 62 12.037 7.834 -3.603 1.00 10.00 H new ATOM 0 HG3 ARG B 62 11.265 9.357 -3.207 1.00 10.00 H new ATOM 0 HD2 ARG B 62 13.499 10.496 -3.240 1.00 10.00 H new ATOM 0 HD3 ARG B 62 14.269 8.974 -3.640 1.00 10.00 H new ATOM 0 HE ARG B 62 12.700 10.693 -5.431 1.00 10.00 H new ATOM 0 HH11 ARG B 62 14.392 7.636 -5.103 1.00 10.00 H new ATOM 0 HH12 ARG B 62 14.036 7.145 -6.762 1.00 10.00 H new ATOM 0 HH21 ARG B 62 11.992 9.891 -7.436 1.00 10.00 H new ATOM 0 HH22 ARG B 62 12.703 8.398 -8.058 1.00 10.00 H new ATOM 951 N THR B 63 9.102 8.256 -1.923 1.00 10.00 N ATOM 952 CA THR B 63 7.779 8.829 -2.243 1.00 10.00 C ATOM 953 C THR B 63 6.765 8.774 -1.115 1.00 10.00 C ATOM 954 O THR B 63 5.829 9.576 -1.140 1.00 10.00 O ATOM 955 CB THR B 63 7.253 8.125 -3.506 1.00 10.00 C ATOM 956 OG1 THR B 63 7.693 8.881 -4.609 1.00 10.00 O ATOM 957 CG2 THR B 63 5.767 7.861 -3.723 1.00 10.00 C ATOM 0 H THR B 63 9.334 7.475 -2.537 1.00 10.00 H new ATOM 0 HA THR B 63 7.917 9.897 -2.411 1.00 10.00 H new ATOM 0 HB THR B 63 7.646 7.117 -3.377 1.00 10.00 H new ATOM 0 HG1 THR B 63 7.253 9.757 -4.602 1.00 10.00 H new ATOM 0 HG21 THR B 63 5.623 7.355 -4.678 1.00 10.00 H new ATOM 0 HG22 THR B 63 5.388 7.232 -2.918 1.00 10.00 H new ATOM 0 HG23 THR B 63 5.226 8.807 -3.729 1.00 10.00 H new ATOM 965 N LEU B 64 6.969 7.884 -0.127 1.00 10.00 N ATOM 966 CA LEU B 64 6.177 7.843 1.103 1.00 10.00 C ATOM 967 C LEU B 64 6.988 8.056 2.387 1.00 10.00 C ATOM 968 O LEU B 64 6.416 8.355 3.436 1.00 10.00 O ATOM 969 CB LEU B 64 5.387 6.535 1.156 1.00 10.00 C ATOM 970 CG LEU B 64 3.910 6.795 1.487 1.00 10.00 C ATOM 971 CD1 LEU B 64 3.097 7.089 0.221 1.00 10.00 C ATOM 972 CD2 LEU B 64 3.362 5.535 2.129 1.00 10.00 C ATOM 0 H LEU B 64 7.696 7.169 -0.166 1.00 10.00 H new ATOM 0 HA LEU B 64 5.495 8.692 1.064 1.00 10.00 H new ATOM 0 HB2 LEU B 64 5.463 6.021 0.198 1.00 10.00 H new ATOM 0 HB3 LEU B 64 5.821 5.875 1.907 1.00 10.00 H new ATOM 0 HG LEU B 64 3.835 7.659 2.147 1.00 10.00 H new ATOM 0 HD11 LEU B 64 2.056 7.268 0.490 1.00 10.00 H new ATOM 0 HD12 LEU B 64 3.501 7.972 -0.274 1.00 10.00 H new ATOM 0 HD13 LEU B 64 3.155 6.236 -0.455 1.00 10.00 H new ATOM 0 HD21 LEU B 64 2.311 5.682 2.379 1.00 10.00 H new ATOM 0 HD22 LEU B 64 3.456 4.701 1.433 1.00 10.00 H new ATOM 0 HD23 LEU B 64 3.924 5.315 3.037 1.00 10.00 H new ATOM 984 N LYS B 65 8.324 7.912 2.338 1.00 10.00 N ATOM 985 CA LYS B 65 9.195 8.344 3.435 1.00 10.00 C ATOM 986 C LYS B 65 9.109 9.857 3.580 1.00 10.00 C ATOM 987 O LYS B 65 9.294 10.342 4.693 1.00 10.00 O ATOM 988 CB LYS B 65 10.640 7.880 3.240 1.00 10.00 C ATOM 989 CG LYS B 65 10.835 6.489 3.851 1.00 10.00 C ATOM 990 CD LYS B 65 11.361 6.514 5.297 1.00 10.00 C ATOM 991 CE LYS B 65 10.410 7.106 6.348 1.00 10.00 C ATOM 992 NZ LYS B 65 10.512 8.584 6.476 1.00 10.00 N ATOM 0 H LYS B 65 8.820 7.499 1.548 1.00 10.00 H new ATOM 0 HA LYS B 65 8.848 7.877 4.357 1.00 10.00 H new ATOM 0 HB2 LYS B 65 10.882 7.856 2.177 1.00 10.00 H new ATOM 0 HB3 LYS B 65 11.324 8.589 3.706 1.00 10.00 H new ATOM 0 HG2 LYS B 65 9.884 5.956 3.829 1.00 10.00 H new ATOM 0 HG3 LYS B 65 11.531 5.924 3.231 1.00 10.00 H new ATOM 0 HD2 LYS B 65 11.606 5.494 5.591 1.00 10.00 H new ATOM 0 HD3 LYS B 65 12.290 7.083 5.315 1.00 10.00 H new ATOM 0 HE2 LYS B 65 9.385 6.842 6.088 1.00 10.00 H new ATOM 0 HE3 LYS B 65 10.621 6.650 7.315 1.00 10.00 H new ATOM 0 HZ1 LYS B 65 10.383 8.856 7.472 1.00 10.00 H new ATOM 0 HZ2 LYS B 65 11.449 8.897 6.150 1.00 10.00 H new ATOM 0 HZ3 LYS B 65 9.775 9.034 5.896 1.00 10.00 H new ATOM 1006 N SER B 66 8.879 10.570 2.473 1.00 10.00 N ATOM 1007 CA SER B 66 8.503 11.978 2.451 1.00 10.00 C ATOM 1008 C SER B 66 7.005 11.971 2.817 1.00 10.00 C ATOM 1009 O SER B 66 6.256 11.169 2.259 1.00 10.00 O ATOM 1010 CB SER B 66 8.816 12.588 1.070 1.00 10.00 C ATOM 1011 OG SER B 66 8.443 11.753 -0.009 1.00 10.00 O ATOM 0 H SER B 66 8.953 10.165 1.540 1.00 10.00 H new ATOM 0 HA SER B 66 9.058 12.603 3.150 1.00 10.00 H new ATOM 0 HB2 SER B 66 8.299 13.543 0.977 1.00 10.00 H new ATOM 0 HB3 SER B 66 9.884 12.797 1.006 1.00 10.00 H new ATOM 0 HG SER B 66 9.175 11.134 -0.212 1.00 10.00 H new ATOM 1017 N PRO B 67 6.545 12.796 3.771 1.00 10.00 N ATOM 1018 CA PRO B 67 5.210 12.642 4.337 1.00 10.00 C ATOM 1019 C PRO B 67 4.044 13.011 3.434 1.00 10.00 C ATOM 1020 O PRO B 67 4.124 13.896 2.581 1.00 10.00 