USER MOD reduce.3.24.130724 H: found=0, std=0, add=1088, rem=0, adj=34 USER MOD reduce.3.24.130724 removed 1088 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 81 ASN : amide:sc= -0.0804 K(o=1,f=-8.1!) USER MOD Set 1.2: A 110 TYR OH : rot 180:sc= 0 USER MOD Set 1.3: A 123 LYS NZ :NH3+ -172:sc= 1.11 (180deg=0.000844) USER MOD Set 2.1: A 97 ASN : amide:sc= -0.0663 K(o=-0.038,f=-1.5) USER MOD Set 2.2: A 101 LYS NZ :NH3+ -164:sc= 0.0285 (180deg=0) USER MOD Set 3.1: A 91 CYS SG : rot 180:sc= 0.355 USER MOD Set 3.2: A 93 SER OG : rot -79:sc= 0.415 USER MOD Set 4.1: A 6 CYS SG : rot 179:sc= -0.835 USER MOD Set 4.2: A 48 TYR OH : rot 180:sc= 0 USER MOD Set 5.1: A 21 ASN : amide:sc= -0.226 K(o=0.83,f=-0.58) USER MOD Set 5.2: A 25 ASN : amide:sc= 1.05 K(o=0.83,f=-0.096) USER MOD Set 6.1: A 5 LYS NZ :NH3+ 133:sc= 0.555 (180deg=0) USER MOD Set 6.2: A 149 GLN : amide:sc= -1.23 K(o=-0.68,f=-15!) USER MOD Single : A 4 GLN : amide:sc= -0.287 K(o=-0.29,f=-2.5!) USER MOD Single : A 9 GLN : amide:sc= -2.48! C(o=-2.5!,f=-3.6!) USER MOD Single : A 11 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 13 MET CE :methyl -167:sc= -0.0236 (180deg=-0.185) USER MOD Single : A 14 THR OG1 : rot 180:sc= 0.154 USER MOD Single : A 15 CYS SG : rot 180:sc= 0 USER MOD Single : A 17 SER OG : rot 22:sc= 1.03 USER MOD Single : A 18 CYS SG : rot 180:sc= 0 USER MOD Single : A 20 SER OG : rot 180:sc= 0 USER MOD Single : A 27 GLN : amide:sc= -0.101 X(o=-0.1,f=0) USER MOD Single : A 28 LYS NZ :NH3+ 157:sc= -0.0207 (180deg=-0.787) USER MOD Single : A 34 SER OG : rot 170:sc= 0 USER MOD Single : A 40 MET CE :methyl 174:sc= 0 (180deg=-0.0377) USER MOD Single : A 43 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 47 LYS NZ :NH3+ -163:sc= 1.17 (180deg=0.918) USER MOD Single : A 54 GLN : amide:sc= -0.0689 X(o=-0.069,f=-0.069) USER MOD Single : A 60 GLN : amide:sc= -0.243 X(o=-0.24,f=-0.015) USER MOD Single : A 63 GLN : amide:sc= 0.668 K(o=0.67,f=-1.6!) USER MOD Single : A 72 MET CE :methyl 159:sc= -0.214 (180deg=-0.22) USER MOD Single : A 85 THR OG1 : rot -6:sc= 1.06 USER MOD Single : A 87 THR OG1 : rot 180:sc= 0.0227 USER MOD Single : A 89 MET CE :methyl -166:sc= 0 (180deg=-0.135) USER MOD Single : A 90 THR OG1 : rot -45:sc= 0.852 USER MOD Single : A 94 CYS SG : rot -112:sc= 0.0363 USER MOD Single : A 96 HIS : no HD1:sc= -0.0395 X(o=-0.04,f=0) USER MOD Single : A 100 SER OG : rot 180:sc= 0 USER MOD Single : A 103 THR OG1 : rot -77:sc= 1.24 USER MOD Single : A 105 THR OG1 : rot -82:sc= 0.379 USER MOD Single : A 106 ASN :FLIP amide:sc= -0.132 F(o=-0.65,f=-0.13) USER MOD Single : A 109 THR OG1 : rot 180:sc= 0 USER MOD Single : A 112 SER OG : rot 180:sc= 0 USER MOD Single : A 117 THR OG1 : rot 30:sc= 0.0452 USER MOD Single : A 118 SER OG : rot -39:sc= 0.411 USER MOD Single : A 119 LYS NZ :NH3+ -157:sc= 1.13 (180deg=0.887) USER MOD Single : A 136 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 144 HIS : no HD1:sc=-0.00486 X(o=-0.0049,f=-0.032) USER MOD Single : A 146 SER OG : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 44 N GLN A 4 -9.313 -4.026 6.795 1.00 2.91 N ATOM 45 CA GLN A 4 -7.988 -3.641 6.340 1.00 2.73 C ATOM 46 C GLN A 4 -7.831 -2.163 6.671 1.00 2.60 C ATOM 47 O GLN A 4 -8.832 -1.483 6.881 1.00 2.88 O ATOM 48 CB GLN A 4 -7.821 -3.929 4.836 1.00 2.73 C ATOM 49 CG GLN A 4 -6.970 -5.175 4.530 1.00 2.93 C ATOM 50 CD GLN A 4 -7.789 -6.378 4.071 1.00 2.63 C ATOM 51 OE1 GLN A 4 -7.725 -6.758 2.910 1.00 2.86 O ATOM 52 NE2 GLN A 4 -8.546 -7.012 4.957 1.00 3.29 N ATOM 0 HA GLN A 4 -7.208 -4.218 6.836 1.00 2.73 H new ATOM 0 HB2 GLN A 4 -8.807 -4.056 4.389 1.00 2.73 H new ATOM 0 HB3 GLN A 4 -7.363 -3.062 4.359 1.00 2.73 H new ATOM 0 HG2 GLN A 4 -6.242 -4.926 3.758 1.00 2.93 H new ATOM 0 HG3 GLN A 4 -6.408 -5.448 5.423 1.00 2.93 H new ATOM 0 HE21 GLN A 4 -8.588 -6.682 5.921 1.00 3.29 H new ATOM 0 HE22 GLN A 4 -9.086 -7.830 4.674 1.00 3.29 H new ATOM 61 N LYS A 5 -6.587 -1.682 6.763 1.00 2.28 N ATOM 62 CA LYS A 5 -6.264 -0.285 6.993 1.00 2.10 C ATOM 63 C LYS A 5 -5.375 0.224 5.870 1.00 2.04 C ATOM 64 O LYS A 5 -4.641 -0.559 5.269 1.00 2.22 O ATOM 65 CB LYS A 5 -5.612 -0.074 8.367 1.00 2.27 C ATOM 66 CG LYS A 5 -4.382 -0.957 8.621 1.00 2.36 C ATOM 67 CD LYS A 5 -3.498 -0.259 9.666 1.00 2.68 C ATOM 68 CE LYS A 5 -2.401 -1.144 10.280 1.00 3.22 C ATOM 69 NZ LYS A 5 -1.496 -1.750 9.281 1.00 3.51 N ATOM 0 H LYS A 5 -5.762 -2.275 6.676 1.00 2.28 H new ATOM 0 HA LYS A 5 -7.189 0.291 6.996 1.00 2.10 H new ATOM 0 HB2 LYS A 5 -5.320 0.972 8.462 1.00 2.27 H new ATOM 0 HB3 LYS A 5 -6.353 -0.270 9.142 1.00 2.27 H new ATOM 0 HG2 LYS A 5 -4.687 -1.941 8.977 1.00 2.36 H new ATOM 0 HG3 LYS A 5 -3.827 -1.111 7.696 1.00 2.36 H new ATOM 0 HD2 LYS A 5 -3.028 0.608 9.202 1.00 2.68 H new ATOM 0 HD3 LYS A 5 -4.135 0.115 10.468 1.00 2.68 H new ATOM 0 HE2 LYS A 5 -1.812 -0.546 10.975 1.00 3.22 H new ATOM 0 HE3 LYS A 5 -2.870 -1.938 10.861 1.00 3.22 H new ATOM 0 HZ1 LYS A 5 -0.509 -1.623 9.584 1.00 3.51 H new ATOM 0 HZ2 LYS A 5 -1.704 -2.765 9.195 1.00 3.51 H new ATOM 0 HZ3 LYS A 5 -1.637 -1.289 8.360 1.00 3.51 H new ATOM 83 N CYS A 6 -5.448 1.527 5.594 1.00 1.85 N ATOM 84 CA CYS A 6 -4.625 2.168 4.584 1.00 1.78 C ATOM 85 C CYS A 6 -4.193 3.536 5.099 1.00 1.59 C ATOM 86 O CYS A 6 -5.023 4.301 5.592 1.00 1.42 O ATOM 87 CB CYS A 6 -5.411 2.249 3.281 1.00 1.71 C ATOM 88 SG CYS A 6 -4.471 3.101 1.999 1.00 2.07 S ATOM 0 H CYS A 6 -6.085 2.165 6.071 1.00 1.85 H new ATOM 0 HA CYS A 6 -3.722 1.592 4.382 1.00 1.78 H new ATOM 0 HB2 CYS A 6 -5.663 1.244 2.943 1.00 1.71 H new ATOM 0 HB3 CYS A 6 -6.352 2.772 3.453 1.00 1.71 H new ATOM 0 HG CYS A 6 -5.166 3.133 0.901 1.00 2.07 H new ATOM 94 N PHE A 7 -2.882 3.779 5.047 1.00 1.72 N ATOM 95 CA PHE A 7 -2.200 4.927 5.631 1.00 1.66 C ATOM 96 C PHE A 7 -1.908 5.942 4.536 1.00 1.54 C ATOM 97 O PHE A 7 -0.914 5.805 3.818 1.00 1.65 O ATOM 98 CB PHE A 7 -0.884 4.480 6.296 1.00 1.90 C ATOM 99 CG PHE A 7 -1.000 4.248 7.787 1.00 2.21 C ATOM 100 CD1 PHE A 7 -0.939 5.351 8.658 1.00 3.28 C ATOM 101 CD2 PHE A 7 -1.120 2.947 8.309 1.00 2.77 C ATOM 102 CE1 PHE A 7 -1.047 5.162 10.045 1.00 3.73 C ATOM 103 CE2 PHE A 7 -1.196 2.758 9.701 1.00 3.05 C ATOM 104 CZ PHE A 7 -1.191 3.865 10.565 1.00 3.12 C ATOM 0 H PHE A 7 -2.238 3.146 4.572 1.00 1.72 H new ATOM 0 HA PHE A 7 -2.837 5.380 6.390 1.00 1.66 H new ATOM 0 HB2 PHE A 7 -0.542 3.561 5.820 1.00 1.90 H new ATOM 0 HB3 PHE A 7 -0.121 5.237 6.114 1.00 1.90 H new ATOM 0 HD1 PHE A 7 -0.809 6.346 8.259 1.00 3.28 H new ATOM 0 HD2 PHE A 7 -1.154 2.097 7.644 1.00 2.77 H new ATOM 0 HE1 PHE A 7 -1.019 6.012 10.711 1.00 3.73 H new ATOM 0 HE2 PHE A 7 -1.258 1.759 10.106 1.00 3.05 H new ATOM 0 HZ PHE A 7 -1.298 3.719 11.630 1.00 3.12 H new ATOM 114 N LEU A 8 -2.744 6.974 4.411 1.00 1.34 N ATOM 115 CA LEU A 8 -2.499 8.030 3.451 1.00 1.24 C ATOM 116 C LEU A 8 -2.487 9.406 4.095 1.00 1.08 C ATOM 117 O LEU A 8 -2.639 9.559 5.305 1.00 1.09 O ATOM 118 CB LEU A 8 -3.362 7.868 2.182 1.00 1.21 C ATOM 119 CG LEU A 8 -4.886 7.848 2.246 1.00 1.32 C ATOM 120 CD1 LEU A 8 -5.373 7.883 0.791 1.00 1.85 C ATOM 121 CD2 LEU A 8 -5.396 6.546 2.868 1.00 2.16 C ATOM 0 H LEU A 8 -3.592 7.093 4.965 1.00 1.34 H new ATOM 0 HA LEU A 8 -1.480 7.929 3.077 1.00 1.24 H new ATOM 0 HB2 LEU A 8 -3.085 8.677 1.506 1.00 1.21 H new ATOM 0 HB3 LEU A 8 -3.054 6.937 1.707 1.00 1.21 H new ATOM 0 HG LEU A 8 -5.244 8.685 2.845 1.00 1.32 H new ATOM 0 HD11 LEU A 8 -6.463 7.870 0.772 1.00 1.85 H new ATOM 0 HD12 LEU A 8 -5.012 8.791 0.308 1.00 1.85 H new ATOM 0 HD13 LEU A 8 -4.991 7.012 0.258 1.00 1.85 H new ATOM 0 HD21 LEU A 8 -6.485 6.561 2.900 1.00 2.16 H new ATOM 0 HD22 LEU A 8 -5.062 5.700 2.267 1.00 2.16 H new ATOM 0 HD23 LEU A 8 -5.004 6.449 3.880 1.00 2.16 H new ATOM 133 N GLN A 9 -2.197 10.415 3.284 1.00 0.98 N ATOM 134 CA GLN A 9 -2.201 11.797 3.691 1.00 0.85 C ATOM 135 C GLN A 9 -2.890 12.587 2.591 1.00 0.71 C ATOM 136 O GLN A 9 -2.857 12.213 1.415 1.00 0.87 O ATOM 137 CB GLN A 9 -0.792 12.283 4.083 1.00 1.06 C ATOM 138 CG GLN A 9 0.397 11.866 3.198 1.00 1.53 C ATOM 139 CD GLN A 9 0.612 12.805 2.019 1.00 1.26 C ATOM 140 OE1 GLN A 9 1.506 13.645 2.018 1.00 1.79 O ATOM 141 NE2 GLN A 9 -0.211 12.685 0.992 1.00 1.27 N ATOM 0 H GLN A 9 -1.948 10.283 2.304 1.00 0.98 H new ATOM 0 HA GLN A 9 -2.767 11.948 4.610 1.00 0.85 H new ATOM 0 HB2 GLN A 9 -0.814 13.372 4.118 1.00 1.06 H new ATOM 0 HB3 GLN A 9 -0.590 11.935 5.096 1.00 1.06 H new ATOM 0 HG2 GLN A 9 1.303 11.837 3.804 1.00 1.53 H new ATOM 0 HG3 GLN A 9 0.230 10.855 2.826 1.00 1.53 H new ATOM 0 HE21 GLN A 9 -0.949 11.981 1.009 1.00 1.27 H new ATOM 0 HE22 GLN A 9 -0.108 13.296 0.182 1.00 1.27 H new ATOM 150 N ILE A 10 -3.580 13.641 3.010 1.00 0.59 N ATOM 151 CA ILE A 10 -4.311 14.521 2.144 1.00 0.63 C ATOM 152 C ILE A 10 -3.420 15.735 1.919 1.00 0.72 C ATOM 153 O ILE A 10 -2.767 16.186 2.860 1.00 0.81 O ATOM 154 CB ILE A 10 -5.623 14.900 2.840 1.00 0.67 C ATOM 155 CG1 ILE A 10 -6.481 13.672 3.187 1.00 0.65 C ATOM 156 CG2 ILE A 10 -6.418 15.899 2.009 1.00 0.84 C ATOM 157 CD1 ILE A 10 -6.779 12.730 2.015 1.00 0.70 C ATOM 0 H ILE A 10 -3.640 13.904 3.994 1.00 0.59 H new ATOM 0 HA ILE A 10 -4.562 14.067 1.186 1.00 0.63 H new ATOM 0 HB ILE A 10 -5.350 15.375 3.782 1.00 0.67 H new ATOM 0 HG12 ILE A 10 -5.975 13.105 3.968 1.00 0.65 H new ATOM 0 HG13 ILE A 10 -7.427 14.016 3.605 1.00 0.65 H new ATOM 0 HG21 ILE A 10 -7.343 16.149 2.528 1.00 0.84 H new ATOM 0 HG22 ILE A 10 -5.827 16.804 1.864 1.00 0.84 H new ATOM 0 HG23 ILE A 10 -6.653 15.460 1.039 1.00 0.84 H new ATOM 0 HD11 ILE A 10 -7.389 11.897 2.364 1.00 0.70 H new ATOM 0 HD12 ILE A 10 -7.317 13.274 1.239 1.00 0.70 H new ATOM 0 HD13 ILE A 10 -5.843 12.348 1.608 1.00 0.70 H new ATOM 169 N LYS A 11 -3.381 16.261 0.697 1.00 0.77 N ATOM 170 CA LYS A 11 -2.656 17.488 0.397 1.00 0.96 C ATOM 171 C LYS A 11 -3.669 18.552 -0.031 1.00 1.02 C ATOM 172 O LYS A 11 -3.819 18.841 -1.214 1.00 1.45 O ATOM 173 CB LYS A 11 -1.562 17.212 -0.646 1.00 1.16 C ATOM 174 CG LYS A 11 -0.414 16.359 -0.094 1.00 1.26 C ATOM 175 CD LYS A 11 0.501 15.987 -1.271 1.00 2.10 C ATOM 176 CE LYS A 11 1.852 15.422 -0.808 1.00 2.64 C ATOM 177 NZ LYS A 11 2.898 15.616 -1.835 1.00 3.13 N ATOM 0 H LYS A 11 -3.850 15.848 -0.109 1.00 0.77 H new ATOM 0 HA LYS A 11 -2.134 17.869 1.275 1.00 0.96 H new ATOM 0 HB2 LYS A 11 -2.004 16.706 -1.504 1.00 1.16 H new ATOM 0 HB3 LYS A 11 -1.163 18.160 -1.006 1.00 1.16 H new ATOM 0 HG2 LYS A 11 0.143 16.911 0.663 1.00 1.26 H new ATOM 0 HG3 LYS A 11 -0.802 15.461 0.387 1.00 1.26 H new ATOM 0 HD2 LYS A 11 -0.001 15.251 -1.899 1.00 2.10 H new ATOM 0 HD3 LYS A 11 0.672 16.869 -1.888 1.00 2.10 H new ATOM 0 HE2 LYS A 11 2.154 15.911 0.118 1.00 2.64 H new ATOM 0 HE3 LYS A 11 1.748 14.359 -0.589 1.00 2.64 H new ATOM 0 HZ1 LYS A 11 3.798 15.224 -1.492 1.00 3.13 H new ATOM 0 HZ2 LYS A 11 2.619 15.129 -2.711 1.00 3.13 H new ATOM 0 HZ3 LYS A 11 3.013 16.632 -2.026 1.00 3.13 H new ATOM 191 N GLY A 12 -4.382 19.124 0.942 1.00 1.04 N ATOM 192 CA GLY A 12 -5.334 20.199 0.696 1.00 1.08 C ATOM 193 C GLY A 12 -5.819 20.778 2.021 1.00 1.08 C ATOM 194 O GLY A 12 -5.458 21.896 2.376 1.00 1.23 O ATOM 0 H GLY A 12 -4.312 18.851 1.922 1.00 1.04 H new ATOM 0 HA2 GLY A 12 -4.866 20.981 0.097 1.00 1.08 H new ATOM 0 HA3 GLY A 12 -6.181 19.822 0.122 1.00 1.08 H new ATOM 198 N MET A 13 -6.614 19.990 2.753 1.00 1.07 N ATOM 199 CA MET A 13 -7.137 20.274 4.087 1.00 1.13 C ATOM 200 C MET A 13 -7.394 21.757 4.399 1.00 1.16 C ATOM 201 O MET A 13 -6.745 22.348 5.257 1.00 1.30 O ATOM 202 CB MET A 13 -6.313 19.564 5.169 1.00 1.44 C ATOM 203 CG MET A 13 -4.844 20.013 5.236 1.00 1.44 C ATOM 204 SD MET A 13 -3.625 18.860 4.557 1.00 2.54 S ATOM 205 CE MET A 13 -3.747 17.528 5.773 1.00 1.61 C ATOM 0 H MET A 13 -6.926 19.083 2.406 1.00 1.07 H new ATOM 0 HA MET A 13 -8.141 19.850 4.094 1.00 1.13 H new ATOM 0 HB2 MET A 13 -6.779 19.738 6.139 1.00 1.44 H new ATOM 0 HB3 MET A 13 -6.345 18.490 4.988 1.00 1.44 H new ATOM 0 HG2 MET A 13 -4.751 20.961 4.707 1.00 1.44 H new ATOM 0 HG3 MET A 13 -4.591 20.204 6.279 1.00 1.44 H new ATOM 0 HE1 MET A 13 -2.910 16.841 5.646 1.00 1.61 H new ATOM 0 HE2 MET A 13 -3.721 17.949 6.778 1.00 1.61 H new ATOM 0 HE3 MET A 13 -4.683 16.989 5.629 1.00 1.61 H new ATOM 215 N THR A 14 -8.439 22.322 3.789 1.00 1.33 N ATOM 216 CA THR A 14 -8.948 23.666 4.047 1.00 1.49 C ATOM 217 C THR A 14 -9.249 23.949 5.530 1.00 1.31 C ATOM 218 O THR A 14 -9.460 25.102 5.901 1.00 1.43 O ATOM 219 CB THR A 14 -10.229 23.823 3.213 1.00 1.89 C ATOM 220 OG1 THR A 14 -10.065 23.133 1.989 1.00 2.41 O ATOM 221 CG2 THR A 14 -10.608 25.280 2.938 1.00 2.26 C ATOM 0 H THR A 14 -8.974 21.832 3.072 1.00 1.33 H new ATOM 0 HA THR A 14 -8.177 24.385 3.771 1.00 1.49 H new ATOM 0 HB THR A 14 -11.046 23.401 3.798 1.00 1.89 H new ATOM 0 HG1 THR A 14 -10.878 23.226 1.450 1.00 2.41 H new ATOM 0 HG21 THR A 14 -11.522 25.312 2.345 1.00 2.26 H new ATOM 0 HG22 THR A 14 -10.770 25.798 3.883 1.00 2.26 H new ATOM 0 HG23 THR A 14 -9.802 25.768 2.390 1.00 2.26 H new ATOM 229 N CYS A 15 -9.356 22.911 6.366 1.00 1.43 N ATOM 230 CA CYS A 15 -9.678 22.977 7.788 1.00 1.69 C ATOM 231 C CYS A 15 -11.156 23.271 8.020 1.00 1.50 C ATOM 232 O CYS A 15 -11.817 22.481 8.686 1.00 1.74 O ATOM 233 CB CYS A 15 -8.780 23.939 8.574 1.00 2.61 C ATOM 234 SG CYS A 15 -9.064 23.632 10.336 1.00 3.36 S ATOM 0 H CYS A 15 -9.212 21.953 6.048 1.00 1.43 H new ATOM 0 HA CYS A 15 -9.469 21.983 8.185 1.00 1.69 H new ATOM 0 HB2 CYS A 15 -7.732 23.778 8.321 1.00 2.61 H new ATOM 0 HB3 CYS A 15 -9.014 24.974 8.323 1.00 2.61 H new ATOM 0 HG CYS A 15 -8.317 24.429 11.041 1.00 3.36 H new ATOM 240 N ALA A 16 -11.651 24.386 7.463 1.00 2.59 N ATOM 241 CA ALA A 16 -13.006 24.927 7.601 1.00 4.04 C ATOM 242 C ALA A 16 -14.037 23.862 7.988 1.00 3.53 C ATOM 243 O ALA A 16 -14.451 23.797 9.141 1.00 3.60 O ATOM 244 CB ALA A 16 -13.391 25.663 6.312 1.00 5.69 C ATOM 0 H ALA A 16 -11.072 24.973 6.862 1.00 2.59 H new ATOM 0 HA ALA A 16 -13.007 25.636 8.429 1.00 4.04 H new ATOM 0 HB1 ALA A 16 -14.399 26.067 6.411 1.00 5.69 H new ATOM 0 HB2 ALA A 16 -12.689 26.478 6.135 1.00 5.69 H new ATOM 0 HB3 ALA A 16 -13.359 24.968 5.473 1.00 5.69 H new ATOM 250 N SER A 17 -14.433 23.016 7.032 1.00 3.05 N ATOM 251 CA SER A 17 -15.113 21.748 7.297 1.00 2.31 C ATOM 252 C SER A 17 -14.893 20.742 6.159 1.00 1.85 C ATOM 253 O SER A 17 -15.635 19.764 6.055 1.00 1.82 O ATOM 254 CB SER A 17 -16.619 21.983 7.516 1.00 2.56 C ATOM 255 OG SER A 17 -16.880 22.619 8.752 1.00 2.26 O ATOM 0 H SER A 17 -14.287 23.197 6.039 1.00 3.05 H new ATOM 0 HA SER A 17 -14.683 21.325 8.205 1.00 2.31 H new ATOM 0 HB2 SER A 17 -17.013 22.593 6.703 1.00 2.56 H new ATOM 0 HB3 SER A 17 -17.144 21.028 7.481 1.00 2.56 H new ATOM 0 HG SER A 17 -16.076 23.090 9.054 1.00 2.26 H new ATOM 261 N CYS A 18 -13.891 20.945 5.292 1.00 1.57 N ATOM 262 CA CYS A 18 -13.773 20.106 4.105 1.00 1.38 C ATOM 263 C CYS A 18 -13.390 18.692 4.515 1.00 1.00 C ATOM 264 O CYS A 18 -14.084 17.758 4.134 1.00 0.94 O ATOM 265 CB CYS A 18 -12.794 20.666 3.069 1.00 1.47 C ATOM 266 SG CYS A 18 -13.673 21.578 1.779 1.00 1.85 S ATOM 0 H CYS A 18 -13.173 21.663 5.390 1.00 1.57 H new ATOM 0 HA CYS A 18 -14.747 20.092 3.616 1.00 1.38 H new ATOM 0 HB2 CYS A 18 -12.076 21.323 3.559 1.00 1.47 H new ATOM 0 HB3 CYS A 18 -12.226 19.850 2.621 1.00 1.47 H new ATOM 0 HG CYS A 18 -12.818 22.043 0.917 1.00 1.85 H new ATOM 272 N VAL A 19 -12.331 18.525 5.317 1.00 0.88 N ATOM 273 CA VAL A 19 -11.928 17.212 5.811 1.00 0.80 C ATOM 274 C VAL A 19 -13.129 16.510 6.448 1.00 0.90 C ATOM 275 O VAL A 19 -13.419 15.365 6.124 1.00 0.91 O ATOM 276 CB VAL A 19 -10.759 17.363 6.796 1.00 1.01 C ATOM 277 CG1 VAL A 19 -10.420 16.040 7.495 1.00 1.48 C ATOM 278 CG2 VAL A 19 -9.513 17.853 6.048 1.00 1.36 C ATOM 0 H VAL A 19 -11.738 19.291 5.636 1.00 0.88 H new ATOM 0 HA VAL A 19 -11.583 16.592 4.984 1.00 0.80 H new ATOM 0 HB VAL A 19 -11.065 18.084 7.554 1.00 1.01 H new ATOM 0 HG11 VAL A 19 -9.588 16.194 8.182 1.00 1.48 H new ATOM 0 HG12 VAL A 19 -11.289 15.689 8.051 1.00 1.48 H new ATOM 0 HG13 VAL A 19 -10.142 15.295 6.749 1.00 1.48 H new ATOM 0 HG21 VAL A 19 -8.686 17.959 6.750 1.00 1.36 H new ATOM 0 HG22 VAL A 19 -9.244 17.131 5.277 1.00 1.36 H new ATOM 0 HG23 VAL A 19 -9.722 18.817 5.585 1.00 1.36 H new ATOM 288 N SER A 20 -13.851 17.226 7.310 1.00 1.06 N ATOM 289 CA SER A 20 -15.018 16.688 8.007 1.00 1.24 C ATOM 290 C SER A 20 -16.058 16.171 7.001 1.00 1.17 C ATOM 291 O SER A 20 -16.535 15.036 7.091 1.00 1.21 O ATOM 292 CB SER A 20 -15.594 17.767 8.937 1.00 1.59 C ATOM 293 OG SER A 20 -16.672 17.259 9.697 1.00 2.87 O ATOM 0 H SER A 20 -13.642 18.197 7.545 1.00 1.06 H new ATOM 0 HA SER A 20 -14.723 15.835 8.619 1.00 1.24 H new ATOM 0 HB2 SER A 20 -14.813 18.131 9.605 1.00 1.59 H new ATOM 0 HB3 SER A 20 -15.931 18.619 8.346 1.00 1.59 H new ATOM 0 HG SER A 20 -17.020 17.964 10.282 1.00 2.87 H new ATOM 299 N ASN A 21 -16.394 16.995 6.004 1.00 1.14 N ATOM 300 CA ASN A 21 -17.325 16.601 4.961 1.00 1.16 C ATOM 301 C ASN A 21 -16.792 15.365 4.235 1.00 0.96 C ATOM 302 O ASN A 21 -17.502 14.371 4.106 1.00 0.89 O ATOM 303 CB ASN A 21 -17.559 17.781 4.012 1.00 1.30 C ATOM 304 CG ASN A 21 -18.232 17.322 2.727 1.00 1.54 C ATOM 305 OD1 ASN A 21 -19.450 17.182 2.660 1.00 2.64 O ATOM 306 ND2 ASN A 21 -17.435 17.049 1.700 1.00 1.37 N ATOM 0 H ASN A 21 -16.029 17.942 5.904 1.00 1.14 H new ATOM 0 HA ASN A 21 -18.289 16.332 5.394 1.00 1.16 H new ATOM 0 HB2 ASN A 21 -18.179 18.530 4.504 1.00 1.30 H new ATOM 0 HB3 ASN A 21 -16.607 18.258 3.778 1.00 1.30 H new ATOM 0 HD21 ASN A 21 -17.831 16.712 0.823 1.00 1.37 H new ATOM 0 HD22 ASN A 21 -16.427 17.176 1.789 1.00 1.37 H new ATOM 313 N ILE A 22 -15.543 15.423 3.778 1.00 0.91 N ATOM 314 CA ILE A 22 -14.849 14.347 3.087 1.00 0.85 C ATOM 315 C ILE A 22 -14.939 13.041 3.882 1.00 0.80 C ATOM 316 O ILE A 22 -15.297 12.019 3.308 1.00 0.78 O ATOM 317 CB ILE A 22 -13.411 14.800 2.767 1.00 0.95 C ATOM 318 CG1 ILE A 22 -13.394 15.599 1.448 1.00 1.20 C ATOM 319 CG2 ILE A 22 -12.414 13.637 2.653 1.00 1.15 C ATOM 320 CD1 ILE A 22 -12.476 16.816 1.507 1.00 1.45 C ATOM 0 H ILE A 22 -14.966 16.257 3.885 1.00 0.91 H new ATOM 0 HA ILE A 22 -15.330 14.128 2.134 1.00 0.85 H new ATOM 0 HB ILE A 22 -13.094 15.419 3.606 1.00 0.95 H new ATOM 0 HG12 ILE A 22 -13.072 14.946 0.637 1.00 1.20 H new ATOM 0 HG13 ILE A 22 -14.407 15.925 1.212 1.00 1.20 H new ATOM 0 HG21 ILE A 22 -11.422 14.029 2.427 1.00 1.15 H new ATOM 0 HG22 ILE A 22 -12.382 13.091 3.596 1.00 1.15 H new ATOM 0 HG23 ILE A 22 -12.729 12.964 1.855 1.00 1.15 H new ATOM 0 HD11 ILE A 22 -12.504 17.340 0.551 1.00 1.45 H new ATOM 0 HD12 ILE A 22 -12.811 17.487 2.298 1.00 1.45 H new ATOM 0 HD13 ILE A 22 -11.456 16.493 1.714 1.00 1.45 H new ATOM 332 N GLU A 23 -14.669 13.062 5.188 1.00 0.89 N ATOM 333 CA GLU A 23 -14.830 11.902 6.051 1.00 1.00 C ATOM 334 C GLU A 23 -16.263 11.356 5.956 1.00 0.93 C ATOM 335 O GLU A 23 -16.477 10.174 5.676 1.00 0.91 O ATOM 336 CB GLU A 23 -14.437 12.279 7.492 1.00 1.31 C ATOM 337 CG GLU A 23 -12.910 12.388 7.649 1.00 2.37 C ATOM 338 CD GLU A 23 -12.499 12.682 9.089 1.00 3.31 C ATOM 339 OE1 GLU A 23 -13.048 13.661 9.638 1.00 4.05 O ATOM 340 OE2 GLU A 23 -11.648 11.925 9.609 1.00 4.06 O ATOM 0 H GLU A 23 -14.331 13.892 5.675 1.00 0.89 H new ATOM 0 HA GLU A 23 -14.168 11.100 5.724 1.00 1.00 H new ATOM 0 HB2 GLU A 23 -14.900 13.229 7.760 1.00 1.31 H new ATOM 0 HB3 GLU A 23 -14.823 11.530 8.183 1.00 1.31 H new ATOM 0 HG2 GLU A 23 -12.445 11.457 7.323 1.00 2.37 H new ATOM 0 HG3 GLU A 23 -12.535 13.177 6.997 1.00 2.37 H new ATOM 347 N ARG A 24 -17.264 12.213 6.165 1.00 0.98 N ATOM 348 CA ARG A 24 -18.658 11.779 6.174 1.00 1.05 C ATOM 349 C ARG A 24 -19.098 11.280 4.794 1.00 0.97 C ATOM 350 O ARG A 24 -19.944 10.389 4.700 1.00 1.14 O ATOM 351 CB ARG A 24 -19.563 12.910 6.680 1.00 1.23 C ATOM 352 CG ARG A 24 -19.305 13.245 8.157 1.00 1.92 C ATOM 353 CD ARG A 24 -19.857 12.202 9.143 1.00 2.46 C ATOM 354 NE ARG A 24 -21.330 12.217 9.197 1.00 2.59 N ATOM 355 CZ ARG A 24 -22.172 11.300 8.690 1.00 3.53 C ATOM 356 NH1 ARG A 24 -21.713 10.281 7.953 1.00 4.45 N ATOM 357 NH2 ARG A 24 -23.486 11.414 8.923 1.00 4.47 N ATOM 0 H ARG A 24 -17.133 13.211 6.330 1.00 0.98 H new ATOM 0 HA ARG A 24 -18.750 10.937 6.860 1.00 1.05 H new ATOM 0 HB2 ARG A 24 -19.401 13.801 6.074 1.00 1.23 H new ATOM 0 HB3 ARG A 24 -20.607 12.623 6.552 1.00 1.23 H new ATOM 0 HG2 ARG A 24 -18.231 13.345 8.314 1.00 1.92 H new ATOM 0 HG3 ARG