O ATOM 1021 CB PRO B 67 5.238 13.479 5.619 1.00 10.00 C ATOM 1022 CG PRO B 67 6.174 14.630 5.244 1.00 10.00 C ATOM 1023 CD PRO B 67 7.204 13.969 4.329 1.00 10.00 C ATOM 0 HA PRO B 67 5.013 11.584 4.508 1.00 10.00 H new ATOM 0 HB2 PRO B 67 4.245 13.836 5.892 1.00 10.00 H new ATOM 0 HB3 PRO B 67 5.616 12.909 6.468 1.00 10.00 H new ATOM 0 HG2 PRO B 67 5.640 15.432 4.734 1.00 10.00 H new ATOM 0 HG3 PRO B 67 6.643 15.069 6.125 1.00 10.00 H new ATOM 0 HD2 PRO B 67 7.521 14.651 3.540 1.00 10.00 H new ATOM 0 HD3 PRO B 67 8.098 13.687 4.886 1.00 10.00 H new ATOM 1031 N SER B 68 2.920 12.352 3.721 1.00 10.00 N ATOM 1032 CA SER B 68 1.676 12.298 2.961 1.00 10.00 C ATOM 1033 C SER B 68 1.075 13.654 2.570 1.00 10.00 C ATOM 1034 O SER B 68 0.318 13.700 1.610 1.00 10.00 O ATOM 1035 CB SER B 68 0.635 11.496 3.763 1.00 10.00 C ATOM 1036 OG SER B 68 1.208 10.355 4.373 1.00 10.00 O ATOM 0 H SER B 68 2.855 11.792 4.571 1.00 10.00 H new ATOM 0 HA SER B 68 1.934 11.818 2.017 1.00 10.00 H new ATOM 0 HB2 SER B 68 0.195 12.135 4.528 1.00 10.00 H new ATOM 0 HB3 SER B 68 -0.174 11.187 3.101 1.00 10.00 H new ATOM 0 HG SER B 68 0.496 9.760 4.689 1.00 10.00 H new ATOM 1042 N SER B 69 1.421 14.739 3.274 1.00 10.00 N ATOM 1043 CA SER B 69 0.887 16.096 3.071 1.00 10.00 C ATOM 1044 C SER B 69 0.887 16.537 1.590 1.00 10.00 C ATOM 1045 O SER B 69 -0.189 16.553 0.990 1.00 10.00 O ATOM 1046 CB SER B 69 1.552 17.067 4.060 1.00 10.00 C ATOM 1047 OG SER B 69 1.175 18.395 3.766 1.00 10.00 O ATOM 0 H SER B 69 2.106 14.697 4.029 1.00 10.00 H new ATOM 0 HA SER B 69 -0.177 16.102 3.308 1.00 10.00 H new ATOM 0 HB2 SER B 69 1.260 16.816 5.080 1.00 10.00 H new ATOM 0 HB3 SER B 69 2.636 16.968 4.005 1.00 10.00 H new ATOM 0 HG SER B 69 1.603 19.005 4.403 1.00 10.00 H new ATOM 1053 N PRO B 70 2.029 16.843 0.939 1.00 10.00 N ATOM 1054 CA PRO B 70 2.064 17.026 -0.513 1.00 10.00 C ATOM 1055 C PRO B 70 2.078 15.667 -1.232 1.00 10.00 C ATOM 1056 O PRO B 70 1.586 15.546 -2.354 1.00 10.00 O ATOM 1057 CB PRO B 70 3.344 17.818 -0.782 1.00 10.00 C ATOM 1058 CG PRO B 70 4.285 17.349 0.327 1.00 10.00 C ATOM 1059 CD PRO B 70 3.337 17.129 1.506 1.00 10.00 C ATOM 0 HA PRO B 70 1.184 17.551 -0.886 1.00 10.00 H new ATOM 0 HB2 PRO B 70 3.749 17.604 -1.771 1.00 10.00 H new ATOM 0 HB3 PRO B 70 3.170 18.893 -0.734 1.00 10.00 H new ATOM 0 HG2 PRO B 70 4.808 16.433 0.053 1.00 10.00 H new ATOM 0 HG3 PRO B 70 5.046 18.095 0.554 1.00 10.00 H new ATOM 0 HD2 PRO B 70 3.679 16.302 2.129 1.00 10.00 H new ATOM 0 HD3 PRO B 70 3.299 18.013 2.143 1.00 10.00 H new ATOM 1067 N GLN B 71 2.619 14.622 -0.585 1.00 10.00 N ATOM 1068 CA GLN B 71 2.868 13.312 -1.188 1.00 10.00 C ATOM 1069 C GLN B 71 1.614 12.509 -1.532 1.00 10.00 C ATOM 1070 O GLN B 71 1.732 11.517 -2.254 1.00 10.00 O ATOM 1071 CB GLN B 71 3.912 12.532 -0.360 1.00 10.00 C ATOM 1072 CG GLN B 71 5.290 13.232 -0.388 1.00 10.00 C ATOM 1073 CD GLN B 71 5.899 13.393 -1.789 1.00 10.00 C ATOM 1074 OE1 GLN B 71 5.457 14.184 -2.611 1.00 10.00 O ATOM 1075 NE2 GLN B 71 6.937 12.658 -2.110 1.00 10.00 N ATOM 0 H GLN B 71 2.900 14.671 0.394 1.00 10.00 H new ATOM 0 HA GLN B 71 3.296 13.497 -2.173 1.00 10.00 H new ATOM 0 HB2 GLN B 71 3.568 12.443 0.671 1.00 10.00 H new ATOM 0 HB3 GLN B 71 4.008 11.520 -0.753 1.00 10.00 H new ATOM 0 HG2 GLN B 71 5.191 14.218 0.066 1.00 10.00 H new ATOM 0 HG3 GLN B 71 5.984 12.664 0.232 1.00 10.00 H new ATOM 0 HE21 GLN B 71 7.319 11.993 -1.437 1.00 10.00 H new ATOM 0 HE22 GLN B 71 7.362 12.751 -3.032 1.00 10.00 H new ATOM 1084 N GLN B 72 0.425 12.987 -1.132 1.00 10.00 N ATOM 1085 CA GLN B 72 -0.903 12.509 -1.536 1.00 10.00 C ATOM 1086 C GLN B 72 -1.083 12.419 -3.058 1.00 10.00 C ATOM 1087 O GLN B 72 -1.949 11.688 -3.553 1.00 10.00 O ATOM 1088 CB GLN B 72 -1.967 13.454 -0.930 1.00 10.00 C ATOM 1089 CG GLN B 72 -2.056 14.892 -1.482 1.00 10.00 C ATOM 1090 CD GLN B 72 -3.160 15.068 -2.526 1.00 10.00 C ATOM 1091 OE1 GLN B 72 -2.902 15.332 -3.696 1.00 10.00 O ATOM 1092 NE2 GLN B 72 -4.417 14.949 -2.125 1.00 10.00 N ATOM 0 H GLN B 72 0.364 13.766 -0.477 1.00 10.00 H new ATOM 0 HA GLN B 72 -1.018 11.492 -1.160 1.00 10.00 H new ATOM 0 HB2 GLN B 72 -2.943 12.985 -1.060 1.00 10.00 H new ATOM 0 HB3 GLN B 72 -1.784 13.519 0.143 1.00 10.00 H new ATOM 0 HG2 GLN B 72 -2.232 15.581 -0.656 1.00 10.00 H new ATOM 0 HG3 GLN B 72 -1.098 