A 24 -19.751 14.214 8.382 1.00 1.92 H new ATOM 0 HD2 ARG A 24 -19.515 11.209 8.849 1.00 2.46 H new ATOM 0 HD3 ARG A 24 -19.456 12.396 10.138 1.00 2.46 H new ATOM 0 HE ARG A 24 -21.758 13.012 9.672 1.00 2.59 H new ATOM 0 HH11 ARG A 24 -20.713 10.193 7.770 1.00 4.45 H new ATOM 0 HH12 ARG A 24 -22.363 9.592 7.574 1.00 4.45 H new ATOM 0 HH21 ARG A 24 -23.839 12.191 9.481 1.00 4.47 H new ATOM 0 HH22 ARG A 24 -24.133 10.723 8.543 1.00 4.47 H new ATOM 371 N ASN A 25 -18.528 11.852 3.733 1.00 0.80 N ATOM 372 CA ASN A 25 -18.755 11.436 2.358 1.00 0.80 C ATOM 373 C ASN A 25 -18.136 10.060 2.128 1.00 0.79 C ATOM 374 O ASN A 25 -18.823 9.161 1.657 1.00 0.85 O ATOM 375 CB ASN A 25 -18.181 12.467 1.378 1.00 0.81 C ATOM 376 CG ASN A 25 -19.151 13.610 1.101 1.00 0.95 C ATOM 377 OD1 ASN A 25 -19.680 13.737 0.003 1.00 1.19 O ATOM 378 ND2 ASN A 25 -19.389 14.453 2.098 1.00 0.97 N ATOM 0 H ASN A 25 -17.881 12.636 3.813 1.00 0.80 H new ATOM 0 HA ASN A 25 -19.828 11.371 2.179 1.00 0.80 H new ATOM 0 HB2 ASN A 25 -17.253 12.872 1.783 1.00 0.81 H new ATOM 0 HB3 ASN A 25 -17.930 11.972 0.440 1.00 0.81 H new ATOM 0 HD21 ASN A 25 -20.029 15.235 1.962 1.00 0.97 H new ATOM 0 HD22 ASN A 25 -18.932 14.318 3.000 1.00 0.97 H new ATOM 385 N LEU A 26 -16.861 9.883 2.485 1.00 0.77 N ATOM 386 CA LEU A 26 -16.152 8.613 2.381 1.00 0.81 C ATOM 387 C LEU A 26 -16.911 7.515 3.104 1.00 0.86 C ATOM 388 O LEU A 26 -17.037 6.411 2.593 1.00 0.88 O ATOM 389 CB LEU A 26 -14.742 8.710 2.967 1.00 0.90 C ATOM 390 CG LEU A 26 -13.688 9.099 1.926 1.00 0.89 C ATOM 391 CD1 LEU A 26 -12.424 9.418 2.712 1.00 1.90 C ATOM 392 CD2 LEU A 26 -13.369 7.949 0.960 1.00 1.93 C ATOM 0 H LEU A 26 -16.285 10.636 2.861 1.00 0.77 H new ATOM 0 HA LEU A 26 -16.078 8.373 1.320 1.00 0.81 H new ATOM 0 HB2 LEU A 26 -14.739 9.445 3.772 1.00 0.90 H new ATOM 0 HB3 LEU A 26 -14.471 7.751 3.410 1.00 0.90 H new ATOM 0 HG LEU A 26 -14.056 9.934 1.330 1.00 0.89 H new ATOM 0 HD11 LEU A 26 -11.630 9.704 2.023 1.00 1.90 H new ATOM 0 HD12 LEU A 26 -12.621 10.240 3.400 1.00 1.90 H new ATOM 0 HD13 LEU A 26 -12.115 8.538 3.277 1.00 1.90 H new ATOM 0 HD21 LEU A 26 -12.617 8.275 0.242 1.00 1.93 H new ATOM 0 HD22 LEU A 26 -12.988 7.096 1.522 1.00 1.93 H new ATOM 0 HD23 LEU A 26 -14.275 7.658 0.429 1.00 1.93 H new ATOM 404 N GLN A 27 -17.473 7.827 4.270 1.00 0.94 N ATOM 405 CA GLN A 27 -18.307 6.895 5.018 1.00 1.07 C ATOM 406 C GLN A 27 -19.440 6.306 4.171 1.00 0.99 C ATOM 407 O GLN A 27 -20.031 5.298 4.551 1.00 1.14 O ATOM 408 CB GLN A 27 -18.873 7.623 6.242 1.00 1.31 C ATOM 409 CG GLN A 27 -18.764 6.791 7.522 1.00 1.34 C ATOM 410 CD GLN A 27 -18.719 7.722 8.722 1.00 1.90 C ATOM 411 OE1 GLN A 27 -19.659 7.812 9.503 1.00 2.70 O ATOM 412 NE2 GLN A 27 -17.627 8.470 8.831 1.00 1.90 N ATOM 0 H GLN A 27 -17.361 8.735 4.721 1.00 0.94 H new ATOM 0 HA GLN A 27 -17.688 6.052 5.326 1.00 1.07 H new ATOM 0 HB2 GLN A 27 -18.341 8.565 6.378 1.00 1.31 H new ATOM 0 HB3 GLN A 27 -19.919 7.871 6.062 1.00 1.31 H new ATOM 0 HG2 GLN A 27 -19.615 6.114 7.604 1.00 1.34 H new ATOM 0 HG3 GLN A 27 -17.867 6.173 7.493 1.00 1.34 H new ATOM 0 HE21 GLN A 27 -16.867 8.364 8.159 1.00 1.90 H new ATOM 0 HE22 GLN A 27 -17.549 9.151 9.586 1.00 1.90 H new ATOM 421 N LYS A 28 -19.781 6.971 3.063 1.00 0.83 N ATOM 422 CA LYS A 28 -20.774 6.536 2.098 1.00 0.81 C ATOM 423 C LYS A 28 -20.207 6.506 0.667 1.00 0.81 C ATOM 424 O LYS A 28 -20.987 6.594 -0.279 1.00 0.92 O ATOM 425 CB LYS A 28 -21.988 7.468 2.214 1.00 0.90 C ATOM 426 CG LYS A 28 -22.453 7.582 3.678 1.00 0.94 C ATOM 427 CD LYS A 28 -23.918 8.029 3.820 1.00 1.19 C ATOM 428 CE LYS A 28 -24.118 9.551 3.772 1.00 2.60 C ATOM 429 NZ LYS A 28 -23.754 10.138 2.467 1.00 3.88 N ATOM 0 H LYS A 28 -19.351 7.861 2.811 1.00 0.83 H new ATOM 0 HA LYS A 28 -21.076 5.512 2.316 1.00 0.81 H new ATOM 0 HB2 LYS A 28 -21.731 8.456 1.831 1.00 0.90 H new ATOM 0 HB3 LYS A 28 -22.803 7.089 1.597 1.00 0.90 H new ATOM 0 HG2 LYS A 28 -22.326 6.617 4.168 1.00 0.94 H new ATOM 0 HG3 LYS A 28 -21.812 8.292 4.201 1.00 0.94 H new ATOM 0 HD2 LYS A 28 -24.505 7.571 3.024 1.00 1.19 H new ATOM 0 HD3 LYS A 28 -24.312 7.651 4.764 1.00 1.19 H new ATOM 0 HE2 LYS A 28 -25.161 9.782 3.991 1.00 2.60 H new ATOM 0 HE3 LYS A 28 -23.518 10.016 4.554 1.00 2.60 H new ATOM 0 HZ1 LYS A 28 -24.249 11.044 2.344 1.00 3.88 H new ATOM 0 HZ2 LYS A 28 -22.727 10.297 2.432 1.00 3.88 H new ATOM 0 HZ3 LYS A 28 -24.029 9.487 1.704 1.00 3.88 H new ATOM 443 N GLU A 29 -18.883 6.377 0.492 1.00 0.80 N ATOM 444 CA GLU A 29 -18.268 6.122 -0.805 1.00 0.85 C ATOM 445 C GLU A 29 -18.549 4.662 -1.187 1.00 0.86 C ATOM 446 O GLU A 29 -19.504 4.391 -1.914 1.00 0.93 O ATOM 447 CB GLU A 29 -16.783 6.526 -0.732 1.00 1.04 C ATOM 448 CG GLU A 29 -15.910 6.153 -1.943 1.00 1.10 C ATOM 449 CD GLU A 29 -14.946 4.994 -1.689 1.00 1.76 C ATOM 450 OE1 GLU A 29 -15.180 4.243 -0.715 1.00 3.20 O ATOM 451 OE2 GLU A 29 -13.980 4.883 -2.470 1.00 2.40 O ATOM 0 H GLU A 29 -18.211 6.448 1.256 1.00 0.80 H new ATOM 0 HA GLU A 29 -18.688 6.724 -1.611 1.00 0.85 H new ATOM 0 HB2 GLU A 29 -16.730 7.606 -0.592 1.00 1.04 H new ATOM 0 HB3 GLU A 29 -16.348 6.068 0.156 1.00 1.04 H new ATOM 0 HG2 GLU A 29 -16.560 5.893 -2.779 1.00 1.10 H new ATOM 0 HG3 GLU A 29 -15.336 7.029 -2.246 1.00 1.10 H new ATOM 458 N ALA A 30 -17.755 3.718 -0.681 1.00 0.97 N ATOM 459 CA ALA A 30 -17.925 2.293 -0.924 1.00 1.05 C ATOM 460 C ALA A 30 -17.542 1.517 0.341 1.00 1.11 C ATOM 461 O ALA A 30 -17.963 1.887 1.434 1.00 1.28 O ATOM 462 CB ALA A 30 -17.100 1.909 -2.156 1.00 1.20 C ATOM 0 H ALA A 30 -16.960 3.932 -0.079 1.00 0.97 H new ATOM 0 HA ALA A 30 -18.963 2.039 -1.139 1.00 1.05 H new ATOM 0 HB1 ALA A 30 -17.215 0.843 -2.353 1.00 1.20 H new ATOM 0 HB2 ALA A 30 -17.448 2.478 -3.018 1.00 1.20 H new ATOM 0 HB3 ALA A 30 -16.049 2.133 -1.974 1.00 1.20 H new ATOM 468 N GLY A 31 -16.735 0.454 0.239 1.00 1.12 N ATOM 469 CA GLY A 31 -16.421 -0.413 1.368 1.00 1.28 C ATOM 470 C GLY A 31 -15.408 0.188 2.346 1.00 1.19 C ATOM 471 O GLY A 31 -14.638 -0.558 2.942 1.00 1.31 O ATOM 0 H GLY A 31 -16.284 0.175 -0.632 1.00 1.12 H new ATOM 0 HA2 GLY A 31 -17.341 -0.640 1.906 1.00 1.28 H new ATOM 0 HA3 GLY A 31 -16.031 -1.358 0.991 1.00 1.28 H new ATOM 475 N VAL A 32 -15.411 1.511 2.534 1.00 1.28 N ATOM 476 CA VAL A 32 -14.663 2.224 3.557 1.00 1.27 C ATOM 477 C VAL A 32 -15.623 2.649 4.667 1.00 1.29 C ATOM 478 O VAL A 32 -16.574 3.385 4.418 1.00 1.29 O ATOM 479 CB VAL A 32 -13.883 3.388 2.926 1.00 1.21 C ATOM 480 CG1 VAL A 32 -14.777 4.469 2.323 1.00 1.47 C ATOM 481 CG2 VAL A 32 -12.962 4.056 3.954 1.00 1.57 C ATOM 0 H VAL A 32 -15.962 2.137 1.947 1.00 1.28 H new ATOM 0 HA VAL A 32 -13.913 1.580 4.015 1.00 1.27 H new ATOM 0 HB VAL A 32 -13.305 2.935 2.121 1.00 1.21 H new ATOM 0 HG11 VAL A 32 -14.157 5.258 1.896 1.00 1.47 H new ATOM 0 HG12 VAL A 32 -15.398 4.033 1.541 1.00 1.47 H new ATOM 0 HG13 VAL A 32 -15.415 4.889 3.101 1.00 1.47 H new ATOM 0 HG21 VAL A 32 -12.422 4.876 3.480 1.00 1.57 H new ATOM 0 HG22 VAL A 32 -13.559 4.443 4.780 1.00 1.57 H new ATOM 0 HG23 VAL A 32 -12.249 3.324 4.334 1.00 1.57 H new ATOM 491 N LEU A 33 -15.400 2.165 5.895 1.00 1.39 N ATOM 492 CA LEU A 33 -16.267 2.485 7.026 1.00 1.41 C ATOM 493 C LEU A 33 -15.391 2.844 8.216 1.00 1.53 C ATOM 494 O LEU A 33 -15.521 2.291 9.307 1.00 1.61 O ATOM 495 CB LEU A 33 -17.179 1.294 7.373 1.00 1.49 C ATOM 496 CG LEU A 33 -18.040 0.790 6.205 1.00 2.22 C ATOM 497 CD1 LEU A 33 -17.251 -0.118 5.247 1.00 2.66 C ATOM 498 CD2 LEU A 33 -19.235 0.013 6.768 1.00 3.32 C ATOM 0 H LEU A 33 -14.622 1.548 6.127 1.00 1.39 H new ATOM 0 HA LEU A 33 -16.909 3.327 6.766 1.00 1.41 H new ATOM 0 HB2 LEU A 33 -16.561 0.472 7.733 1.00 1.49 H new ATOM 0 HB3 LEU A 33 -17.836 1.582 8.194 1.00 1.49 H new ATOM 0 HG LEU A 33 -18.372 1.658 5.635 1.00 2.22 H new ATOM 0 HD11 LEU A 33 -17.903 -0.448 4.439 1.00 2.66 H new ATOM 0 HD12 LEU A 33 -16.410 0.436 4.831 1.00 2.66 H new ATOM 0 HD13 LEU A 33 -16.880 -0.986 5.791 1.00 2.66 H new ATOM 0 HD21 LEU A 33 -19.853 -0.349 5.947 1.00 3.32 H new ATOM 0 HD22 LEU A 33 -18.876 -0.834 7.353 1.00 3.32 H new ATOM 0 HD23 LEU A 33 -19.828 0.669 7.406 1.00 3.32 H new ATOM 510 N SER A 34 -14.483 3.793 8.011 1.00 1.52 N ATOM 511 CA SER A 34 -13.669 4.340 9.074 1.00 1.50 C ATOM 512 C SER A 34 -13.111 5.662 8.584 1.00 1.45 C ATOM 513 O SER A 34 -12.886 5.804 7.384 1.00 1.47 O ATOM 514 CB SER A 34 -12.553 3.354 9.412 1.00 1.53 C ATOM 515 OG SER A 34 -12.488 3.121 10.803 1.00 2.09 O ATOM 0 H SER A 34 -14.296 4.202 7.095 1.00 1.52 H new ATOM 0 HA SER A 34 -14.250 4.505 9.981 1.00 1.50 H new ATOM 0 HB2 SER A 34 -12.724 2.413 8.890 1.00 1.53 H new ATOM 0 HB3 SER A 34 -11.598 3.745 9.060 1.00 1.53 H new ATOM 0 HG SER A 34 -11.881 2.372 10.981 1.00 2.09 H new ATOM 521 N VAL A 35 -12.884 6.605 9.493 1.00 1.43 N ATOM 522 CA VAL A 35 -12.345 7.902 9.192 1.00 1.41 C ATOM 523 C VAL A 35 -11.406 8.253 10.336 1.00 1.45 C ATOM 524 O VAL A 35 -11.866 8.576 11.427 1.00 1.60 O ATOM 525 CB VAL A 35 -13.501 8.889 9.013 1.00 1.42 C ATOM 526 CG1 VAL A 35 -14.119 8.687 7.625 1.00 2.08 C ATOM 527 CG2 VAL A 35 -14.610 8.818 10.075 1.00 2.83 C ATOM 0 H VAL A 35 -13.080 6.472 10.485 1.00 1.43 H new ATOM 0 HA VAL A 35 -11.779 7.932 8.261 1.00 1.41 H new ATOM 0 HB VAL A 35 -13.057 9.878 9.130 1.00 1.42 H new ATOM 0 HG11 VAL A 35 -14.944 9.386 7.489 1.00 2.08 H new ATOM 0 HG12 VAL A 35 -13.363 8.865 6.861 1.00 2.08 H new ATOM 0 HG13 VAL A 35 -14.491 7.666 7.537 1.00 2.08 H new ATOM 0 HG21 VAL A 35 -15.377 9.560 9.851 1.00 2.83 H new ATOM 0 HG22 VAL A 35 -15.055 7.823 10.070 1.00 2.83 H new ATOM 0 HG23 VAL A 35 -14.186 9.021 11.058 1.00 2.83 H new ATOM 537 N LEU A 36 -10.096 8.091 10.132 1.00 1.36 N ATOM 538 CA LEU A 36 -9.121 8.469 11.145 1.00 1.38 C ATOM 539 C LEU A 36 -8.160 9.477 10.523 1.00 1.30 C ATOM 540 O LEU A 36 -6.994 9.174 10.260 1.00 1.34 O ATOM 541 CB LEU A 36 -8.498 7.195 11.750 1.00 1.47 C ATOM 542 CG LEU A 36 -7.710 7.328 13.070 1.00 1.89 C ATOM 543 CD1 LEU A 36 -6.193 7.280 12.856 1.00 2.28 C ATOM 544 CD2 LEU A 36 -8.069 8.551 13.921 1.00 3.24 C ATOM 0 H LEU A 36 -9.693 7.703 9.279 1.00 1.36 H new ATOM 0 HA LEU A 36 -9.560 8.981 12.001 1.00 1.38 H new ATOM 0 HB2 LEU A 36 -9.301 6.476 11.912 1.00 1.47 H new ATOM 0 HB3 LEU