15.164 -1.926 1.00 10.00 H new ATOM 0 HE21 GLN B 72 -4.623 14.729 -1.150 1.00 10.00 H new ATOM 0 HE22 GLN B 72 -5.179 15.077 -2.791 1.00 10.00 H new ATOM 1101 N GLN B 73 -0.278 13.182 -3.807 1.00 10.00 N ATOM 1102 CA GLN B 73 -0.351 13.289 -5.255 1.00 10.00 C ATOM 1103 C GLN B 73 -0.050 11.999 -6.037 1.00 10.00 C ATOM 1104 O GLN B 73 0.448 10.993 -5.526 1.00 10.00 O ATOM 1105 CB GLN B 73 0.551 14.455 -5.719 1.00 10.00 C ATOM 1106 CG GLN B 73 -0.250 15.752 -5.898 1.00 10.00 C ATOM 1107 CD GLN B 73 -1.407 15.551 -6.875 1.00 10.00 C ATOM 1108 OE1 GLN B 73 -1.220 15.227 -8.043 1.00 10.00 O ATOM 1109 NE2 GLN B 73 -2.635 15.651 -6.411 1.00 10.00 N ATOM 0 H GLN B 73 0.462 13.756 -3.403 1.00 10.00 H new ATOM 0 HA GLN B 73 -1.396 13.488 -5.491 1.00 10.00 H new ATOM 0 HB2 GLN B 73 1.345 14.615 -4.989 1.00 10.00 H new ATOM 0 HB3 GLN B 73 1.032 14.191 -6.661 1.00 10.00 H new ATOM 0 HG2 GLN B 73 -0.637 16.081 -4.933 1.00 10.00 H new ATOM 0 HG3 GLN B 73 0.407 16.541 -6.264 1.00 10.00 H new ATOM 0 HE21 GLN B 73 -2.793 15.920 -5.440 1.00 10.00 H new ATOM 0 HE22 GLN B 73 -3.428 15.459 -7.023 1.00 10.00 H new ATOM 1118 N GLN B 74 -0.317 12.106 -7.345 1.00 10.00 N ATOM 1119 CA GLN B 74 -0.138 11.089 -8.388 1.00 10.00 C ATOM 1120 C GLN B 74 1.222 10.391 -8.345 1.00 10.00 C ATOM 1121 O GLN B 74 1.317 9.268 -8.828 1.00 10.00 O ATOM 1122 CB GLN B 74 -0.288 11.758 -9.761 1.00 10.00 C ATOM 1123 CG GLN B 74 -1.690 12.328 -10.037 1.00 10.00 C ATOM 1124 CD GLN B 74 -1.646 13.400 -11.120 1.00 10.00 C ATOM 1125 OE1 GLN B 74 -1.765 13.130 -12.304 1.00 10.00 O ATOM 1126 NE2 GLN B 74 -1.459 14.656 -10.746 1.00 10.00 N ATOM 0 H GLN B 74 -0.693 12.972 -7.731 1.00 10.00 H new ATOM 0 HA GLN B 74 -0.897 10.327 -8.211 1.00 10.00 H new ATOM 0 HB2 GLN B 74 0.441 12.564 -9.841 1.00 10.00 H new ATOM 0 HB3 GLN B 74 -0.045 11.030 -10.535 1.00 10.00 H new ATOM 0 HG2 GLN B 74 -2.358 11.524 -10.345 1.00 10.00 H new ATOM 0 HG3 GLN B 74 -2.101 12.750 -9.120 1.00 10.00 H new ATOM 0 HE21 GLN B 74 -1.359 14.884 -9.757 1.00 10.00 H new ATOM 0 HE22 GLN B 74 -1.415 15.396 -11.447 1.00 10.00 H new ATOM 1135 N GLN B 75 2.262 11.012 -7.781 1.00 10.00 N ATOM 1136 CA GLN B 75 3.601 10.432 -7.676 1.00 10.00 C ATOM 1137 C GLN B 75 3.635 9.050 -7.023 1.00 10.00 C ATOM 1138 O GLN B 75 4.372 8.206 -7.521 1.00 10.00 O ATOM 1139 CB GLN B 75 4.579 11.412 -6.985 1.00 10.00 C ATOM 1140 CG GLN B 75 4.201 11.823 -5.544 1.00 10.00 C ATOM 1141 CD GLN B 75 5.043 11.223 -4.418 1.00 10.00 C ATOM 1142 OE1 GLN B 75 6.242 11.005 -4.538 1.00 10.00 O ATOM 1143 NE2 GLN B 75 4.436 10.948 -3.276 1.00 10.00 N ATOM 0 H GLN B 75 2.194 11.947 -7.379 1.00 10.00 H new ATOM 0 HA GLN B 75 3.935 10.271 -8.701 1.00 10.00 H new ATOM 0 HB2 GLN B 75 5.569 10.957 -6.967 1.00 10.00 H new ATOM 0 HB3 GLN B 75 4.654 12.313 -7.594 1.00 10.00 H new ATOM 0 HG2 GLN B 75 4.261 12.909 -5.473 1.00 10.00 H new ATOM 0 HG3 GLN B 75 3.160 11.549 -5.374 1.00 10.00 H new ATOM 0 HE21 GLN B 75 3.437 11.128 -3.173 1.00 10.00 H new ATOM 0 HE22 GLN B 75 4.966 10.555 -2.498 1.00 10.00 H new ATOM 1152 N VAL B 76 2.809 8.785 -5.994 1.00 10.00 N ATOM 1153 CA VAL B 76 2.768 7.431 -5.435 1.00 10.00 C ATOM 1154 C VAL B 76 2.190 6.494 -6.469 1.00 10.00 C ATOM 1155 O VAL B 76 2.801 5.473 -6.772 1.00 10.00 O ATOM 1156 CB VAL B 76 1.979 7.281 -4.127 1.00 10.00 C ATOM 1157 CG1 VAL B 76 2.425 6.003 -3.417 1.00 10.00 C ATOM 1158 CG2 VAL B 76 2.198 8.405 -3.143 1.00 10.00 C ATOM 0 H VAL B 76 2.187 9.462 -5.551 1.00 10.00 H new ATOM 0 HA VAL B 76 3.799 7.187 -5.181 1.00 10.00 H new ATOM 0 HB VAL B 76 0.929 7.274 -4.419 1.00 10.00 H new ATOM 0 HG11 VAL B 76 1.868 5.890 -2.487 1.00 10.00 H new ATOM 0 HG12 VAL B 76 2.234 5.144 -4.060 1.00 10.00 H new ATOM 0 HG13 VAL B 76 3.491 6.062 -3.197 1.00 10.00 H new ATOM 0 HG21 VAL B 76 1.606 8.224 -2.246 1.00 10.00 H new ATOM 0 HG22 VAL B 76 3.254 8.455 -2.877 1.00 10.00 H new ATOM 0 HG23 VAL B 76 1.893 9.349 -3.595 1.00 10.00 H new ATOM 1168 N LEU B 77 1.018 6.857 -7.001 1.00 10.00 N ATOM 1169 CA LEU B 77 0.257 6.017 -7.907 1.00 10.00 C ATOM 1170 C LEU B 77 1.080 5.700 -9.180 1.00 10.00 C ATOM 1171 O LEU B 77 1.092 4.569 -9.676 1.00 10.00 O ATOM 1172 CB LEU B 77 -1.111 6.657 -8.182 1.00 10.00 C ATOM 1173 CG LEU B 77 -2.242 5.612 -8.311 1.00 10.00 C ATOM 1174 CD1 LEU B 77 -3.594 6.326 -8.332 1.00 10.00 C