A 36 -7.830 6.764 11.005 1.00 1.47 H new ATOM 0 HG LEU A 36 -8.025 6.452 13.636 1.00 1.89 H new ATOM 0 HD11 LEU A 36 -5.687 7.378 13.816 1.00 2.28 H new ATOM 0 HD12 LEU A 36 -5.920 6.330 12.397 1.00 2.28 H new ATOM 0 HD13 LEU A 36 -5.892 8.098 12.202 1.00 2.28 H new ATOM 0 HD21 LEU A 36 -7.462 8.555 14.826 1.00 3.24 H new ATOM 0 HD22 LEU A 36 -7.877 9.460 13.351 1.00 3.24 H new ATOM 0 HD23 LEU A 36 -9.124 8.509 14.192 1.00 3.24 H new ATOM 556 N VAL A 37 -8.662 10.700 10.297 1.00 1.22 N ATOM 557 CA VAL A 37 -7.840 11.814 9.859 1.00 1.18 C ATOM 558 C VAL A 37 -7.457 12.638 11.079 1.00 1.31 C ATOM 559 O VAL A 37 -8.296 12.961 11.916 1.00 1.53 O ATOM 560 CB VAL A 37 -8.543 12.693 8.814 1.00 1.08 C ATOM 561 CG1 VAL A 37 -7.575 13.732 8.228 1.00 1.84 C ATOM 562 CG2 VAL A 37 -9.090 11.860 7.653 1.00 1.68 C ATOM 0 H VAL A 37 -9.648 10.934 10.415 1.00 1.22 H new ATOM 0 HA VAL A 37 -6.951 11.415 9.371 1.00 1.18 H new ATOM 0 HB VAL A 37 -9.365 13.188 9.331 1.00 1.08 H new ATOM 0 HG11 VAL A 37 -8.098 14.341 7.491 1.00 1.84 H new ATOM 0 HG12 VAL A 37 -7.200 14.371 9.027 1.00 1.84 H new ATOM 0 HG13 VAL A 37 -6.739 13.221 7.750 1.00 1.84 H new ATOM 0 HG21 VAL A 37 -9.580 12.516 6.934 1.00 1.68 H new ATOM 0 HG22 VAL A 37 -8.270 11.334 7.164 1.00 1.68 H new ATOM 0 HG23 VAL A 37 -9.810 11.135 8.033 1.00 1.68 H new ATOM 572 N ALA A 38 -6.175 12.991 11.172 1.00 1.21 N ATOM 573 CA ALA A 38 -5.670 13.885 12.195 1.00 1.23 C ATOM 574 C ALA A 38 -5.252 15.184 11.521 1.00 1.15 C ATOM 575 O ALA A 38 -4.067 15.374 11.261 1.00 1.26 O ATOM 576 CB ALA A 38 -4.501 13.215 12.920 1.00 1.28 C ATOM 0 H ALA A 38 -5.457 12.657 10.529 1.00 1.21 H new ATOM 0 HA ALA A 38 -6.433 14.107 12.941 1.00 1.23 H new ATOM 0 HB1 ALA A 38 -4.119 13.885 13.690 1.00 1.28 H new ATOM 0 HB2 ALA A 38 -4.842 12.288 13.382 1.00 1.28 H new ATOM 0 HB3 ALA A 38 -3.708 12.994 12.205 1.00 1.28 H new ATOM 582 N LEU A 39 -6.210 16.086 11.281 1.00 1.09 N ATOM 583 CA LEU A 39 -6.005 17.404 10.664 1.00 1.08 C ATOM 584 C LEU A 39 -4.853 18.187 11.327 1.00 1.21 C ATOM 585 O LEU A 39 -4.232 19.042 10.705 1.00 1.25 O ATOM 586 CB LEU A 39 -7.341 18.185 10.704 1.00 1.12 C ATOM 587 CG LEU A 39 -7.682 18.966 9.423 1.00 2.05 C ATOM 588 CD1 LEU A 39 -9.178 19.309 9.433 1.00 2.67 C ATOM 589 CD2 LEU A 39 -6.886 20.265 9.255 1.00 2.88 C ATOM 0 H LEU A 39 -7.186 15.913 11.520 1.00 1.09 H new ATOM 0 HA LEU A 39 -5.702 17.267 9.626 1.00 1.08 H new ATOM 0 HB2 LEU A 39 -8.149 17.482 10.907 1.00 1.12 H new ATOM 0 HB3 LEU A 39 -7.310 18.885 11.539 1.00 1.12 H new ATOM 0 HG LEU A 39 -7.414 18.320 8.587 1.00 2.05 H new ATOM 0 HD11 LEU A 39 -9.430 19.863 8.529 1.00 2.67 H new ATOM 0 HD12 LEU A 39 -9.762 18.389 9.470 1.00 2.67 H new ATOM 0 HD13 LEU A 39 -9.406 19.919 10.307 1.00 2.67 H new ATOM 0 HD21 LEU A 39 -7.184 20.757 8.329 1.00 2.88 H new ATOM 0 HD22 LEU A 39 -7.087 20.926 10.098 1.00 2.88 H new ATOM 0 HD23 LEU A 39 -5.821 20.037 9.219 1.00 2.88 H new ATOM 601 N MET A 40 -4.547 17.861 12.586 1.00 1.31 N ATOM 602 CA MET A 40 -3.491 18.485 13.374 1.00 1.41 C ATOM 603 C MET A 40 -2.099 18.105 12.861 1.00 1.32 C ATOM 604 O MET A 40 -1.187 18.925 12.848 1.00 1.31 O ATOM 605 CB MET A 40 -3.675 18.107 14.852 1.00 1.65 C ATOM 606 CG MET A 40 -3.476 16.620 15.176 1.00 2.02 C ATOM 607 SD MET A 40 -4.103 16.114 16.799 1.00 2.65 S ATOM 608 CE MET A 40 -3.654 14.363 16.798 1.00 4.75 C ATOM 0 H MET A 40 -5.045 17.132 13.097 1.00 1.31 H new ATOM 0 HA MET A 40 -3.567 19.568 13.273 1.00 1.41 H new ATOM 0 HB2 MET A 40 -2.974 18.690 15.449 1.00 1.65 H new ATOM 0 HB3 MET A 40 -4.678 18.399 15.163 1.00 1.65 H new ATOM 0 HG2 MET A 40 -3.970 16.025 14.408 1.00 2.02 H new ATOM 0 HG3 MET A 40 -2.412 16.389 15.123 1.00 2.02 H new ATOM 0 HE1 MET A 40 -3.876 13.930 17.773 1.00 4.75 H new ATOM 0 HE2 MET A 40 -4.226 13.841 16.031 1.00 4.75 H new ATOM 0 HE3 MET A 40 -2.589 14.261 16.590 1.00 4.75 H new ATOM 618 N ALA A 41 -1.940 16.836 12.480 1.00 1.32 N ATOM 619 CA ALA A 41 -0.677 16.260 12.029 1.00 1.27 C ATOM 620 C ALA A 41 -0.616 16.201 10.501 1.00 1.13 C ATOM 621 O ALA A 41 0.459 16.286 9.916 1.00 1.17 O ATOM 622 CB ALA A 41 -0.528 14.859 12.628 1.00 1.38 C ATOM 0 H ALA A 41 -2.708 16.165 12.478 1.00 1.32 H new ATOM 0 HA ALA A 41 0.145 16.891 12.366 1.00 1.27 H new ATOM 0 HB1 ALA A 41 0.413 14.420 12.297 1.00 1.38 H new ATOM 0 HB2 ALA A 41 -0.534 14.926 13.716 1.00 1.38 H new ATOM 0 HB3 ALA A 41 -1.357 14.232 12.298 1.00 1.38 H new ATOM 628 N GLY A 42 -1.775 16.016 9.865 1.00 1.00 N ATOM 629 CA GLY A 42 -1.924 15.873 8.432 1.00 0.88 C ATOM 630 C GLY A 42 -1.719 14.423 8.015 1.00 0.88 C ATOM 631 O GLY A 42 -0.818 14.132 7.231 1.00 0.90 O ATOM 0 H GLY A 42 -2.664 15.961 10.362 1.00 1.00 H new ATOM 0 HA2 GLY A 42 -2.916 16.208 8.129 1.00 0.88 H new ATOM 0 HA3 GLY A 42 -1.202 16.510 7.920 1.00 0.88 H new ATOM 635 N LYS A 43 -2.557 13.502 8.511 1.00 0.91 N ATOM 636 CA LYS A 43 -2.552 12.136 8.036 1.00 0.94 C ATOM 637 C LYS A 43 -3.996 11.677 7.977 1.00 0.93 C ATOM 638 O LYS A 43 -4.736 11.976 8.914 1.00 0.98 O ATOM 639 CB LYS A 43 -1.721 11.247 8.962 1.00 1.06 C ATOM 640 CG LYS A 43 -1.822 11.513 10.469 1.00 1.22 C ATOM 641 CD LYS A 43 -1.100 10.381 11.224 1.00 1.49 C ATOM 642 CE LYS A 43 -0.520 10.798 12.584 1.00 2.30 C ATOM 643 NZ LYS A 43 -1.558 11.128 13.579 1.00 3.66 N ATOM 0 H LYS A 43 -3.243 13.691 9.242 1.00 0.91 H new ATOM 0 HA LYS A 43 -2.097 12.069 7.048 1.00 0.94 H new ATOM 0 HB2 LYS A 43 -2.008 10.211 8.782 1.00 1.06 H new ATOM 0 HB3 LYS A 43 -0.675 11.343 8.672 1.00 1.06 H new ATOM 0 HG2 LYS A 43 -1.373 12.476 10.713 1.00 1.22 H new ATOM 0 HG3 LYS A 43 -2.867 11.563 10.774 1.00 1.22 H new ATOM 0 HD2 LYS A 43 -1.799 9.559 11.377 1.00 1.49 H new ATOM 0 HD3 LYS A 43 -0.292 10.001 10.599 1.00 1.49 H new ATOM 0 HE2 LYS A 43 0.101 9.990 12.970 1.00 2.30 H new ATOM 0 HE3 LYS A 43 0.130 11.662 12.446 1.00 2.30 H new ATOM 0 HZ1 LYS A 43 -1.106 11.401 14.475 1.00 3.66 H new ATOM 0 HZ2 LYS A 43 -2.137 11.918 13.228 1.00 3.66 H new ATOM 0 HZ3 LYS A 43 -2.164 10.298 13.737 1.00 3.66 H new ATOM 657 N ALA A 44 -4.372 10.982 6.898 1.00 0.90 N ATOM 658 CA ALA A 44 -5.640 10.292 6.745 1.00 0.91 C ATOM 659 C ALA A 44 -5.410 8.785 6.763 1.00 1.03 C ATOM 660 O ALA A 44 -5.013 8.205 5.755 1.00 1.05 O ATOM 661 CB ALA A 44 -6.307 10.734 5.442 1.00 0.78 C ATOM 0 H ALA A 44 -3.771 10.886 6.079 1.00 0.90 H new ATOM 0 HA ALA A 44 -6.303 10.544 7.573 1.00 0.91 H new ATOM 0 HB1 ALA A 44 -7.259 10.216 5.327 1.00 0.78 H new ATOM 0 HB2 ALA A 44 -6.480 11.810 5.469 1.00 0.78 H new ATOM 0 HB3 ALA A 44 -5.658 10.492 4.601 1.00 0.78 H new ATOM 667 N GLU A 45 -5.700 8.142 7.896 1.00 1.17 N ATOM 668 CA GLU A 45 -5.806 6.698 7.952 1.00 1.33 C ATOM 669 C GLU A 45 -7.299 6.388 7.874 1.00 1.32 C ATOM 670 O GLU A 45 -8.110 7.042 8.531 1.00 1.31 O ATOM 671 CB GLU A 45 -5.183 6.174 9.252 1.00 1.59 C ATOM 672 CG GLU A 45 -5.052 4.642 9.265 1.00 2.27 C ATOM 673 CD GLU A 45 -4.970 4.093 10.682 1.00 3.11 C ATOM 674 OE1 GLU A 45 -4.171 4.634 11.472 1.00 3.45 O ATOM 675 OE2 GLU A 45 -5.775 3.182 10.984 1.00 4.28 O ATOM 0 H GLU A 45 -5.865 8.609 8.787 1.00 1.17 H new ATOM 0 HA GLU A 45 -5.270 6.212 7.137 1.00 1.33 H new ATOM 0 HB2 GLU A 45 -4.198 6.621 9.385 1.00 1.59 H new ATOM 0 HB3 GLU A 45 -5.794 6.491 10.097 1.00 1.59 H new ATOM 0 HG2 GLU A 45 -5.907 4.200 8.753 1.00 2.27 H new ATOM 0 HG3 GLU A 45 -4.161 4.349 8.710 1.00 2.27 H new ATOM 682 N ILE A 46 -7.688 5.403 7.074 1.00 1.39 N ATOM 683 CA ILE A 46 -9.023 4.854 7.078 1.00 1.46 C ATOM 684 C ILE A 46 -8.907 3.335 7.041 1.00 1.59 C ATOM 685 O ILE A 46 -7.804 2.792 6.923 1.00 1.69 O ATOM 686 CB ILE A 46 -9.854 5.414 5.918 1.00 1.42 C ATOM 687 CG1 ILE A 46 -9.571 4.797 4.550 1.00 1.56 C ATOM 688 CG2 ILE A 46 -9.836 6.938 5.832 1.00 1.91 C ATOM 689 CD1 ILE A 46 -8.111 4.850 4.118 1.00 2.29 C ATOM 0 H ILE A 46 -7.068 4.961 6.395 1.00 1.39 H new ATOM 0 HA ILE A 46 -9.554 5.145 7.985 1.00 1.46 H new ATOM 0 HB ILE A 46 -10.864 5.101 6.185 1.00 1.42 H new ATOM 0 HG12 ILE A 46 -9.895 3.756 4.562 1.00 1.56 H new ATOM 0 HG13 ILE A 46 -10.176 5.311 3.803 1.00 1.56 H new ATOM 0 HG21 ILE A 46 -10.445 7.262 4.988 1.00 1.91 H new ATOM 0 HG22 ILE A 46 -10.239 7.359 6.753 1.00 1.91 H new ATOM 0 HG23 ILE A 46 -8.811 7.283 5.693 1.00 1.91 H new ATOM 0 HD11 ILE A 46 -8.005 4.389 3.136 1.00 2.29 H new ATOM 0 HD12 ILE A 46 -7.784 5.888 4.069 1.00 2.29 H new ATOM 0 HD13 ILE A 46 -7.498 4.310 4.840 1.00 2.29 H new ATOM 701 N LYS A 47 -10.051 2.659 7.158 1.00 1.63 N ATOM 702 CA LYS A 47 -10.140 1.214 7.114 1.00 1.84 C ATOM 703 C LYS A 47 -11.223 0.818 6.113 1.00 1.88 C ATOM 704 O LYS A 47 -12.415 0.970 6.393 1.00 1.90 O ATOM 705 CB LYS A 47 -10.341 0.624 8.525 1.00 2.02 C ATOM 706 CG LYS A 47 -9.026 0.524 9.315 1.00 2.71 C ATOM 707 CD LYS A 47 -8.995 1.236 10.675 1.00 3.60 C ATOM 708 CE LYS A 47 -8.869 2.759 10.510 1.00 4.25 C ATOM 709 NZ LYS A 47 -8.247 3.405 11.682 1.00 5.55 N ATOM 0 H LYS A 47 -10.953 3.117 7.288 1.00 1.63 H new ATOM 0 HA LYS A 47 -9.201 0.785 6.765 1.00 1.84 H new ATOM 0 HB2 LYS A 47 -11.047 1.245 9.077 1.00 2.02 H new ATOM 0 HB3 LYS A 47 -10.786 -0.367 8.441 1.00 2.02 H new ATOM 0 HG2 LYS A 47 -8.802 -0.531 9.476 1.00 2.71 H new ATOM 0 HG3 LYS A 47 -8.224 0.929 8.698 1.00 2.71 H new ATOM 0 HD2 LYS A 47 -9.904 1.003 11.230 1.00 3.60 H new ATOM 0 HD3 LYS A 47 -8.157 0.862 11.264 1.00 3.60 H new ATOM 0 HE2 LYS A 47 -8.276 2.977 9.622 1.00 4.25 H new ATOM 0 HE3 LYS A 47 -9.858 3.186 10.346 1.00 4.25 H new ATOM 0 HZ1 LYS A 47 -8.440 4.427 11.659 1.00 5.55 H new ATOM 0 HZ2 LYS A 47 -8.642 2.998 12.553 1.00 5.55 H new ATOM 0 HZ3 LYS A 47 -7.219 3.246 11.661 1.00 5.55 H new ATOM 723 N TYR A 48 -10.778 0.374 4.930 1.00 1.91 N ATOM 724 CA TYR A 48 -11.619 -0.095 3.845 1.00 1.98 C ATOM 725 C TYR A 48 -11.392 -1.560 3.480 1.00 1.98 C ATOM 726 O TYR A 48 -10.394 -2.160 3.874 1.00 1.85 O ATOM 727 CB TYR A 48 -11.396 0.796 2.617 1.00 1.98 C ATOM 728 CG TYR A 48 -10.030 0.678 1.954 1.00 2.02 C ATOM 729 CD1 TYR A 48 -9.762 -0.378 1.061 1.00 2.31 C ATOM 730 CD2 TYR A 48 -9.107 1.732 2.063 1.00 3.21 C ATOM 731 CE1 TYR A 48 -8.563 -0.406 0.331 1.00 2.27 C ATOM 732 CE2 TYR A 48 -7.931 1.727 1.292 1.00 3.31 C ATOM 733 CZ TYR A 48 -7.632 0.632 0.467 1.00 2.15 C