ATOM 1175 CD2 LEU B 77 -2.101 4.762 -9.575 1.00 10.00 C ATOM 0 H LEU B 77 0.574 7.754 -6.807 1.00 10.00 H new ATOM 0 HA LEU B 77 0.056 5.050 -7.446 1.00 10.00 H new ATOM 0 HB2 LEU B 77 -1.352 7.350 -7.376 1.00 10.00 H new ATOM 0 HB3 LEU B 77 -1.056 7.242 -9.100 1.00 10.00 H new ATOM 0 HG LEU B 77 -2.174 4.945 -7.452 1.00 10.00 H new ATOM 0 HD11 LEU B 77 -4.393 5.590 -8.423 1.00 10.00 H new ATOM 0 HD12 LEU B 77 -3.723 6.889 -7.407 1.00 10.00 H new ATOM 0 HD13 LEU B 77 -3.632 7.009 -9.181 1.00 10.00 H new ATOM 0 HD21 LEU B 77 -2.918 4.042 -9.622 1.00 10.00 H new ATOM 0 HD22 LEU B 77 -2.134 5.407 -10.453 1.00 10.00 H new ATOM 0 HD23 LEU B 77 -1.150 4.230 -9.552 1.00 10.00 H new ATOM 1187 N ASN B 78 1.842 6.693 -9.646 1.00 10.00 N ATOM 1188 CA ASN B 78 2.752 6.618 -10.782 1.00 10.00 C ATOM 1189 C ASN B 78 3.903 5.619 -10.584 1.00 10.00 C ATOM 1190 O ASN B 78 4.330 5.013 -11.568 1.00 10.00 O ATOM 1191 CB ASN B 78 3.265 8.032 -11.102 1.00 10.00 C ATOM 1192 CG ASN B 78 3.993 8.094 -12.436 1.00 10.00 C ATOM 1193 OD1 ASN B 78 3.557 7.508 -13.419 1.00 10.00 O ATOM 1194 ND2 ASN B 78 5.120 8.775 -12.512 1.00 10.00 N ATOM 0 H ASN B 78 1.837 7.618 -9.215 1.00 10.00 H new ATOM 0 HA ASN B 78 2.195 6.228 -11.634 1.00 10.00 H new ATOM 0 HB2 ASN B 78 2.425 8.726 -11.117 1.00 10.00 H new ATOM 0 HB3 ASN B 78 3.936 8.361 -10.309 1.00 10.00 H new ATOM 0 HD21 ASN B 78 5.633 8.815 -13.393 1.00 10.00 H new ATOM 0 HD22 ASN B 78 5.478 9.261 -11.690 1.00 10.00 H new ATOM 1201 N ILE B 79 4.394 5.414 -9.355 1.00 10.00 N ATOM 1202 CA ILE B 79 5.394 4.380 -9.071 1.00 10.00 C ATOM 1203 C ILE B 79 4.679 3.048 -8.754 1.00 10.00 C ATOM 1204 O ILE B 79 5.035 2.015 -9.326 1.00 10.00 O ATOM 1205 CB ILE B 79 6.395 4.850 -7.998 1.00 10.00 C ATOM 1206 CG1 ILE B 79 7.065 6.204 -8.353 1.00 10.00 C ATOM 1207 CG2 ILE B 79 7.519 3.815 -7.860 1.00 10.00 C ATOM 1208 CD1 ILE B 79 7.471 7.026 -7.123 1.00 10.00 C ATOM 0 H ILE B 79 4.112 5.955 -8.538 1.00 10.00 H new ATOM 0 HA ILE B 79 6.010 4.196 -9.951 1.00 10.00 H new ATOM 0 HB ILE B 79 5.826 4.968 -7.076 1.00 10.00 H new ATOM 0 HG12 ILE B 79 7.949 6.014 -8.962 1.00 10.00 H new ATOM 0 HG13 ILE B 79 6.378 6.792 -8.963 1.00 10.00 H new ATOM 0 HG21 ILE B 79 8.228 4.147 -7.101 1.00 10.00 H new ATOM 0 HG22 ILE B 79 7.095 2.855 -7.566 1.00 10.00 H new ATOM 0 HG23 ILE B 79 8.034 3.707 -8.815 1.00 10.00 H new ATOM 0 HD11 ILE B 79 7.933 7.959 -7.445 1.00 10.00 H new ATOM 0 HD12 ILE B 79 6.587 7.246 -6.525 1.00 10.00 H new ATOM 0 HD13 ILE B 79 8.182 6.457 -6.524 1.00 10.00 H new ATOM 1220 N LEU B 80 3.621 3.090 -7.933 1.00 10.00 N ATOM 1221 CA LEU B 80 2.718 1.986 -7.580 1.00 10.00 C ATOM 1222 C LEU B 80 2.375 1.096 -8.779 1.00 10.00 C ATOM 1223 O LEU B 80 2.672 -0.095 -8.742 1.00 10.00 O ATOM 1224 CB LEU B 80 1.415 2.559 -6.989 1.00 10.00 C ATOM 1225 CG LEU B 80 1.360 2.732 -5.472 1.00 10.00 C ATOM 1226 CD1 LEU B 80 0.242 3.688 -5.021 1.00 10.00 C ATOM 1227 CD2 LEU B 80 0.992 1.403 -4.845 1.00 10.00 C ATOM 0 H LEU B 80 3.355 3.957 -7.465 1.00 10.00 H new ATOM 0 HA LEU B 80 3.238 1.366 -6.849 1.00 10.00 H new ATOM 0 HB2 LEU B 80 1.233 3.531 -7.448 1.00 10.00 H new ATOM 0 HB3 LEU B 80 0.593 1.908 -7.286 1.00 10.00 H new ATOM 0 HG LEU B 80 2.335 3.118 -5.173 1.00 10.00 H new ATOM 0 HD11 LEU B 80 0.251 3.772 -3.934 1.00 10.00 H new ATOM 0 HD12 LEU B 80 0.404 4.671 -5.462 1.00 10.00 H new ATOM 0 HD13 LEU B 80 -0.723 3.299 -5.347 1.00 10.00 H new ATOM 0 HD21 LEU B 80 0.949 1.511 -3.761 1.00 10.00 H new ATOM 0 HD22 LEU B 80 0.019 1.083 -5.217 1.00 10.00 H new ATOM 0 HD23 LEU B 80 1.743 0.657 -5.105 1.00 10.00 H new ATOM 1239 N LYS B 81 1.757 1.658 -9.833 1.00 10.00 N ATOM 1240 CA LYS B 81 1.206 0.845 -10.936 1.00 10.00 C ATOM 1241 C LYS B 81 2.254 0.074 -11.749 1.00 10.00 C ATOM 1242 O LYS B 81 1.901 -0.768 -12.563 1.00 10.00 O ATOM 1243 CB LYS B 81 0.221 1.661 -11.810 1.00 10.00 C ATOM 1244 CG LYS B 81 0.772 2.317 -13.085 1.00 10.00 C ATOM 1245 CD LYS B 81 1.834 3.398 -12.843 1.00 10.00 C ATOM 1246 CE LYS B 81 2.329 3.894 -14.204 1.00 10.00 C ATOM 1247 NZ LYS B 81 3.414 4.893 -14.080 1.00 10.00 N ATOM 0 H LYS B 81 1.626 2.663 -9.946 1.00 10.00 H new ATOM 0 HA LYS B 81 0.628 0.054 -10.458 1.00 10.00 H new ATOM 0 HB2 LYS B 81 -0.597 1.001 -12.099 1.00 10.00 H new ATOM 0 HB3 LYS B 81 -0.208 2.446 -11.188 1.00 10.00 H new ATOM 