ATOM 734 OH TYR A 48 -6.442 0.567 -0.199 1.00 2.26 O ATOM 0 H TYR A 48 -9.784 0.334 4.704 1.00 1.91 H new ATOM 0 HA TYR A 48 -12.651 -0.030 4.190 1.00 1.98 H new ATOM 0 HB2 TYR A 48 -12.160 0.560 1.876 1.00 1.98 H new ATOM 0 HB3 TYR A 48 -11.548 1.834 2.912 1.00 1.98 H new ATOM 0 HD1 TYR A 48 -10.484 -1.172 0.937 1.00 2.31 H new ATOM 0 HD2 TYR A 48 -9.302 2.549 2.742 1.00 3.21 H new ATOM 0 HE1 TYR A 48 -8.358 -1.230 -0.337 1.00 2.27 H new ATOM 0 HE2 TYR A 48 -7.256 2.569 1.335 1.00 3.31 H new ATOM 0 HH TYR A 48 -5.911 1.366 0.002 1.00 2.26 H new ATOM 744 N ASP A 49 -12.316 -2.085 2.671 1.00 2.16 N ATOM 745 CA ASP A 49 -12.342 -3.432 2.123 1.00 2.19 C ATOM 746 C ASP A 49 -11.812 -3.435 0.677 1.00 2.21 C ATOM 747 O ASP A 49 -12.499 -2.960 -0.234 1.00 2.07 O ATOM 748 CB ASP A 49 -13.797 -3.901 2.170 1.00 2.09 C ATOM 749 CG ASP A 49 -13.966 -5.327 1.671 1.00 2.20 C ATOM 750 OD1 ASP A 49 -13.398 -5.629 0.598 1.00 2.77 O ATOM 751 OD2 ASP A 49 -14.669 -6.076 2.386 1.00 3.17 O ATOM 0 H ASP A 49 -13.119 -1.537 2.364 1.00 2.16 H new ATOM 0 HA ASP A 49 -11.703 -4.101 2.699 1.00 2.19 H new ATOM 0 HB2 ASP A 49 -14.165 -3.832 3.194 1.00 2.09 H new ATOM 0 HB3 ASP A 49 -14.410 -3.233 1.565 1.00 2.09 H new ATOM 756 N PRO A 50 -10.591 -3.939 0.434 1.00 2.38 N ATOM 757 CA PRO A 50 -9.957 -3.834 -0.871 1.00 2.42 C ATOM 758 C PRO A 50 -10.619 -4.677 -1.964 1.00 2.40 C ATOM 759 O PRO A 50 -10.184 -4.604 -3.114 1.00 2.46 O ATOM 760 CB PRO A 50 -8.498 -4.238 -0.668 1.00 2.60 C ATOM 761 CG PRO A 50 -8.534 -5.113 0.578 1.00 2.70 C ATOM 762 CD PRO A 50 -9.685 -4.533 1.399 1.00 2.56 C ATOM 0 HA PRO A 50 -10.057 -2.812 -1.235 1.00 2.42 H new ATOM 0 HB2 PRO A 50 -8.110 -4.783 -1.529 1.00 2.60 H new ATOM 0 HB3 PRO A 50 -7.858 -3.367 -0.527 1.00 2.60 H new ATOM 0 HG2 PRO A 50 -8.709 -6.159 0.327 1.00 2.70 H new ATOM 0 HG3 PRO A 50 -7.592 -5.070 1.124 1.00 2.70 H new ATOM 0 HD2 PRO A 50 -10.184 -5.310 1.979 1.00 2.56 H new ATOM 0 HD3 PRO A 50 -9.324 -3.788 2.108 1.00 2.56 H new ATOM 770 N GLU A 51 -11.631 -5.486 -1.633 1.00 2.37 N ATOM 771 CA GLU A 51 -12.243 -6.395 -2.591 1.00 2.38 C ATOM 772 C GLU A 51 -13.381 -5.710 -3.341 1.00 2.19 C ATOM 773 O GLU A 51 -13.774 -6.152 -4.419 1.00 2.24 O ATOM 774 CB GLU A 51 -12.735 -7.640 -1.851 1.00 2.47 C ATOM 775 CG GLU A 51 -11.656 -8.095 -0.862 1.00 3.05 C ATOM 776 CD GLU A 51 -11.828 -9.555 -0.456 1.00 3.37 C ATOM 777 OE1 GLU A 51 -11.977 -10.388 -1.378 1.00 3.24 O ATOM 778 OE2 GLU A 51 -11.834 -9.812 0.767 1.00 4.46 O ATOM 0 H GLU A 51 -12.042 -5.525 -0.700 1.00 2.37 H new ATOM 0 HA GLU A 51 -11.503 -6.692 -3.334 1.00 2.38 H new ATOM 0 HB2 GLU A 51 -13.662 -7.421 -1.321 1.00 2.47 H new ATOM 0 HB3 GLU A 51 -12.954 -8.437 -2.561 1.00 2.47 H new ATOM 0 HG2 GLU A 51 -10.672 -7.958 -1.311 1.00 3.05 H new ATOM 0 HG3 GLU A 51 -11.691 -7.465 0.027 1.00 3.05 H new ATOM 785 N VAL A 52 -13.913 -4.634 -2.756 1.00 2.05 N ATOM 786 CA VAL A 52 -15.026 -3.869 -3.295 1.00 1.90 C ATOM 787 C VAL A 52 -14.586 -2.438 -3.586 1.00 1.82 C ATOM 788 O VAL A 52 -15.114 -1.825 -4.511 1.00 1.88 O ATOM 789 CB VAL A 52 -16.231 -3.962 -2.343 1.00 1.83 C ATOM 790 CG1 VAL A 52 -16.059 -3.126 -1.074 1.00 2.80 C ATOM 791 CG2 VAL A 52 -17.533 -3.559 -3.046 1.00 2.21 C ATOM 0 H VAL A 52 -13.567 -4.266 -1.870 1.00 2.05 H new ATOM 0 HA VAL A 52 -15.349 -4.289 -4.248 1.00 1.90 H new ATOM 0 HB VAL A 52 -16.287 -5.009 -2.045 1.00 1.83 H new ATOM 0 HG11 VAL A 52 -16.942 -3.234 -0.445 1.00 2.80 H new ATOM 0 HG12 VAL A 52 -15.180 -3.470 -0.528 1.00 2.80 H new ATOM 0 HG13 VAL A 52 -15.932 -2.078 -1.343 1.00 2.80 H new ATOM 0 HG21 VAL A 52 -18.364 -3.636 -2.345 1.00 2.21 H new ATOM 0 HG22 VAL A 52 -17.452 -2.532 -3.401 1.00 2.21 H new ATOM 0 HG23 VAL A 52 -17.710 -4.222 -3.893 1.00 2.21 H new ATOM 801 N ILE A 53 -13.624 -1.905 -2.820 1.00 1.72 N ATOM 802 CA ILE A 53 -13.028 -0.607 -3.104 1.00 1.63 C ATOM 803 C ILE A 53 -11.546 -0.793 -3.429 1.00 1.67 C ATOM 804 O ILE A 53 -10.927 -1.782 -3.061 1.00 1.74 O ATOM 805 CB ILE A 53 -13.385 0.421 -2.004 1.00 1.46 C ATOM 806 CG1 ILE A 53 -12.515 1.690 -1.973 1.00 1.50 C ATOM 807 CG2 ILE A 53 -13.492 -0.140 -0.583 1.00 1.67 C ATOM 808 CD1 ILE A 53 -11.198 1.483 -1.214 1.00 1.58 C ATOM 0 H ILE A 53 -13.244 -2.364 -1.992 1.00 1.72 H new ATOM 0 HA ILE A 53 -13.454 -0.156 -4.000 1.00 1.63 H new ATOM 0 HB ILE A 53 -14.385 0.705 -2.331 1.00 1.46 H new ATOM 0 HG12 ILE A 53 -12.296 2.001 -2.994 1.00 1.50 H new ATOM 0 HG13 ILE A 53 -13.076 2.500 -1.506 1.00 1.50 H new ATOM 0 HG21 ILE A 53 -13.746 0.664 0.108 1.00 1.67 H new ATOM 0 HG22 ILE A 53 -14.268 -0.904 -0.551 1.00 1.67 H new ATOM 0 HG23 ILE A 53 -12.538 -0.580 -0.293 1.00 1.67 H new ATOM 0 HD11 ILE A 53 -10.623 2.409 -1.223 1.00 1.58 H new ATOM 0 HD12 ILE A 53 -11.413 1.199 -0.184 1.00 1.58 H new ATOM 0 HD13 ILE A 53 -10.621 0.693 -1.695 1.00 1.58 H new ATOM 820 N GLN A 54 -10.995 0.163 -4.168 1.00 1.67 N ATOM 821 CA GLN A 54 -9.621 0.236 -4.636 1.00 1.65 C ATOM 822 C GLN A 54 -9.083 1.646 -4.342 1.00 1.54 C ATOM 823 O GLN A 54 -9.859 2.597 -4.249 1.00 1.51 O ATOM 824 CB GLN A 54 -9.605 -0.061 -6.145 1.00 1.69 C ATOM 825 CG GLN A 54 -9.548 -1.552 -6.484 1.00 1.90 C ATOM 826 CD GLN A 54 -8.141 -2.097 -6.279 1.00 1.85 C ATOM 827 OE1 GLN A 54 -7.253 -1.865 -7.094 1.00 2.94 O ATOM 828 NE2 GLN A 54 -7.902 -2.788 -5.173 1.00 1.76 N ATOM 0 H GLN A 54 -11.541 0.967 -4.478 1.00 1.67 H new ATOM 0 HA GLN A 54 -8.988 -0.493 -4.130 1.00 1.65 H new ATOM 0 HB2 GLN A 54 -10.497 0.371 -6.600 1.00 1.69 H new ATOM 0 HB3 GLN A 54 -8.745 0.437 -6.594 1.00 1.69 H new ATOM 0 HG2 GLN A 54 -10.251 -2.100 -5.856 1.00 1.90 H new ATOM 0 HG3 GLN A 54 -9.856 -1.707 -7.518 1.00 1.90 H new ATOM 0 HE21 GLN A 54 -8.657 -2.968 -4.511 1.00 1.76 H new ATOM 0 HE22 GLN A 54 -6.963 -3.140 -4.984 1.00 1.76 H new ATOM 837 N PRO A 55 -7.758 1.808 -4.189 1.00 1.50 N ATOM 838 CA PRO A 55 -7.164 3.072 -3.781 1.00 1.45 C ATOM 839 C PRO A 55 -7.410 4.185 -4.806 1.00 1.43 C ATOM 840 O PRO A 55 -7.686 5.322 -4.426 1.00 1.42 O ATOM 841 CB PRO A 55 -5.676 2.775 -3.565 1.00 1.45 C ATOM 842 CG PRO A 55 -5.413 1.539 -4.423 1.00 1.43 C ATOM 843 CD PRO A 55 -6.737 0.783 -4.343 1.00 1.54 C ATOM 0 HA PRO A 55 -7.619 3.453 -2.867 1.00 1.45 H new ATOM 0 HB2 PRO A 55 -5.053 3.614 -3.874 1.00 1.45 H new ATOM 0 HB3 PRO A 55 -5.456 2.585 -2.514 1.00 1.45 H new ATOM 0 HG2 PRO A 55 -5.161 1.805 -5.449 1.00 1.43 H new ATOM 0 HG3 PRO A 55 -4.585 0.946 -4.035 1.00 1.43 H new ATOM 0 HD2 PRO A 55 -6.907 0.191 -5.243 1.00 1.54 H new ATOM 0 HD3 PRO A 55 -6.744 0.091 -3.501 1.00 1.54 H new ATOM 851 N LEU A 56 -7.324 3.878 -6.106 1.00 1.46 N ATOM 852 CA LEU A 56 -7.554 4.896 -7.131 1.00 1.47 C ATOM 853 C LEU A 56 -8.990 5.409 -7.075 1.00 1.43 C ATOM 854 O LEU A 56 -9.230 6.603 -7.204 1.00 1.35 O ATOM 855 CB LEU A 56 -7.129 4.448 -8.538 1.00 1.57 C ATOM 856 CG LEU A 56 -8.155 3.705 -9.413 1.00 1.96 C ATOM 857 CD1 LEU A 56 -7.718 3.759 -10.883 1.00 2.59 C ATOM 858 CD2 LEU A 56 -8.278 2.244 -8.985 1.00 2.82 C ATOM 0 H LEU A 56 -7.101 2.950 -6.466 1.00 1.46 H new ATOM 0 HA LEU A 56 -6.899 5.737 -6.901 1.00 1.47 H new ATOM 0 HB2 LEU A 56 -6.807 5.334 -9.085 1.00 1.57 H new ATOM 0 HB3 LEU A 56 -6.256 3.804 -8.431 1.00 1.57 H new ATOM 0 HG LEU A 56 -9.122 4.192 -9.291 1.00 1.96 H new ATOM 0 HD11 LEU A 56 -8.447 3.232 -11.499 1.00 2.59 H new ATOM 0 HD12 LEU A 56 -7.654 4.798 -11.206 1.00 2.59 H new ATOM 0 HD13 LEU A 56 -6.742 3.285 -10.990 1.00 2.59 H new ATOM 0 HD21 LEU A 56 -9.009 1.740 -9.618 1.00 2.82 H new ATOM 0 HD22 LEU A 56 -7.310 1.753 -9.086 1.00 2.82 H new ATOM 0 HD23 LEU A 56 -8.603 2.195 -7.946 1.00 2.82 H new ATOM 870 N GLU A 57 -9.936 4.499 -6.855 1.00 1.51 N ATOM 871 CA GLU A 57 -11.350 4.815 -6.709 1.00 1.54 C ATOM 872 C GLU A 57 -11.560 5.794 -5.548 1.00 1.37 C ATOM 873 O GLU A 57 -12.236 6.814 -5.705 1.00 1.30 O ATOM 874 CB GLU A 57 -12.166 3.527 -6.518 1.00 1.78 C ATOM 875 CG GLU A 57 -11.911 2.488 -7.624 1.00 1.57 C ATOM 876 CD GLU A 57 -12.291 3.005 -9.006 1.00 1.90 C ATOM 877 OE1 GLU A 57 -13.407 3.553 -9.122 1.00 2.48 O ATOM 878 OE2 GLU A 57 -11.451 2.845 -9.918 1.00 2.95 O ATOM 0 H GLU A 57 -9.735 3.503 -6.772 1.00 1.51 H new ATOM 0 HA GLU A 57 -11.703 5.300 -7.619 1.00 1.54 H new ATOM 0 HB2 GLU A 57 -11.922 3.088 -5.551 1.00 1.78 H new ATOM 0 HB3 GLU A 57 -13.227 3.775 -6.497 1.00 1.78 H new ATOM 0 HG2 GLU A 57 -10.857 2.209 -7.621 1.00 1.57 H new ATOM 0 HG3 GLU A 57 -12.481 1.584 -7.408 1.00 1.57 H new ATOM 885 N ILE A 58 -10.915 5.527 -4.403 1.00 1.32 N ATOM 886 CA ILE A 58 -10.893 6.457 -3.282 1.00 1.18 C ATOM 887 C ILE A 58 -10.392 7.786 -3.822 1.00 1.12 C ATOM 888 O ILE A 58 -11.066 8.812 -3.705 1.00 1.00 O ATOM 889 CB ILE A 58 -10.008 5.912 -2.132 1.00 1.18 C ATOM 890 CG1 ILE A 58 -10.889 5.147 -1.134 1.00 1.27 C ATOM 891 CG2 ILE A 58 -9.209 7.014 -1.399 1.00 1.32 C ATOM 892 CD1 ILE A 58 -10.065 4.440 -0.050 1.00 1.23 C ATOM 0 H ILE A 58 -10.399 4.663 -4.236 1.00 1.32 H new ATOM 0 HA ILE A 58 -11.886 6.586 -2.852 1.00 1.18 H new ATOM 0 HB ILE A 58 -9.270 5.247 -2.581 1.00 1.18 H new ATOM 0 HG12 ILE A 58 -11.586 5.840 -0.663 1.00 1.27 H new ATOM 0 HG13 ILE A 58 -11.486 4.410 -1.671 1.00 1.27 H new ATOM 0 HG21 ILE A 58 -8.611 6.564 -0.606 1.00 1.32 H new ATOM 0 HG22 ILE A 58 -8.552 7.519 -2.107 1.00 1.32 H new ATOM 0 HG23 ILE A 58 -9.900 7.737 -0.966 1.00 1.32 H new ATOM 0 HD11 ILE A 58 -10.734 3.914 0.630 1.00 1.23 H new ATOM 0 HD12 ILE A 58 -9.387 3.726 -0.517 1.00 1.23 H new ATOM 0 HD13 ILE A 58 -9.488 5.178 0.507 1.00 1.23 H new ATOM 904 N ALA A 59 -9.204 7.754 -4.436 1.00 1.28 N ATOM 905 CA ALA A 59 -8.541 8.962 -4.871 1.00 1.28 C ATOM 906 C ALA A 59 -9.456 9.779 -5.778 1.00 1.27 C ATOM 907 O ALA A 59 -9.531 10.994 -5.633 1.00 1.21 O ATOM 908 CB ALA A 59 -7.195 8.658 -5.534 1.00 1.44 C ATOM 0 H ALA A 59 -8.691 6.896 -4.638 1.00 1.28 H new ATOM 0 HA ALA A 59 -8.324 9.567 -3.991 1.00 1.28 H new ATOM 0 HB1 ALA A 59 -6.725 9.590 -5.848 1.00 1.44 H new ATOM 0 HB2 ALA A 59 -6.546 8.147 -4.823 1.00 1.44 H new ATOM 0 HB3 ALA A 59 -7.354 8.020 -6.404 1.00 1.44 H new ATOM 914 N GLN A 60 -10.175 9.106 -6.675 1.00 1.37 N ATOM 915 CA GLN A 60 -11.107 9.699 -7.616 1.00 1.44 C ATOM 916 C GLN A 60 -12.115 10.560 -6.857 1.00 1.23 C ATOM 917 O GLN A 60 -12.303 11.729 -7.184 1.00 1.27 O ATOM 918 CB GLN A 60 -11.801 8.584 -8.422 1.00 1.66 C ATOM 919 CG GLN A 60 -12.308 9.041 -9.794 1.00 1.56 C ATOM 920 CD GLN A 60 -11.171 9.158 -10.808 1.00 1.73 C ATOM 921 OE1 GLN A 60 -10.860 8.211 -11.520 1.00 2.77 O ATOM 922 NE2 GLN A 60 -10.536 10.322 -10.891 1.00 1.55 N ATOM 0 H GLN A 60 -10.117 8.092 -6.765 1.00 1.37 H new ATOM 0 HA GLN A 60 -10.578 10.342 -8.320 1.00 1.44 H new ATOM 0 HB2 GLN A 60 -11.103 7.758 -8.559 1.00 1.66 H new ATOM 0 HB3 GLN A 60 -12.641 8.199 -7.844 1.00 1.66 H new ATOM 0 HG2 GLN A 60 -13.051 8.333 -10.161 1.00 1.56 H new ATOM 0 HG3 GLN A 60 -12.807 10.005 -9.695 1.00 1.56 H new ATOM 0 HE21 GLN A 60 -10.812 11.097 -10.288 1.00 1.55 H new ATOM 0 HE22 GLN A 60 -9.773 10.440 -11.557 1.00 1.55 H new ATOM 931 N PHE A 61 -12.716 9.984 -5.811 1.00 1.06 N ATOM 932 CA PHE A 61 -13.649 10.687 -4.940 1.00 0.93 C ATOM 933 C PHE A 61 -12.991 11.956 -4.393 1.00 0.86 C ATOM 934 O PHE A 61 -13.563 13.044 -4.437 1.00 0.91 O ATOM 935 CB PHE A 61 -14.114 9.754 -3.803 1.00 0.83 C ATOM 936 CG PHE A 61 -15.619 9.664 -3.645 1.00 0.87 C ATOM 937 CD1 PHE A 61 -16.372 8.984 -4.619 1.00 1.97 C ATOM 938 CD2 PHE A 61 -16.260 10.183 -2.503 1.00 2.03 C ATOM 939 CE1 PHE A 61 -17.759 8.827 -4.458 1.00 2.12 C ATOM 940 CE2 PHE A 61 -17.648 10.024 -2.342 1.00 2.21 C ATOM 941 CZ PHE A 61 -18.398 9.345 -3.319 1.00 1.46 C ATOM 0 H PHE A 61 -12.564 9.010 -5.547 1.00 1.06 H new ATOM 0 HA PHE A 61 -14.530 10.983 -5.509 1.00 0.93 H new ATOM 0 HB2 PHE A 61 -13.719 8.754 -3.985 1.00 0.83 H new ATOM 0 HB3 PHE A 61 -13.682 10.101 -2.864 1.00 0.83 H new ATOM 0 HD1 PHE A 61 -15.883 8.581 -5.493 1.00 1.97 H new ATOM 0 HD2 PHE A 61 -15.685 10.703 -1.751 1.00 2.03 H new ATOM 0 HE1 PHE A 61 -18.334 8.308 -5.210 1.00 2.12 H new ATOM 0 HE2 PHE A 61 -18.139 10.424 -1.467 1.00 2.21 H new ATOM 0 HZ PHE A 61 -19.464 9.222 -3.194 1.00 1.46 H new ATOM 951 N ILE A 62 -11.766 11.818 -3.880 1.00 0.80 N ATOM 952 CA ILE A 62 -11.046 12.938 -3.288 1.00 0.77 C ATOM 953 C ILE A 62 -10.769 14.022 -4.345 1.00 0.93 C ATOM 954 O ILE A 62 -10.923 15.213 -4.067 1.00 0.96 O ATOM 955 CB ILE A 62 -9.785 12.445 -2.548 1.00 0.74 C ATOM 956 CG1 ILE A 62 -10.038 11.246 -1.616 1.00 1.37 C ATOM 957 CG2 ILE A 62 -9.172 13.576 -1.720 1.00 1.10 C ATOM 958 CD1 ILE A 62 -11.299 11.356 -0.757 1.00 2.67 C ATOM 0 H ILE A 62 -11.254 10.936 -3.865 1.00 0.80 H new ATOM 0 HA ILE A 62 -11.668 13.413 -2.529 1.00 0.77 H new ATOM 0 HB ILE A 62 -9.103 12.116 -3.332 1.00 0.74 H new ATOM 0 HG12 ILE A 62 -10.105 10.342 -2.221 1.00 1.37 H new ATOM 0 HG13 ILE A 62 -9.177 11.127 -0.959 1.00 1.37 H new ATOM 0 HG21 ILE A 62 -8.284 13.210 -1.205 1.00 1.10 H new ATOM 0 HG22 ILE A 62 -8.896 14.400 -2.378 1.00 1.10 H new ATOM 0 HG23 ILE A 62 -9.899 13.925 -0.986 1.00 1.10 H new ATOM 0 HD11 ILE A 62 -11.394 10.467 -0.134 1.00 2.67 H new ATOM 0 HD12 ILE A 62 -11.230 12.239 -0.121 1.00 2.67 H new ATOM 0 HD13 ILE A 62 -12.173 11.441 -1.403 1.00 2.67 H new ATOM 970 N GLN A 63 -10.406 13.619 -5.569 1.00 1.05 N ATOM 971 CA GLN A 63 -10.153 14.552 -6.657 1.00 1.21 C ATOM 972 C GLN A 63 -11.444 15.282 -7.021 1.00 1.28 C ATOM 973 O GLN A 63 -11.420 16.490 -7.239 1.00 1.36 O ATOM 974 CB GLN A 63 -9.569 13.849 -7.895 1.00 1.34 C ATOM 975 CG GLN A 63 -8.264 13.053 -7.712 1.00 1.81 C ATOM 976 CD GLN A 63 -7.399 13.547 -6.557 1.00 1.34 C ATOM 977 OE1 GLN A 63 -6.633 14.488 -6.713 1.00 1.96 O ATOM 978 NE2 GLN A 63 -7.521 12.910 -5.395 1.00 1.47 N ATOM 0 H GLN A 63 -10.282 12.640 -5.825 1.00 1.05 H new ATOM 0 HA GLN A 63 -9.410 15.272 -6.314 1.00 1.21 H new ATOM 0 HB2 GLN A 63 -10.326 13.168 -8.283 1.00 1.34 H new ATOM 0 HB3 GLN A 63 -9.397 14.605 -8.661 1.00 1.34 H new ATOM 0 HG2 GLN A 63 -8.509 12.004 -7.547 1.00 1.81 H new ATOM 0 HG3 GLN A 63 -7.686 13.104 -8.635 1.00 1.81 H new ATOM 0 HE21 GLN A 63 -8.172 12.130 -5.307 1.00 1.47 H new ATOM 0 HE22 GLN A 63 -6.964 13.202 -4.592 1.00 1.47 H new ATOM 987 N ASP A 64 -12.566 14.559 -7.074 1.00 1.28 N ATOM 988 CA ASP A 64 -13.869 15.133 -7.377 1.00 1.37 C ATOM 989 C ASP A 64 -14.222 16.186 -6.325 1.00 1.33 C ATOM 990 O ASP A 64 -14.567 17.321 -6.648 1.00 1.46 O ATOM 991 CB ASP A 64 -14.916 14.016 -7.441 1.00 1.36 C ATOM 992 CG ASP A 64 -16.178 14.496 -8.144 1.00 1.75 C ATOM 993 OD1 ASP A 64 -17.011 15.118 -7.453 1.00 1.66 O ATOM 994 OD2 ASP A 64 -16.281 14.227 -9.360 1.00 2.98 O ATOM 0 H ASP A 64 -12.590 13.553 -6.906 1.00 1.28 H new ATOM 0 HA ASP A 64 -13.847 15.628 -8.348 1.00 1.37 H new ATOM 0 HB2 ASP A 64 -14.505 13.156 -7.970 1.00 1.36 H new ATOM 0 HB3 ASP A 64 -15.161 13.683 -6.432 1.00 1.36 H new ATOM 999 N LEU A 65 -14.049 15.819 -5.049 1.00 1.19 N ATOM 1000 CA LEU A 65 -14.221 16.732 -3.925 1.00 1.19 C ATOM 1001 C LEU A 65 -13.273 17.937 -4.024 1.00 1.27 C ATOM 1002 O LEU A 65 -13.639 19.037 -3.614 1.00 1.36 O ATOM 1003 CB LEU A 65 -14.064 15.971 -2.599 1.00 1.06 C ATOM 1004 CG LEU A 65 -15.273 15.046 -2.352 1.00 1.34 C ATOM 1005 CD1 LEU A 65 -14.918 13.855 -1.457 1.00 2.04 C ATOM 1006 CD2 LEU A 65 -16.423 15.824 -1.700 1.00 1.49 C ATOM 0 H LEU A 65 -13.784 14.874 -4.772 1.00 1.19 H new ATOM 0 HA LEU A 65 -15.232 17.139 -3.958 1.00 1.19 H new ATOM 0 HB2 LEU A 65 -13.147 15.381 -2.619 1.00 1.06 H new ATOM 0 HB3 LEU A 65 -13.969 16.680 -1.777 1.00 1.06 H new ATOM 0 HG LEU A 65 -15.579 14.668 -3.328 1.00 1.34 H new ATOM 0 HD11 LEU A 65 -15.801 13.233 -1.312 1.00 2.04 H new ATOM 0 HD12 LEU A 65 -14.133 13.266 -1.930 1.00 2.04 H new ATOM 0 HD13 LEU A 65 -14.567 14.218 -0.491 1.00 2.04 H new ATOM 0 HD21 LEU A 65 -17.267 15.154 -1.534 1.00 1.49 H new ATOM 0 HD22 LEU A 65 -16.091 16.233 -0.746 1.00 1.49 H new ATOM 0 HD23 LEU A 65 -16.730 16.638 -2.357 1.00 1.49 H new ATOM 1018 N GLY A 66 -12.070 17.740 -4.570 1.00 1.27 N ATOM 1019 CA GLY A 66 -11.156 18.814 -4.951 1.00 1.35 C ATOM 1020 C GLY A 66 -9.916 18.836 -4.067 1.00 1.24 C ATOM 1021 O GLY A 66 -9.312 19.887 -3.866 1.00 1.39 O ATOM 0 H GLY A 66 -11.699 16.810 -4.762 1.00 1.27 H new ATOM 0 HA2 GLY A 66 -10.859 18.687 -5.992 1.00 1.35 H new ATOM 0 HA3 GLY A 66 -11.671 19.772 -4.881 1.00 1.35 H new ATOM 1025 N PHE A 67 -9.541 17.673 -3.532 1.00 1.03 N ATOM 1026 CA PHE A 67 -8.377 17.456 -2.694 1.00 0.94 C ATOM 1027 C PHE A 67 -7.452 16.453 -3.389 1.00 0.94 C ATOM 1028 O PHE A 67 -7.888 15.676 -4.231 1.00 1.02 O ATOM 1029 CB PHE A 67 -8.854 16.867 -1.360 1.00 0.81 C ATOM 1030 CG PHE A 67 -9.147 17.810 -0.212 1.00 0.82 C ATOM 1031 CD1 PHE A 67 -9.488 19.161 -0.407 1.00 1.99 C ATOM 1032 CD2 PHE A 67 -9.199 17.268 1.081 1.00 2.13 C ATOM 1033 CE1 PHE A 67 -9.827 19.967 0.694 1.00 2.09 C ATOM 1034 CE2 PHE A 67 -9.459 18.088 2.188 1.00 2.18 C ATOM 1035 CZ PHE A 67 -9.786 19.438 1.996 1.00 1.12 C ATOM 0 H PHE A 67 -10.074 16.817 -3.684 1.00 1.03 H new ATOM 0 HA PHE A 67 -7.842 18.390 -2.524 1.00 0.94 H new ATOM 0 HB2 PHE A 67 -9.760 16.294 -1.557 1.00 0.81 H new ATOM 0 HB3 PHE A 67 -8.097 16.159 -1.022 1.00 0.81 H new ATOM 0 HD1 PHE A 67 -9.489 19.579 -1.403 1.00 1.99 H new ATOM 0 HD2 PHE A 67 -9.037 16.210 1.225 1.00 2.13 H new ATOM 0 HE1 PHE A 67 -10.120 20.995 0.539 1.00 2.09 H new ATOM 0 HE2 PHE A 67 -9.408 17.681 3.187 1.00 2.18 H new ATOM 0 HZ PHE A 67 -10.005 20.069 2.845 1.00 1.12 H new ATOM 1045 N GLU A 68 -6.192 16.413 -2.954 1.00 0.89 N ATOM 1046 CA GLU A 68 -5.197 15.443 -3.376 1.00 0.91 C ATOM 1047 C GLU A 68 -5.130 14.347 -2.318 1.00 0.85 C ATOM 1048 O GLU A 68 -4.974 14.652 -1.132 1.00 0.84 O ATOM 1049 CB GLU A 68 -3.842 16.142 -3.425 1.00 0.91 C ATOM 1050 CG GLU A 68 -3.700 17.091 -4.621 1.00 1.12 C ATOM 1051 CD GLU A 68 -3.302 16.372 -5.907 1.00 2.16 C ATOM 1052 OE1 GLU A 68 -3.058 15.147 -5.833 1.00 3.69 O ATOM 1053 OE2 GLU A 68 -3.200 17.080 -6.931 1.00 2.53 O ATOM 0 H GLU A 68 -5.830 17.082 -2.274 1.00 0.89 H new ATOM 0 HA GLU A 68 -5.450 15.026 -4.351 1.00 0.91 H new ATOM 0 HB2 GLU A 68 -3.696 16.704 -2.503 1.00 0.91 H new ATOM 0 HB3 GLU A 68 -3.053 15.391 -3.469 1.00 0.91 H new ATOM 0 HG2 GLU A 68 -4.645 17.611 -4.779 1.00 1.12 H new ATOM 0 HG3 GLU A 68 -2.953 17.850 -4.389 1.00 1.12 H new ATOM 1060 N ALA A 69 -5.225 13.090 -2.753 1.00 0.89 N ATOM 1061 CA ALA A 69 -5.069 11.904 -1.921 1.00 0.86 C ATOM 1062 C ALA A 69 -3.758 11.222 -2.292 1.00 0.94 C ATOM 1063 O ALA A 69 -3.660 10.663 -3.381 1.00 1.17 O ATOM 1064 CB ALA A 69 -6.234 10.944 -2.177 1.00 1.01 C ATOM 0 H ALA A 69 -5.420 12.866 -3.729 1.00 0.89 H new ATOM 0 HA ALA A 69 -5.061 12.184 -0.868 1.00 0.86 H new ATOM 0 HB1 ALA A 69 -6.118 10.057 -1.555 1.00 1.01 H new ATOM 0 HB2 ALA A 69 -7.174 11.439 -1.932 1.00 1.01 H new ATOM 0 HB3 ALA A 69 -6.241 10.652 -3.227 1.00 1.01 H new ATOM 1070 N ALA A 70 -2.761 11.248 -1.403 1.00 0.92 N ATOM 1071 CA ALA A 70 -1.503 10.545 -1.629 1.00 1.12 C ATOM 1072 C ALA A 70 -1.190 9.641 -0.440 1.00 1.13 C ATOM 1073 O ALA A 70 -1.123 10.102 0.699 1.00 1.06 O ATOM 1074 CB ALA A 70 -0.379 11.548 -1.913 1.00 1.21 C ATOM 0 H ALA A 70 -2.805 11.752 -0.517 1.00 0.92 H new ATOM 0 HA ALA A 70 -1.592 9.907 -2.508 1.00 1.12 H new ATOM 0 HB1 ALA A 70 0.555 11.011 -2.080 1.00 1.21 H new ATOM 0 HB2 ALA A 70 -0.626 12.130 -2.801 1.00 1.21 H new ATOM 0 HB3 ALA A 70 -0.265 12.218 -1.060 1.00 1.21 H new ATOM 1080 N VAL A 71 -1.019 8.344 -0.707 1.00 1.32 N ATOM 1081 CA VAL A 71 -0.568 7.381 0.281 1.00 1.39 C ATOM 1082 C VAL A 71 0.788 7.778 0.848 1.00 1.54 C ATOM 1083 O VAL A 71 1.595 8.394 0.155 1.00 1.63 O ATOM 1084 CB VAL A 71 -0.616 5.937 -0.245 1.00 1.63 C ATOM 1085 CG1 VAL A 71 -0.652 4.920 0.901 1.00 3.14 C ATOM 1086 CG2 VAL A 71 -1.844 5.662 -1.108 1.00 2.22 C ATOM 0 H VAL A 71 -1.193 7.936 -1.626 1.00 1.32 H new ATOM 0 HA VAL A 71 -1.271 7.400 1.114 1.00 1.39 H new ATOM 0 HB VAL A 71 0.290 5.829 -0.841 1.00 1.63 H new ATOM 0 HG11 VAL A 71 -0.686 3.911 0.491 1.00 3.14 H new ATOM 0 HG12 VAL A 71 0.241 5.033 1.515 1.00 3.14 H new ATOM 0 HG13 VAL A 71 -1.537 5.093 1.513 1.00 3.14 H new ATOM 0 HG21 VAL A 71 -1.824 4.627 -1.451 1.00 2.22 H new ATOM 0 HG22 VAL A 71 -2.747 5.832 -0.521 1.00 2.22 H new ATOM 0 HG23 VAL A 71 -1.840 6.330 -1.970 1.00 2.22 H new ATOM 1096 N MET A 72 1.023 7.440 2.119 1.00 1.66 N ATOM 1097 CA MET A 72 2.277 7.751 2.781 1.00 2.00 C ATOM 1098 C MET A 72 3.471 7.125 2.045 1.00 2.32 C ATOM 1099 O MET A 72 4.520 7.756 1.966 1.00 2.69 O ATOM 1100 CB MET A 72 2.202 7.271 4.228 1.00 2.22 C ATOM 1101 CG MET A 72 1.387 8.205 5.127 1.00 2.79 C ATOM 1102 SD MET A 72 1.571 7.843 6.889 1.00 3.61 S ATOM 1103 CE MET A 72 0.671 9.243 7.576 1.00 4.96 C ATOM 0 H MET A 72 0.351 6.947 2.707 1.00 1.66 H new ATOM 0 HA MET A 72 2.433 8.830 2.766 1.00 2.00 H new ATOM 0 HB2 MET A 72 1.760 6.275 4.252 1.00 2.22 H new ATOM 0 HB3 MET A 72 3.212 7.181 4.628 1.00 2.22 H new ATOM 0 HG2 MET A 72 1.692 9.235 4.941 1.00 2.79 H new ATOM 0 HG3 MET A 72 0.334 8.131 4.856 1.00 2.79 H new ATOM 0 HE1 MET A 72 0.357 9.010 8.593 1.00 4.96 H new ATOM 0 HE2 MET A 72 1.317 10.121 7.588 1.00 4.96 H new ATOM 0 HE3 MET A 72 -0.207 9.447 6.963 1.00 4.96 H new ATOM 1201 N GLY A 80 -3.099 -9.021 -1.172 1.00 1.72 N ATOM 1202 CA GLY A 80 -2.140 -9.397 -2.180 1.00 1.84 C ATOM 1203 C GLY A 80 -1.048 -8.353 -2.272 1.00 1.62 C ATOM 1204 O GLY A 80 0.084 -8.699 -2.600 1.00 1.85 O ATOM 0 HA2 GLY A 80 -1.707 -10.367 -1.937 1.00 1.84 H new ATOM 0 HA3 GLY A 80 -2.636 -9.502 -3.145 1.00 1.84 H new ATOM 1208 N ASN A 81 -1.385 -7.090 -1.988 1.00 1.43 N ATOM 1209 CA ASN A 81 -0.560 -5.928 -2.268 1.00 1.41 C ATOM 1210 C ASN A 81 0.184 -5.532 -1.009 1.00 1.55 C ATOM 1211 O ASN A 81 -0.123 -4.515 -0.388 1.00 2.08 O ATOM 1212 CB ASN A 81 -1.426 -4.785 -2.827 1.00 1.38 C ATOM 1213 CG ASN A 81 -0.623 -3.589 -3.343 1.00 1.89 C ATOM 1214 OD1 ASN A 81 -0.719 -3.221 -4.512 1.00 2.81 O ATOM 1215 ND2 ASN A 81 0.217 -2.971 -2.518 1.00 1.90 N ATOM 0 H ASN A 81 -2.270 -6.849 -1.542 1.00 1.43 H new ATOM 0 HA ASN A 81 0.180 -6.164 -3.032 1.00 1.41 H new ATOM 0 HB2 ASN A 81 -2.042 -5.173 -3.638 1.00 1.38 H new ATOM 0 HB3 ASN A 81 -2.106 -4.443 -2.047 1.00 1.38 H new ATOM 0 HD21 ASN A 81 0.782 -2.191 -2.855 1.00 1.90 H new ATOM 0 HD22 ASN A 81 0.296 -3.276 -1.548 1.00 1.90 H new ATOM 1222 N ILE A 82 1.186 -6.318 -0.639 1.00 1.20 N ATOM 1223 CA ILE A 82 1.991 -6.010 0.529 1.00 1.24 C ATOM 1224 C ILE A 82 3.312 -5.412 0.064 1.00 1.16 C ATOM 1225 O ILE A 82 3.741 -5.631 -1.072 1.00 1.11 O ATOM 1226 CB ILE A 82 2.168 -7.225 1.461 1.00 1.29 C ATOM 1227 CG1 ILE A 82 1.321 -8.461 1.115 1.00 1.68 C ATOM 1228 CG2 ILE A 82 1.854 -6.796 2.899 1.00 1.79 C ATOM 1229 CD1 ILE A 82 -0.188 -8.320 1.355 1.00 2.62 C ATOM 0 H ILE A 82 1.458 -7.170 -1.130 1.00 1.20 H new ATOM 0 HA ILE A 82 1.472 -5.273 1.142 1.00 1.24 H new ATOM 0 HB ILE A 82 3.204 -7.539 1.332 1.00 1.29 H new ATOM 0 HG12 ILE A 82 1.482 -8.707 0.065 1.00 1.68 H new ATOM 0 HG13 ILE A 82 1.686 -9.305 1.700 1.00 1.68 H new ATOM 0 HG21 ILE A 82 1.976 -7.648 3.568 1.00 1.79 H new ATOM 0 HG22 ILE A 82 2.535 -6.000 3.198 1.00 1.79 H new ATOM 0 HG23 ILE A 82 0.827 -6.435 2.955 1.00 1.79 H new ATOM 0 HD11 ILE A 82 -0.689 -9.248 1.078 1.00 2.62 H new ATOM 0 HD12 ILE A 82 -0.371 -8.109 2.409 1.00 2.62 H new ATOM 0 HD13 ILE A 82 -0.578 -7.503 0.749 1.00 2.62 H new ATOM 1241 N GLU A 83 3.936 -4.633 0.944 1.00 1.20 N ATOM 1242 CA GLU A 83 5.253 -4.085 0.761 1.00 1.15 C ATOM 1243 C GLU A 83 6.140 -4.600 1.893 1.00 1.09 C ATOM 1244 O GLU A 83 5.664 -4.748 3.022 1.00 1.23 O ATOM 1245 CB GLU A 83 5.144 -2.562 0.702 1.00 1.34 C ATOM 1246 CG GLU A 83 4.781 -1.897 2.032 1.00 1.46 C ATOM 1247 CD GLU A 83 6.009 -1.301 2.704 1.00 1.94 C ATOM 1248 OE1 GLU A 83 7.033 -2.011 2.794 1.00 2.76 O ATOM 1249 OE2 GLU A 83 5.956 -0.094 3.018 1.00 2.72 O ATOM 0 H GLU A 83 3.513 -4.364 1.832 1.00 1.20 H new ATOM 0 HA GLU A 83 5.712 -4.400 -0.176 1.00 1.15 H new ATOM 0 HB2 GLU A 83 6.094 -2.156 0.355 1.00 1.34 H new ATOM 0 HB3 GLU A 83 4.393 -2.293 -0.041 1.00 1.34 H new ATOM 0 HG2 GLU A 83 4.042 -1.115 1.860 1.00 1.46 H new ATOM 0 HG3 GLU A 83 4.321 -2.630 2.694 1.00 1.46 H new ATOM 1256 N LEU A 84 7.395 -4.933 1.586 1.00 0.97 N ATOM 1257 CA LEU A 84 8.396 -5.256 2.590 1.00 0.92 C ATOM 1258 C LEU A 84 9.658 -4.458 2.300 1.00 0.91 C ATOM 1259 O LEU A 84 9.954 -4.191 1.138 1.00 0.96 O ATOM 1260 CB LEU A 84 8.709 -6.756 2.587 1.00 0.88 C ATOM 1261 CG LEU A 84 7.453 -7.637 2.702 1.00 1.33 C ATOM 1262 CD1 LEU A 84 7.118 -8.258 1.346 1.00 2.14 C ATOM 1263 CD2 LEU A 84 7.665 -8.740 3.738 1.00 1.94 C ATOM 0 H LEU A 84 7.742 -4.985 0.628 1.00 0.97 H new ATOM 0 HA LEU A 84 8.010 -4.997 3.576 1.00 0.92 H new ATOM 0 HB2 LEU A 84 9.239 -7.008 1.669 1.00 0.88 H new ATOM 0 HB3 LEU A 84 9.381 -6.982 3.415 1.00 0.88 H new ATOM 0 HG LEU A 84 6.621 -7.009 3.023 1.00 1.33 H new ATOM 0 HD11 LEU A 84 6.227 -8.879 1.440 1.00 2.14 H new ATOM 0 HD12 LEU A 84 6.933 -7.467 0.619 1.00 2.14 H new ATOM 0 HD13 LEU A 84 7.954 -8.871 1.010 1.00 2.14 H new ATOM 0 HD21 LEU A 84 6.766 -9.353 3.806 1.00 1.94 H new ATOM 0 HD22 LEU A 84 8.508 -9.363 3.439 1.00 1.94 H new ATOM 0 HD23 LEU A 84 7.872 -8.292 4.710 1.00 1.94 H new ATOM 1275 N THR A 85 10.415 -4.113 3.339 1.00 0.91 N ATOM 1276 CA THR A 85 11.621 -3.314 3.242 1.00 0.92 C ATOM 1277 C THR A 85 12.823 -4.248 3.230 1.00 0.87 C ATOM 1278 O THR A 85 12.887 -5.168 4.048 1.00 0.86 O ATOM 1279 CB THR A 85 11.658 -2.251 4.355 1.00 1.08 C ATOM 1280 OG1 THR A 85 12.298 -1.067 3.920 1.00 1.65 O ATOM 1281 CG2 THR A 85 12.319 -2.688 5.666 1.00 1.25 C ATOM 0 H THR A 85 10.195 -4.392 4.295 1.00 0.91 H new ATOM 0 HA THR A 85 11.643 -2.749 2.310 1.00 0.92 H new ATOM 0 HB THR A 85 10.603 -2.081 4.569 1.00 1.08 H new ATOM 0 HG1 THR A 85 12.670 -1.206 3.024 1.00 1.65 H new ATOM 0 HG21 THR A 85 12.291 -1.865 6.380 1.00 1.25 H new ATOM 0 HG22 THR A 85 11.782 -3.543 6.077 1.00 1.25 H new ATOM 0 HG23 THR A 85 13.355 -2.968 5.475 1.00 1.25 H new ATOM 1289 N ILE A 86 13.735 -4.053 2.274 1.00 0.88 N ATOM 1290 CA ILE A 86 14.883 -4.928 2.095 1.00 0.87 C ATOM 1291 C ILE A 86 16.113 -4.292 2.723 1.00 0.90 C ATOM 1292 O ILE A 86 16.594 -3.260 2.251 1.00 1.03 O ATOM 1293 CB ILE A 86 15.109 -5.296 0.625 1.00 0.93 C ATOM 1294 CG1 ILE A 86 13.847 -5.990 0.086 1.00 1.49 C ATOM 1295 CG2 ILE A 86 16.328 -6.233 0.537 1.00 2.47 C ATOM 1296 CD1 ILE A 86 14.101 -6.643 -1.269 1.00 2.94 C ATOM 0 H ILE A 86 13.693 -3.283 1.606 1.00 0.88 H new ATOM 0 HA ILE A 86 14.681 -5.869 2.606 1.00 0.87 H new ATOM 0 HB ILE A 86 15.301 -4.406 0.026 1.00 0.93 H new ATOM 0 HG12 ILE A 86 13.514 -6.745 0.798 1.00 1.49 H new ATOM 0 HG13 ILE A 86 13.041 -5.261 -0.006 1.00 1.49 H new ATOM 0 HG21 ILE A 86 16.503 -6.505 -0.504 1.00 2.47 H new ATOM 0 HG22 ILE A 86 17.207 -5.724 0.932 1.00 2.47 H new ATOM 0 HG23 ILE A 86 16.137 -7.134 1.120 1.00 2.47 H new ATOM 0 HD11 ILE A 86 13.187 -7.123 -1.618 1.00 2.94 H new ATOM 0 HD12 ILE A 86 14.409 -5.883 -1.987 1.00 2.94 H new ATOM 0 HD13 ILE A 86 14.889 -7.390 -1.171 1.00 2.94 H new ATOM 1308 N THR A 87 16.635 -4.944 3.760 1.00 0.88 N ATOM 1309 CA THR A 87 17.788 -4.506 4.520 1.00 1.00 C ATOM 1310 C THR A 87 18.987 -5.403 4.195 1.00 1.12 C ATOM 1311 O THR A 87 19.222 -6.407 4.862 1.00 1.79 O ATOM 1312 CB THR A 87 17.414 -4.544 6.007 1.00 1.04 C ATOM 1313 OG1 THR A 87 16.680 -5.720 6.289 1.00 1.83 O ATOM 1314 CG2 THR A 87 16.520 -3.352 6.356 1.00 2.46 C ATOM 0 H THR A 87 16.247 -5.824 4.101 1.00 0.88 H new ATOM 0 HA THR A 87 18.075 -3.487 4.260 1.00 1.00 H new ATOM 0 HB THR A 87 18.336 -4.514 6.588 1.00 1.04 H new ATOM 0 HG1 THR A 87 16.446 -5.739 7.240 1.00 1.83 H new ATOM 0 HG21 THR A 87 16.261 -3.389 7.414 1.00 2.46 H new ATOM 0 HG22 THR A 87 17.052 -2.424 6.145 1.00 2.46 H new ATOM 0 HG23 THR A 87 15.610 -3.392 5.758 1.00 2.46 H new ATOM 1322 N GLY A 88 19.759 -5.037 3.168 1.00 0.90 N ATOM 1323 CA GLY A 88 20.984 -5.748 2.814 1.00 0.94 C ATOM 1324 C GLY A 88 21.298 -5.580 1.334 1.00 0.90 C ATOM 1325 O GLY A 88 22.435 -5.299 0.961 1.00 1.10 O ATOM 0 H GLY A 88 19.551 -4.243 2.563 1.00 0.90 H new ATOM 0 HA2 GLY A 88 21.814 -5.371 3.412 1.00 0.94 H new ATOM 0 HA3 GLY A 88 20.876 -6.807 3.050 1.00 0.94 H new ATOM 1329 N MET A 89 20.280 -5.747 0.485 1.00 0.86 N ATOM 1330 CA MET A 89 20.418 -5.533 -0.945 1.00 0.90 C ATOM 1331 C MET A 89 20.927 -4.112 -1.222 1.00 1.05 C ATOM 1332 O MET A 89 20.452 -3.154 -0.615 1.00 1.32 O ATOM 1333 CB MET A 89 19.057 -5.793 -1.594 1.00 1.16 C ATOM 1334 CG MET A 89 19.005 -5.393 -3.071 1.00 1.77 C ATOM 1335 SD MET A 89 18.366 -3.739 -3.403 1.00 2.10 S ATOM 1336 CE MET A 89 16.618 -3.981 -3.015 1.00 2.01 C ATOM 0 H MET A 89 19.345 -6.033 0.775 1.00 0.86 H new ATOM 0 HA MET A 89 21.152 -6.217 -1.372 1.00 0.90 H new ATOM 0 HB2 MET A 89 18.815 -6.852 -1.503 1.00 1.16 H new ATOM 0 HB3 MET A 89 18.291 -5.242 -1.048 1.00 1.16 H new ATOM 0 HG2 MET A 89 20.011 -5.465 -3.485 1.00 1.77 H new ATOM 0 HG3 MET A 89 18.388 -6.116 -3.604 1.00 1.77 H new ATOM 0 HE1 MET A 89 16.040 -3.140 -3.399 1.00 2.01 H new ATOM 0 HE2 MET A 89 16.267 -4.904 -3.477 1.00 2.01 H new ATOM 0 HE3 MET A 89 16.491 -4.045 -1.934 1.00 2.01 H new ATOM 1346 N THR A 90 21.883 -3.979 -2.150 1.00 1.09 N ATOM 1347 CA THR A 90 22.421 -2.688 -2.559 1.00 1.44 C ATOM 1348 C THR A 90 23.065 -2.779 -3.950 1.00 1.31 C ATOM 1349 O THR A 90 24.060 -2.104 -4.211 1.00 1.52 O ATOM 1350 CB THR A 90 23.390 -2.160 -1.478 1.00 1.96 C ATOM 1351 OG1 THR A 90 23.890 -0.887 -1.834 1.00 2.88 O ATOM 1352 CG2 THR A 90 24.575 -3.101 -1.221 1.00 1.87 C ATOM 0 H THR A 90 22.303 -4.771 -2.637 1.00 1.09 H new ATOM 0 HA THR A 90 21.610 -1.965 -2.648 1.00 1.44 H new ATOM 0 HB THR A 90 22.806 -2.097 -0.560 1.00 1.96 H new ATOM 0 HG1 THR A 90 24.150 -0.890 -2.779 1.00 2.88 H new ATOM 0 HG21 THR A 90 25.219 -2.674 -0.452 1.00 1.87 H new ATOM 0 HG22 THR A 90 24.204 -4.070 -0.887 1.00 1.87 H new ATOM 0 HG23 THR A 90 25.145 -3.228 -2.141 1.00 1.87 H new ATOM 1360 N CYS A 91 22.518 -3.601 -4.856 1.00 1.22 N ATOM 1361 CA CYS A 91 23.063 -3.739 -6.203 1.00 1.34 C ATOM 1362 C CYS A 91 22.007 -4.294 -7.156 1.00 1.18 C ATOM 1363 O CYS A 91 21.200 -5.136 -6.758 1.00 1.08 O ATOM 1364 CB CYS A 91 24.286 -4.660 -6.195 1.00 1.83 C ATOM 1365 SG CYS A 91 25.061 -4.559 -7.826 1.00 2.61 S ATOM 0 H CYS A 91 21.697 -4.179 -4.675 1.00 1.22 H new ATOM 0 HA CYS A 91 23.365 -2.750 -6.548 1.00 1.34 H new ATOM 0 HB2 CYS A 91 24.988 -4.357 -5.418 1.00 1.83 H new ATOM 0 HB3 CYS A 91 23.991 -5.686 -5.975 1.00 1.83 H new ATOM 0 HG CYS A 91 26.108 -5.329 -7.857 1.00 2.61 H new ATOM 1371 N ALA A 92 22.013 -3.836 -8.412 1.00 1.45 N ATOM 1372 CA ALA A 92 21.080 -4.266 -9.443 1.00 1.84 C ATOM 