0 HG2 LYS B 81 1.201 1.542 -13.720 1.00 10.00 H new ATOM 0 HG3 LYS B 81 -0.057 2.759 -13.637 1.00 10.00 H new ATOM 0 HD2 LYS B 81 1.413 4.223 -12.268 1.00 10.00 H new ATOM 0 HD3 LYS B 81 2.662 2.994 -12.261 1.00 10.00 H new ATOM 0 HE2 LYS B 81 2.685 3.046 -14.789 1.00 10.00 H new ATOM 0 HE3 LYS B 81 1.496 4.333 -14.753 1.00 10.00 H new ATOM 0 HZ1 LYS B 81 4.002 4.875 -14.938 1.00 10.00 H new ATOM 0 HZ2 LYS B 81 3.002 5.841 -13.962 1.00 10.00 H new ATOM 0 HZ3 LYS B 81 4.002 4.666 -13.253 1.00 10.00 H new ATOM 1261 N SER B 82 3.554 0.357 -11.539 1.00 10.00 N ATOM 1262 CA SER B 82 4.684 -0.321 -12.188 1.00 10.00 C ATOM 1263 C SER B 82 5.069 -1.666 -11.556 1.00 10.00 C ATOM 1264 O SER B 82 5.674 -2.497 -12.230 1.00 10.00 O ATOM 1265 CB SER B 82 5.911 0.601 -12.225 1.00 10.00 C ATOM 1266 OG SER B 82 6.516 0.736 -10.958 1.00 10.00 O ATOM 0 H SER B 82 3.852 1.087 -10.892 1.00 10.00 H new ATOM 0 HA SER B 82 4.342 -0.547 -13.198 1.00 10.00 H new ATOM 0 HB2 SER B 82 6.639 0.205 -12.933 1.00 10.00 H new ATOM 0 HB3 SER B 82 5.613 1.584 -12.590 1.00 10.00 H new ATOM 0 HG SER B 82 6.034 1.411 -10.436 1.00 10.00 H new ATOM 1272 N ASN B 83 4.669 -1.924 -10.309 1.00 10.00 N ATOM 1273 CA ASN B 83 4.786 -3.250 -9.689 1.00 10.00 C ATOM 1274 C ASN B 83 3.377 -3.797 -9.413 1.00 10.00 C ATOM 1275 O ASN B 83 2.727 -3.347 -8.469 1.00 10.00 O ATOM 1276 CB ASN B 83 5.658 -3.197 -8.430 1.00 10.00 C ATOM 1277 CG ASN B 83 5.818 -4.571 -7.785 1.00 10.00 C ATOM 1278 OD1 ASN B 83 4.910 -5.377 -7.659 1.00 10.00 O ATOM 1279 ND2 ASN B 83 7.011 -4.866 -7.353 1.00 10.00 N ATOM 0 H ASN B 83 4.254 -1.220 -9.698 1.00 10.00 H new ATOM 0 HA ASN B 83 5.290 -3.935 -10.371 1.00 10.00 H new ATOM 0 HB2 ASN B 83 6.640 -2.801 -8.686 1.00 10.00 H new ATOM 0 HB3 ASN B 83 5.214 -2.509 -7.711 1.00 10.00 H new ATOM 0 HD21 ASN B 83 7.185 -5.769 -6.911 1.00 10.00 H new ATOM 0 HD22 ASN B 83 7.772 -4.194 -7.457 1.00 10.00 H new ATOM 1286 N PRO B 84 2.893 -4.749 -10.227 1.00 10.00 N ATOM 1287 CA PRO B 84 1.521 -5.244 -10.120 1.00 10.00 C ATOM 1288 C PRO B 84 1.213 -5.828 -8.733 1.00 10.00 C ATOM 1289 O PRO B 84 0.159 -5.558 -8.150 1.00 10.00 O ATOM 1290 CB PRO B 84 1.381 -6.293 -11.243 1.00 10.00 C ATOM 1291 CG PRO B 84 2.567 -6.026 -12.175 1.00 10.00 C ATOM 1292 CD PRO B 84 3.628 -5.454 -11.258 1.00 10.00 C ATOM 0 HA PRO B 84 0.797 -4.437 -10.234 1.00 10.00 H new ATOM 0 HB2 PRO B 84 1.412 -7.307 -10.844 1.00 10.00 H new ATOM 0 HB3 PRO B 84 0.432 -6.186 -11.769 1.00 10.00 H new ATOM 0 HG2 PRO B 84 2.908 -6.941 -12.660 1.00 10.00 H new ATOM 0 HG3 PRO B 84 2.303 -5.325 -12.967 1.00 10.00 H new ATOM 0 HD2 PRO B 84 4.248 -6.243 -10.831 1.00 10.00 H new ATOM 0 HD3 PRO B 84 4.295 -4.781 -11.797 1.00 10.00 H new ATOM 1300 N GLN B 85 2.156 -6.604 -8.190 1.00 10.00 N ATOM 1301 CA GLN B 85 2.000 -7.275 -6.904 1.00 10.00 C ATOM 1302 C GLN B 85 2.039 -6.283 -5.733 1.00 10.00 C ATOM 1303 O GLN B 85 1.213 -6.425 -4.838 1.00 10.00 O ATOM 1304 CB GLN B 85 3.042 -8.391 -6.761 1.00 10.00 C ATOM 1305 CG GLN B 85 2.935 -9.150 -5.429 1.00 10.00 C ATOM 1306 CD GLN B 85 1.596 -9.857 -5.208 1.00 10.00 C ATOM 1307 OE1 GLN B 85 1.435 -11.029 -5.494 1.00 10.00 O ATOM 1308 NE2 GLN B 85 0.585 -9.182 -4.692 1.00 10.00 N ATOM 0 H GLN B 85 3.055 -6.783 -8.637 1.00 10.00 H new ATOM 0 HA GLN B 85 1.012 -7.735 -6.873 1.00 10.00 H new ATOM 0 HB2 GLN B 85 2.926 -9.096 -7.584 1.00 10.00 H new ATOM 0 HB3 GLN B 85 4.040 -7.961 -6.848 1.00 10.00 H new ATOM 0 HG2 GLN B 85 3.734 -9.890 -5.381 1.00 10.00 H new ATOM 0 HG3 GLN B 85 3.101 -8.449 -4.611 1.00 10.00 H new ATOM 0 HE21 GLN B 85 0.701 -8.199 -4.446 1.00 10.00 H new ATOM 0 HE22 GLN B 85 -0.312 -9.644 -4.539 1.00 10.00 H new ATOM 1317 N LEU B 86 2.944 -5.289 -5.744 1.00 10.00 N ATOM 1318 CA LEU B 86 2.948 -4.179 -4.783 1.00 10.00 C ATOM 1319 C LEU B 86 1.642 -3.388 -4.914 1.00 10.00 C ATOM 1320 O LEU B 86 1.059 -3.058 -3.894 1.00 10.00 O ATOM 1321 CB LEU B 86 4.180 -3.260 -4.955 1.00 10.00 C ATOM 1322 CG LEU B 86 4.429 -2.174 -3.874 1.00 10.00 C ATOM 1323 CD1 LEU B 86 3.620 -0.904 -4.100 1.00 10.00 C ATOM 1324 CD2 LEU B 86 4.194 -2.576 -2.413 1.00 10.00 C ATOM 0 H LEU B 86 3.699 -5.236 -6.428 1.00 10.00 H new ATOM 0 HA LEU B 86 3.017 -4.597 -3.779 1.00 10.00 H new ATOM 0 HB2 LEU B 86 5.066 -3.893 -5.004 1.00 10.00 H new ATOM 0 HB3 LEU B 86 4.092 -2.759 -5.919 1.00 10.00 H new ATOM 0 HG LEU B 86 5.498 -2.012 -4.011 1.00 10.00 H new ATOM 0 HD11 LEU B 86 3.841 -0.187 -3.310 1.00 10.00 H new ATOM 0 HD12 LEU B 86 3.883 -0.472 -5.066 1.00 10.00 H new ATOM 0 HD13 LEU B 86 2.557 -1.143 -4.087 1.00 10.00 H new ATOM 0 HD21 LEU B 86 4.404 -1.726 -1.764 1.00 10.00 H new ATOM 0 HD22 LEU B 86 3.157 -2.885 -2.283 1.00 10.00 H new ATOM 0 HD23 LEU B 86 4.854 -3.403 -2.153 1.00 10.00 H new ATOM 1336 N MET B 87 1.158 -3.098 -6.126 1.00 10.00 N ATOM 1337 CA MET B 87 -0.115 -2.399 -6.313 1.00 10.00 C ATOM 1338 C MET B 87 -1.304 -3.171 -5.720 1.00 10.00 C ATOM 1339 O MET B 87 -2.096 -2.604 -4.974 1.00 10.00 O ATOM 1340 CB MET B 87 -0.326 -2.068 -7.797 1.00 10.00 C ATOM 1341 CG MET B 87 -1.204 -0.829 -7.884 1.00 10.00 C ATOM 1342 SD MET B 87 -1.942 -0.551 -9.504 1.00 10.00 S ATOM 1343 CE MET B 87 -2.777 0.981 -9.045 1.00 10.00 C ATOM 0 H MET B 87 1.633 -3.339 -6.996 1.00 10.00 H new ATOM 0 HA MET B 87 -0.064 -1.462 -5.758 1.00 10.00 H new ATOM 0 HB2 MET B 87 0.631 -1.891 -8.288 1.00 10.00 H new ATOM 0 HB3 MET B 87 -0.798 -2.906 -8.311 1.00 10.00 H new ATOM 0 HG2 MET B 87 -2.001 -0.911 -7.145 1.00 10.00 H new ATOM 0 HG3 MET B 87 -0.608 0.043 -7.615 1.00 10.00 H new ATOM 0 HE1 MET B 87 -3.324 1.369 -9.904 1.00 10.00 H new ATOM 0 HE2 MET B 87 -3.473 0.786 -8.229 1.00 10.00 H new ATOM 0 HE3 MET B 87 -2.039 1.716 -8.724 1.00 10.00 H new ATOM 1353 N ALA B 88 -1.400 -4.477 -5.988 1.00 10.00 N ATOM 1354 CA ALA B 88 -2.399 -5.335 -5.344 1.00 10.00 C ATOM 1355 C ALA B 88 -2.193 -5.419 -3.820 1.00 10.00 C ATOM 1356 O ALA B 88 -3.165 -5.308 -3.073 1.00 10.00 O ATOM 1357 CB ALA B 88 -2.355 -6.718 -5.992 1.00 10.00 C ATOM 0 H ALA B 88 -0.795 -4.964 -6.649 1.00 10.00 H new ATOM 0 HA ALA B 88 -3.386 -4.897 -5.491 1.00 10.00 H new ATOM 0 HB1 ALA B 88 -3.095 -7.365 -5.520 1.00 10.00 H new ATOM 0 HB2 ALA B 88 -2.577 -6.629 -7.055 1.00 10.00 H new ATOM 0 HB3 ALA B 88 -1.362 -7.149 -5.863 1.00 10.00 H new ATOM 1363 N ALA B 89 -0.947 -5.544 -3.346 1.00 10.00 N ATOM 1364 CA ALA B 89 -0.624 -5.536 -1.921 1.00 10.00 C ATOM 1365 C ALA B 89 -0.940 -4.191 -1.247 1.00 10.00 C ATOM 1366 O ALA B 89 -1.403 -4.193 -0.118 1.00 10.00 O ATOM 1367 CB ALA B 89 0.845 -5.923 -1.717 1.00 10.00 C ATOM 0 H ALA B 89 -0.131 -5.654 -3.948 1.00 10.00 H new ATOM 0 HA ALA B 89 -1.262 -6.276 -1.437 1.00 10.00 H new ATOM 0 HB1 ALA B 89 1.079 -5.915 -0.652 1.00 10.00 H new ATOM 0 HB2 ALA B 89 1.017 -6.921 -2.119 1.00 10.00 H new ATOM 0 HB3 ALA B 89 1.485 -5.208 -2.234 1.00 10.00 H new ATOM 1373 N PHE B 90 -0.757 -3.062 -1.939 1.00 10.00 N ATOM 1374 CA PHE B 90 -1.193 -1.737 -1.511 1.00 10.00 C ATOM 1375 C PHE B 90 -2.709 -1.749 -1.338 1.00 10.00 C ATOM 1376 O PHE B 90 -3.172 -1.617 -0.213 1.00 10.00 O ATOM 1377 CB PHE B 90 -0.769 -0.663 -2.526 1.00 10.00 C ATOM 1378 CG PHE B 90 -1.272 0.744 -2.230 1.00 10.00 C ATOM 1379 CD1 PHE B 90 -0.871 1.377 -1.050 1.00 10.00 C ATOM 1380 CD2 PHE B 90 -2.074 1.456 -3.147 1.00 10.00 C ATOM 1381 CE1 PHE B 90 -1.182 2.718 -0.800 1.00 10.00 C ATOM 1382 CE2 PHE B 90 -2.394 2.808 -2.894 1.00 10.00 C ATOM 1383 CZ PHE B 90 -1.895 3.445 -1.745 1.00 10.00 C ATOM 0 H PHE B 90 -0.285 -3.049 -2.843 1.00 10.00 H new ATOM 0 HA PHE B 90 -0.719 -1.491 -0.561 1.00 10.00 H new ATOM 0 HB2 PHE B 90 0.320 -0.640 -2.573 1.00 10.00 H new ATOM 0 HB3 PHE B 90 -1.124 -0.958 -3.513 1.00 10.00 H new ATOM 0 HD1 PHE B 90 -0.309 0.819 -0.316 1.00 10.00 H new ATOM 0 HD2 PHE B 90 -2.441 0.969 -4.038 1.00 10.00 H new ATOM 0 HE1 PHE B 90 -0.870 3.185 0.122 1.00 10.00 H new ATOM 0 HE2 PHE B 90 -3.022 3.352 -3.583 1.00 10.00 H new ATOM 0 HZ PHE B 90 -2.066 4.501 -1.596 1.00 10.00 H new ATOM 1393 N ILE B 91 -3.467 -2.029 -2.412 1.00 10.00 N ATOM 1394 CA ILE B 91 -4.935 -2.137 -2.391 1.00 10.00 C ATOM 1395 C ILE B 91 -5.398 -3.005 -1.214 1.00 10.00 C ATOM 1396 O ILE B 91 -6.150 -2.521 -0.362 1.00 10.00 O ATOM 1397 CB ILE B 91 -5.458 -2.605 -3.769 1.00 10.00 C ATOM 1398 CG1 ILE B 91 -5.267 -1.467 -4.803 1.00 10.00 C ATOM 1399 CG2 ILE B 91 -6.941 -3.034 -3.698 1.00 10.00 C ATOM 1400 CD1 ILE B 91 -5.479 -1.874 -6.264 1.00 10.00 C ATOM 0 H ILE B 91 -3.068 -2.190 -3.337 1.00 10.00 H new ATOM 0 HA ILE B 91 -5.376 -1.155 -2.220 1.00 10.00 H new ATOM 0 HB ILE B 91 -4.885 -3.479 -4.079 1.00 10.00 H new ATOM 0 HG12 ILE B 91 -5.959 -0.659 -4.563 1.00 10.00 H new ATOM 0 HG13 ILE B 91 -4.259 -1.066 -4.696 1.00 10.00 H new ATOM 0 HG21 ILE B 91 -7.274 -3.357 -4.684 1.00 10.00 H new ATOM 0 HG22 ILE B 91 -7.048 -3.857 -2.992 1.00 10.00 H new ATOM 0 HG23 ILE B 91 -7.548 -2.191 -3.368 1.00 10.00 H new ATOM 0 HD11 ILE B 91 -5.323 -1.009 -6.909 1.00 10.00 H new ATOM 0 HD12 ILE B 91 -4.770 -2.658 -6.530 1.00 10.00 H new ATOM 0 HD13 ILE B 91 -6.496 -2.245 -6.394 1.00 10.00 H new ATOM 1412 N LYS B 92 -4.892 -4.236 -1.111 1.00 10.00 N ATOM 1413 CA LYS B 92 -5.242 -5.164 -0.045 1.00 10.00 C ATOM 1414 C LYS B 92 -4.825 -4.705 1.351 1.00 10.00 C ATOM 1415 O LYS B 92 -5.674 -4.680 2.239 1.00 10.00 O ATOM 1416 CB LYS B 92 -4.690 -6.552 -0.402 1.00 10.00 C ATOM 1417 CG LYS B 92 -5.120 -7.643 0.594 1.00 10.00 C ATOM 1418 CD LYS B 92 -6.618 -7.675 0.956 1.00 10.00 C ATOM 1419 CE LYS B 92 -7.588 -7.563 -0.225 1.00 10.00 C ATOM 1420 NZ LYS B 92 -8.209 -8.854 -0.570 1.00 10.00 N ATOM 0 H LYS B 92 -4.219 -4.617 -1.777 1.00 10.00 H new ATOM 0 HA LYS B 92 -6.329 -5.206 0.018 1.00 10.00 H new ATOM 0 HB2 LYS B 92 -5.029 -6.826 -1.401 1.00 10.00 H new ATOM 0 HB3 LYS B 92 -3.601 -6.507 -0.436 1.00 10.00 H new ATOM 0 HG2 LYS B 92 -4.846 -8.613 0.180 1.00 10.00 H new ATOM 0 HG3 LYS B 92 -4.547 -7.515 1.512 1.00 10.00 H new ATOM 0 HD2 LYS B 92 -6.825 -8.605 1.486 1.00 10.00 H new ATOM 0 HD3 LYS B 92 -6.823 -6.860 1.650 1.00 10.00 H new ATOM 0 HE2 LYS B 92 -8.368 -6.841 0.017 1.00 10.00 H new ATOM 0 HE3 LYS B 92 -7.055 -7.176 -1.094 1.00 10.00 H new ATOM 0 HZ1 LYS B 92 -8.856 -8.724 -1.374 1.00 10.00 H new ATOM 0 HZ2 LYS B 92 -7.469 -9.537 -0.828 1.00 10.00 H new ATOM 0 HZ3 LYS B 92 -8.741 -9.213 0.248 1.00 10.00 H new ATOM 1434 N GLN B 93 -3.555 -4.361 1.589 1.00 10.00 N ATOM 1435 CA GLN B 93 -3.145 -3.969 2.935 1.00 10.00 C ATOM 1436 C GLN B 93 -3.803 -2.638 3.325 1.00 10.00 C ATOM 1437 O GLN B 93 -4.120 -2.468 4.489 1.00 10.00 O ATOM 1438 CB GLN B 93 -1.614 -3.922 3.124 1.00 10.00 C ATOM 1439 CG GLN B 93 -1.088 -4.521 4.453 1.00 10.00 C ATOM 1440 CD GLN B 93 -1.892 -4.176 5.715 1.00 10.00 C ATOM 1441 OE1 GLN B 93 -2.744 -4.941 6.142 1.00 10.00 O ATOM 1442 NE2 GLN B 93 -1.664 -3.048 6.358 1.00 10.00 N ATOM 0 H GLN B 93 -2.814 -4.346 0.888 1.00 10.00 H new ATOM 0 HA GLN B 93 -3.496 -4.749 3.611 1.00 10.00 H new ATOM 0 HB2 GLN B 93 -1.146 -4.454 2.296 1.00 10.00 H new ATOM 0 HB3 GLN B 93 -1.289 -2.884 3.060 1.00 10.00 H new ATOM 0 HG2 GLN B 93 -1.057 -5.606 4.352 1.00 10.00 H new ATOM 0 HG3 GLN B 93 -0.061 -4.185 4.598 1.00 10.00 H new ATOM 0 HE21 GLN B 93 -0.956 -2.399 6.014 1.00 10.00 H new ATOM 0 HE22 GLN B 93 -2.195 -2.824 7.199 1.00 10.00 H new ATOM 1451 N ARG B 94 -4.059 -1.703 2.396 1.00 10.00 N ATOM 1452 CA ARG B 94 -4.836 -0.483 2.661 1.00 10.00 C ATOM 1453 C ARG B 94 -6.284 -0.820 3.025 1.00 10.00 C ATOM 1454 O ARG B 94 -6.773 -0.301 4.031 1.00 10.00 O ATOM 1455 CB ARG B 94 -4.842 0.476 1.463 1.00 10.00 C ATOM 1456 CG ARG B 94 -3.512 1.156 1.095 1.00 10.00 C ATOM 1457 CD ARG B 94 -2.900 2.040 2.174 1.00 10.00 C ATOM 1458 NE ARG B 94 -3.745 3.177 2.546 1.00 10.00 N ATOM 1459 CZ ARG B 94 -3.577 3.911 3.638 1.00 10.00 C ATOM 1460 NH1 ARG B 94 -2.511 3.790 4.402 1.00 10.00 N ATOM 1461 NH2 ARG B 94 -4.434 4.821 4.006 1.00 10.00 N ATOM 0 H ARG B 94 -3.730 -1.774 1.433 1.00 10.00 H new ATOM 0 HA ARG B 94 -4.346 0.010 3.501 1.00 10.00 H new ATOM 0 HB2 ARG B 94 -5.191 -0.077 0.591 1.00 10.00 H new ATOM 0 HB3 ARG B 94 -5.577 1.257 1.660 1.00 10.00 H new ATOM 0 HG2 ARG B 94 -2.790 0.382 0.833 1.00 10.00 H new ATOM 0 HG3 ARG B 94 -3.670 1.761 0.202 1.00 10.00 H new ATOM 0 HD2 ARG B 94 -2.706 1.436 3.061 1.00 10.00 H new ATOM 0 HD3 ARG B 94 -1.937 2.412 1.825 1.00 10.00 H new ATOM 0 HE ARG B 94 -4.515 3.421 1.923 1.00 10.00 H new ATOM 0 HH11 ARG B 94 -1.784 3.116 4.160 1.00 10.00 H new ATOM 0 HH12 ARG B 94 -2.412 4.370 5.235 1.00 10.00 H new ATOM 0 HH21 ARG B 94 -5.270 4.990 3.447 1.00 10.00 H new ATOM 0 HH22 ARG B 94 -4.268 5.365 4.853 1.00 10.00 H new ATOM 1475 N THR B 95 -6.982 -1.687 2.259 1.00 10.00 N ATOM 1476 CA THR B 95 -8.343 -2.106 2.649 1.00 10.00 C ATOM 1477 C THR B 95 -8.340 -2.808 4.009 1.00 10.00 C ATOM 1478 O THR B 95 -9.188 -2.490 4.833 1.00 10.00 O ATOM 1479 CB THR B 95 -9.077 -2.979 1.623 1.00 10.00 C ATOM 1480 OG1 THR B 95 -8.405 -4.173 1.312 1.00 10.00 O ATOM 1481 CG2 THR B 95 -9.472 -2.320 0.317 1.00 10.00 C ATOM 0 H THR B 95 -6.637 -2.099 1.392 1.00 10.00 H new ATOM 0 HA THR B 95 -8.902 -1.172 2.705 1.00 10.00 H new ATOM 0 HB THR B 95 -9.997 -3.183 2.171 1.00 10.00 H new ATOM 0 HG1 THR B 95 -7.508 -4.156 1.707 1.00 10.00 H new ATOM 0 HG21 THR B 95 -9.982 -3.045 -0.317 1.00 10.00 H new ATOM 0 HG22 THR B 95 -10.139 -1.482 0.519 1.00 10.00 H new ATOM 0 HG23 THR B 95 -8.579 -1.958 -0.192 1.00 10.00 H new ATOM 1489 N ALA B 96 -7.371 -3.692 4.275 1.00 10.00 N ATOM 1490 CA ALA B 96 -7.139 -4.307 5.581 1.00 10.00 C ATOM 1491 C ALA B 96 -6.929 -3.250 6.691 1.00 10.00 C ATOM 1492 O ALA B 96 -7.638 -3.265 7.698 1.00 10.00 O ATOM 1493 CB ALA B 96 -5.983 -5.301 5.478 1.00 10.00 C ATOM 0 H ALA B 96 -6.709 -4.006 3.565 1.00 10.00 H new ATOM 0 HA ALA B 96 -8.031 -4.859 5.877 1.00 10.00 H new ATOM 0 HB1 ALA B 96 -5.810 -5.760 6.451 1.00 10.00 H new ATOM 0 HB2 ALA B 96 -6.232 -6.075 4.752 1.00 10.00 H new ATOM 0 HB3 ALA B 96 -5.082 -4.779 5.157 1.00 10.00 H new ATOM 1499 N LYS B 97 -6.002 -2.290 6.476 1.00 10.00 N ATOM 1500 CA LYS B 97 -5.775 -1.081 7.295 1.00 10.00 C ATOM 1501 C LYS B 97 -7.094 -0.388 7.616 1.00 10.00 C ATOM 1502 O LYS B 97 -7.349 -0.106 8.782 1.00 10.00 O ATOM 1503 CB LYS B 97 -4.717 -0.155 6.623 1.00 10.00 C ATOM 1504 CG LYS B 97 -5.006 1.357 6.482 1.00 10.00 C ATOM 1505 CD LYS B 97 -4.873 2.133 7.793 1.00 10.00 C ATOM 1506 CE LYS B 97 -5.677 3.435 7.713 1.00 10.00 C ATOM 1507 NZ LYS B 97 -5.569 4.215 8.965 1.00 10.00 N ATOM 0 H LYS B 97 -5.359 -2.341 5.685 1.00 10.00 H new ATOM 0 HA LYS B 97 -5.352 -1.368 8.258 1.00 10.00 H new ATOM 0 HB2 LYS B 97 -3.789 -0.259 7.185 1.00 10.00 H new ATOM 0 HB3 LYS B 97 -4.530 -0.546 5.623 1.00 10.00 H new ATOM 0 HG2 LYS B 97 -4.322 1.782 5.748 1.00 10.00 H new ATOM 0 HG3 LYS B 97 -6.015 1.490 6.092 1.00 10.00 H new ATOM 0 HD2 LYS B 97 -5.231 1.525 8.624 1.00 10.00 H new ATOM 0 HD3 LYS B 97 -3.824 2.355 7.990 1.00 10.00 H new ATOM 0 HE2 LYS B 97 -5.318 4.035 6.877 1.00 10.00 H new ATOM 0 HE3 LYS B 97 -6.724 3.206 7.515 1.00 10.00 H new ATOM 0 HZ1 LYS B 97 -6.298 4.957 8.976 1.00 10.00 H new ATOM 0 HZ2 LYS B 97 -5.706 3.584 9.780 1.00 10.00 H new ATOM 0 HZ3 LYS B 97 -4.628 4.653 9.021 1.00 10.00 H new ATOM 1521 N TYR B 98 -7.938 -0.126 6.619 1.00 10.00 N ATOM 1522 CA TYR B 98 -9.254 0.432 6.869 1.00 10.00 C ATOM 1523 C TYR B 98 -10.108 -0.522 7.706 1.00 10.00 C ATOM 1524 O TYR B 98 -10.382 -0.194 8.855 1.00 10.00 O ATOM 1525 CB TYR B 98 -9.926 0.826 5.554 1.00 10.00 C ATOM 1526 CG TYR B 98 -9.409 2.111 4.939 1.00 10.00 C ATOM 1527 CD1 TYR B 98 -9.416 3.298 5.692 1.00 10.00 C ATOM 1528 CD2 TYR B 98 -8.962 2.128 3.605 1.00 10.00 C ATOM 1529 CE1 TYR B 98 -8.958 4.493 5.122 1.00 10.00 C ATOM 1530 CE2 TYR B 98 -8.549 3.336 3.002 1.00 10.00 C ATOM 1531 CZ TYR B 98 -8.545 4.523 3.775 1.00 10.00 C ATOM 1532 OH TYR B 98 -8.150 5.716 3.246 1.00 10.00 O ATOM 0 H TYR B 98 -7.729 -0.293 5.635 1.00 10.00 H new ATOM 0 HA TYR B 98 -9.144 1.342 7.458 1.00 10.00 H new ATOM 0 HB2 TYR B 98 -9.792 0.016 4.837 1.00 10.00 H new ATOM 0 HB3 TYR B 98 -10.998 0.927 5.725 1.00 10.00 H new ATOM 0 HD1 TYR B 98 -9.775 3.289 6.711 1.00 10.00 H new ATOM 0 HD2 TYR B 98 -8.935 1.209 3.038 1.00 10.00 H new ATOM 0 HE1 TYR B 98 -8.921 5.394 5.717 1.00 10.00 H new ATOM 0 HE2 TYR B 98 -8.241 3.355 1.967 1.00 10.00 H new ATOM 0 HH TYR B 98 -7.185 5.695 3.076 1.00 10.00 H new ATOM 1542 N VAL B 99 -10.479 -1.709 7.224 1.00 10.00 N ATOM 1543 CA VAL B 99 -11.467 -2.558 7.919 1.00 10.00 C ATOM 1544 C VAL B 99 -11.076 -2.933 9.355 1.00 10.00 C ATOM 1545 O VAL B 99 -11.966 -3.168 10.164 1.00 10.00 O ATOM 1546 CB VAL B 99 -11.850 -3.822 7.121 1.00 10.00 C ATOM 1547 CG1 VAL B 99 -12.388 -3.504 5.715 1.00 10.00 C ATOM 1548 CG2 VAL B 99 -10.695 -4.824 7.002 1.00 10.00 C ATOM 0 H VAL B 99 -10.116 -2.109 6.359 1.00 10.00 H new ATOM 0 HA VAL B 99 -12.349 -1.921 7.987 1.00 10.00 H new ATOM 0 HB VAL B 99 -12.650 -4.279 7.703 1.00 10.00 H new ATOM 0 HG11 VAL B 99 -12.640 -4.433 5.203 1.00 10.00 H new ATOM 0 HG12 VAL B 99 -13.279 -2.882 5.799 1.00 10.00 H new ATOM 0 HG13 VAL B 99 -11.626 -2.971 5.146 1.00 10.00 H new ATOM 0 HG21 VAL B 99 -11.024 -5.692 6.431 1.00 10.00 H new ATOM 0 HG22 VAL B 99 -9.855 -4.352 6.493 1.00 10.00 H new ATOM 0 HG23 VAL B 99 -10.384 -5.141 7.998 1.00 10.00 H new