1373 C ALA A 92 20.997 -5.791 -9.541 1.00 1.45 C ATOM 1374 O ALA A 92 19.913 -6.341 -9.711 1.00 1.59 O ATOM 1375 CB ALA A 92 21.484 -3.659 -10.789 1.00 2.63 C ATOM 0 H ALA A 92 22.683 -3.141 -8.741 1.00 1.45 H new ATOM 0 HA ALA A 92 20.087 -3.910 -9.169 1.00 1.84 H new ATOM 0 HB1 ALA A 92 20.784 -3.983 -11.559 1.00 2.63 H new ATOM 0 HB2 ALA A 92 21.467 -2.571 -10.717 1.00 2.63 H new ATOM 0 HB3 ALA A 92 22.489 -3.990 -11.050 1.00 2.63 H new ATOM 1381 N SER A 93 22.129 -6.488 -9.405 1.00 1.36 N ATOM 1382 CA SER A 93 22.148 -7.943 -9.401 1.00 1.55 C ATOM 1383 C SER A 93 21.175 -8.495 -8.356 1.00 1.28 C ATOM 1384 O SER A 93 20.394 -9.402 -8.637 1.00 1.32 O ATOM 1385 CB SER A 93 23.579 -8.419 -9.132 1.00 1.99 C ATOM 1386 OG SER A 93 24.134 -7.704 -8.041 1.00 3.46 O ATOM 0 H SER A 93 23.048 -6.058 -9.296 1.00 1.36 H new ATOM 0 HA SER A 93 21.824 -8.316 -10.372 1.00 1.55 H new ATOM 0 HB2 SER A 93 23.580 -9.487 -8.915 1.00 1.99 H new ATOM 0 HB3 SER A 93 24.192 -8.274 -10.021 1.00 1.99 H new ATOM 0 HG SER A 93 24.432 -6.822 -8.346 1.00 3.46 H new ATOM 1392 N CYS A 94 21.212 -7.933 -7.147 1.00 1.08 N ATOM 1393 CA CYS A 94 20.407 -8.410 -6.032 1.00 0.95 C ATOM 1394 C CYS A 94 18.938 -8.126 -6.326 1.00 0.83 C ATOM 1395 O CYS A 94 18.095 -9.005 -6.175 1.00 0.78 O ATOM 1396 CB CYS A 94 20.850 -7.740 -4.730 1.00 0.95 C ATOM 1397 SG CYS A 94 22.440 -8.392 -4.177 1.00 1.82 S ATOM 0 H CYS A 94 21.803 -7.134 -6.918 1.00 1.08 H new ATOM 0 HA CYS A 94 20.543 -9.485 -5.910 1.00 0.95 H new ATOM 0 HB2 CYS A 94 20.926 -6.663 -4.878 1.00 0.95 H new ATOM 0 HB3 CYS A 94 20.098 -7.903 -3.958 1.00 0.95 H new ATOM 0 HG CYS A 94 22.274 -9.066 -3.078 1.00 1.82 H new ATOM 1403 N VAL A 95 18.640 -6.908 -6.789 1.00 0.86 N ATOM 1404 CA VAL A 95 17.306 -6.501 -7.218 1.00 0.87 C ATOM 1405 C VAL A 95 16.761 -7.513 -8.230 1.00 0.91 C ATOM 1406 O VAL A 95 15.644 -8.009 -8.091 1.00 0.85 O ATOM 1407 CB VAL A 95 17.366 -5.086 -7.830 1.00 1.08 C ATOM 1408 CG1 VAL A 95 15.987 -4.605 -8.296 1.00 1.15 C ATOM 1409 CG2 VAL A 95 17.904 -4.051 -6.835 1.00 1.63 C ATOM 0 H VAL A 95 19.335 -6.166 -6.876 1.00 0.86 H new ATOM 0 HA VAL A 95 16.635 -6.476 -6.360 1.00 0.87 H new ATOM 0 HB VAL A 95 18.041 -5.168 -8.682 1.00 1.08 H new ATOM 0 HG11 VAL A 95 16.075 -3.605 -8.720 1.00 1.15 H new ATOM 0 HG12 VAL A 95 15.600 -5.287 -9.053 1.00 1.15 H new ATOM 0 HG13 VAL A 95 15.304 -4.580 -7.447 1.00 1.15 H new ATOM 0 HG21 VAL A 95 17.929 -3.070 -7.309 1.00 1.63 H new ATOM 0 HG22 VAL A 95 17.255 -4.015 -5.960 1.00 1.63 H new ATOM 0 HG23 VAL A 95 18.912 -4.331 -6.528 1.00 1.63 H new ATOM 1419 N HIS A 96 17.569 -7.836 -9.244 1.00 1.10 N ATOM 1420 CA HIS A 96 17.169 -8.728 -10.320 1.00 1.19 C ATOM 1421 C HIS A 96 16.917 -10.119 -9.738 1.00 1.10 C ATOM 1422 O HIS A 96 15.989 -10.818 -10.131 1.00 1.10 O ATOM 1423 CB HIS A 96 18.264 -8.737 -11.397 1.00 1.41 C ATOM 1424 CG HIS A 96 17.823 -9.111 -12.792 1.00 1.96 C ATOM 1425 ND1 HIS A 96 18.539 -8.840 -13.937 1.00 2.84 N ATOM 1426 CD2 HIS A 96 16.630 -9.669 -13.179 1.00 2.58 C ATOM 1427 CE1 HIS A 96 17.800 -9.235 -14.987 1.00 3.27 C ATOM 1428 NE2 HIS A 96 16.632 -9.752 -14.574 1.00 3.20 N ATOM 0 H HIS A 96 18.521 -7.481 -9.336 1.00 1.10 H new ATOM 0 HA HIS A 96 16.246 -8.389 -10.790 1.00 1.19 H new ATOM 0 HB2 HIS A 96 18.716 -7.746 -11.435 1.00 1.41 H new ATOM 0 HB3 HIS A 96 19.044 -9.432 -11.086 1.00 1.41 H new ATOM 0 HD2 HIS A 96 15.833 -9.987 -12.523 1.00 2.58 H new ATOM 0 HE1 HIS A 96 18.103 -9.149 -16.020 1.00 3.27 H new ATOM 0 HE2 HIS A 96 15.891 -10.131 -15.163 1.00 3.20 H new ATOM 1436 N ASN A 97 17.740 -10.511 -8.767 1.00 1.06 N ATOM 1437 CA ASN A 97 17.588 -11.759 -8.038 1.00 1.05 C ATOM 1438 C ASN A 97 16.239 -11.797 -7.327 1.00 0.82 C ATOM 1439 O ASN A 97 15.481 -12.749 -7.488 1.00 0.80 O ATOM 1440 CB ASN A 97 18.724 -11.916 -7.023 1.00 1.26 C ATOM 1441 CG ASN A 97 19.240 -13.341 -6.905 1.00 1.19 C ATOM 1442 OD1 ASN A 97 18.567 -14.318 -7.235 1.00 1.72 O ATOM 1443 ND2 ASN A 97 20.478 -13.450 -6.439 1.00 2.12 N ATOM 0 H ASN A 97 18.542 -9.959 -8.464 1.00 1.06 H new ATOM 0 HA ASN A 97 17.631 -12.586 -8.747 1.00 1.05 H new ATOM 0 HB2 ASN A 97 19.548 -11.262 -7.308 1.00 1.26 H new ATOM 0 HB3 ASN A 97 18.376 -11.582 -6.046 1.00 1.26 H new ATOM 0 HD21 ASN A 97 20.907 -14.370 -6.343 1.00 2.12 H new ATOM 0 HD22 ASN A 97 21.000 -12.614 -6.177 1.00 2.12 H new ATOM 1450 N ILE A 98 15.930 -10.764 -6.542 1.00 0.72 N ATOM 1451 CA ILE A 98 14.661 -10.634 -5.843 1.00 0.70 C ATOM 1452 C ILE A 98 13.522 -10.760 -6.851 1.00 0.72 C ATOM 1453 O ILE A 98 12.661 -11.625 -6.697 1.00 0.75 O ATOM 1454 CB ILE A 98 14.663 -9.313 -5.046 1.00 0.77 C ATOM 1455 CG1 ILE A 98 15.513 -9.505 -3.781 1.00 0.91 C ATOM 1456 CG2 ILE A 98 13.260 -8.859 -4.629 1.00 1.06 C ATOM 1457 CD1 ILE A 98 16.275 -8.239 -3.392 1.00 0.85 C ATOM 0 H ILE A 98 16.567 -9.985 -6.375 1.00 0.72 H new ATOM 0 HA ILE A 98 14.512 -11.432 -5.115 1.00 0.70 H new ATOM 0 HB ILE A 98 15.072 -8.542 -5.698 1.00 0.77 H new ATOM 0 HG12 ILE A 98 14.868 -9.805 -2.955 1.00 0.91 H new ATOM 0 HG13 ILE A 98 16.222 -10.317 -3.943 1.00 0.91 H new ATOM 0 HG21 ILE A 98 13.330 -7.925 -4.072 1.00 1.06 H new ATOM 0 HG22 ILE A 98 12.648 -8.707 -5.518 1.00 1.06 H new ATOM 0 HG23 ILE A 98 12.802 -9.623 -4.000 1.00 1.06 H new ATOM 0 HD11 ILE A 98 16.860 -8.428 -2.492 1.00 0.85 H new ATOM 0 HD12 ILE A 98 16.942 -7.952 -4.205 1.00 0.85 H new ATOM 0 HD13 ILE A 98 15.567 -7.432 -3.202 1.00 0.85 H new ATOM 1469 N GLU A 99 13.540 -9.949 -7.911 1.00 0.80 N ATOM 1470 CA GLU A 99 12.490 -9.980 -8.913 1.00 0.92 C ATOM 1471 C GLU A 99 12.382 -11.381 -9.505 1.00 0.93 C ATOM 1472 O GLU A 99 11.283 -11.913 -9.596 1.00 0.99 O ATOM 1473 CB GLU A 99 12.680 -8.904 -9.989 1.00 1.08 C ATOM 1474 CG GLU A 99 11.373 -8.147 -10.258 1.00 1.36 C ATOM 1475 CD GLU A 99 11.243 -7.787 -11.730 1.00 2.07 C ATOM 1476 OE1 GLU A 99 10.892 -8.712 -12.494 1.00 3.13 O ATOM 1477 OE2 GLU A 99 11.522 -6.615 -12.059 1.00 2.40 O ATOM 0 H GLU A 99 14.274 -9.264 -8.091 1.00 0.80 H new ATOM 0 HA GLU A 99 11.544 -9.741 -8.426 1.00 0.92 H new ATOM 0 HB2 GLU A 99 13.451 -8.202 -9.672 1.00 1.08 H new ATOM 0 HB3 GLU A 99 13.031 -9.367 -10.911 1.00 1.08 H new ATOM 0 HG2 GLU A 99 10.525 -8.760 -9.954 1.00 1.36 H new ATOM 0 HG3 GLU A 99 11.343 -7.240 -9.654 1.00 1.36 H new ATOM 1484 N SER A 100 13.509 -12.012 -9.846 1.00 0.92 N ATOM 1485 CA SER A 100 13.547 -13.386 -10.328 1.00 1.00 C ATOM 1486 C SER A 100 12.855 -14.325 -9.334 1.00 0.88 C ATOM 1487 O SER A 100 12.015 -15.133 -9.719 1.00 1.01 O ATOM 1488 CB SER A 100 14.999 -13.807 -10.605 1.00 1.13 C ATOM 1489 OG SER A 100 15.089 -15.177 -10.955 1.00 1.82 O ATOM 0 H SER A 100 14.429 -11.574 -9.793 1.00 0.92 H new ATOM 0 HA SER A 100 12.998 -13.453 -11.267 1.00 1.00 H new ATOM 0 HB2 SER A 100 15.407 -13.198 -11.411 1.00 1.13 H new ATOM 0 HB3 SER A 100 15.608 -13.616 -9.722 1.00 1.13 H new ATOM 0 HG SER A 100 16.025 -15.410 -11.126 1.00 1.82 H new ATOM 1495 N LYS A 101 13.198 -14.238 -8.047 1.00 0.74 N ATOM 1496 CA LYS A 101 12.629 -15.095 -7.025 1.00 0.73 C ATOM 1497 C LYS A 101 11.128 -14.855 -6.873 1.00 0.75 C ATOM 1498 O LYS A 101 10.378 -15.788 -6.601 1.00 0.78 O ATOM 1499 CB LYS A 101 13.364 -14.890 -5.696 1.00 0.77 C ATOM 1500 CG LYS A 101 14.506 -15.900 -5.530 1.00 0.94 C ATOM 1501 CD LYS A 101 15.730 -15.498 -6.355 1.00 1.14 C ATOM 1502 CE LYS A 101 16.807 -16.592 -6.307 1.00 1.80 C ATOM 1503 NZ LYS A 101 17.179 -17.025 -7.667 1.00 2.57 N ATOM 0 H LYS A 101 13.880 -13.568 -7.692 1.00 0.74 H new ATOM 0 HA LYS A 101 12.759 -16.132 -7.333 1.00 0.73 H new ATOM 0 HB2 LYS A 101 13.762 -13.876 -5.651 1.00 0.77 H new ATOM 0 HB3 LYS A 101 12.661 -14.993 -4.869 1.00 0.77 H new ATOM 0 HG2 LYS A 101 14.782 -15.970 -4.478 1.00 0.94 H new ATOM 0 HG3 LYS A 101 14.167 -16.889 -5.838 1.00 0.94 H new ATOM 0 HD2 LYS A 101 15.434 -15.319 -7.389 1.00 1.14 H new ATOM 0 HD3 LYS A 101 16.139 -14.562 -5.974 1.00 1.14 H new ATOM 0 HE2 LYS A 101 17.688 -16.217 -5.787 1.00 1.80 H new ATOM 0 HE3 LYS A 101 16.439 -17.445 -5.737 1.00 1.80 H new ATOM 0 HZ1 LYS A 101 17.690 -17.929 -7.616 1.00 2.57 H new ATOM 0 HZ2 LYS A 101 16.320 -17.145 -8.240 1.00 2.57 H new ATOM 0 HZ3 LYS A 101 17.790 -16.306 -8.105 1.00 2.57 H new ATOM 1517 N LEU A 102 10.690 -13.611 -7.044 1.00 0.87 N ATOM 1518 CA LEU A 102 9.291 -13.254 -6.934 1.00 1.06 C ATOM 1519 C LEU A 102 8.548 -13.809 -8.139 1.00 1.06 C ATOM 1520 O LEU A 102 7.636 -14.622 -7.991 1.00 1.09 O ATOM 1521 CB LEU A 102 9.184 -11.735 -6.820 1.00 1.32 C ATOM 1522 CG LEU A 102 9.766 -11.259 -5.480 1.00 1.05 C ATOM 1523 CD1 LEU A 102 10.143 -9.793 -5.616 1.00 1.80 C ATOM 1524 CD2 LEU A 102 8.778 -11.404 -4.328 1.00 1.46 C ATOM 0 H LEU A 102 11.302 -12.825 -7.263 1.00 0.87 H new ATOM 0 HA LEU A 102 8.834 -13.684 -6.043 1.00 1.06 H new ATOM 0 HB2 LEU A 102 9.718 -11.263 -7.645 1.00 1.32 H new ATOM 0 HB3 LEU A 102 8.141 -11.430 -6.900 1.00 1.32 H new ATOM 0 HG LEU A 102 10.631 -11.881 -5.251 1.00 1.05 H new ATOM 0 HD11 LEU A 102 10.559 -9.435 -4.674 1.00 1.80 H new ATOM 0 HD12 LEU A 102 10.885 -9.680 -6.406 1.00 1.80 H new ATOM 0 HD13 LEU A 102 9.256 -9.211 -5.865 1.00 1.80 H new ATOM 0 HD21 LEU A 102 9.241 -11.053 -3.406 1.00 1.46 H new ATOM 0 HD22 LEU A 102 7.887 -10.811 -4.536 1.00 1.46 H new ATOM 0 HD23 LEU A 102 8.499 -12.452 -4.218 1.00 1.46 H new ATOM 1536 N THR A 103 8.968 -13.414 -9.340 1.00 1.10 N ATOM 1537 CA THR A 103 8.395 -13.938 -10.575 1.00 1.19 C ATOM 1538 C THR A 103 8.483 -15.470 -10.643 1.00 1.13 C ATOM 1539 O THR A 103 7.697 -16.096 -11.347 1.00 1.23 O ATOM 1540 CB THR A 103 9.039 -13.274 -11.800 1.00 1.32 C ATOM 1541 OG1 THR A 103 10.442 -13.321 -11.729 1.00 2.38 O ATOM 1542 CG2 THR A 103 8.612 -11.810 -11.947 1.00 1.61 C ATOM 0 H THR A 103 9.709 -12.727 -9.482 1.00 1.10 H new ATOM 0 HA THR A 103 7.334 -13.687 -10.580 1.00 1.19 H new ATOM 0 HB THR A 103 8.694 -13.838 -12.667 1.00 1.32 H new ATOM 0 HG1 THR A 103 10.761 -12.639 -11.102 1.00 2.38 H new ATOM 0 HG21 THR A 103 9.090 -11.378 -12.826 1.00 1.61 H new ATOM 0 HG22 THR A 103 7.529 -11.756 -12.060 1.00 1.61 H new ATOM 0 HG23 THR A 103 8.912 -11.253 -11.060 1.00 1.61 H new ATOM 1550 N ARG A 104 9.412 -16.082 -9.900 1.00 1.03 N ATOM 1551 CA ARG A 104 9.497 -17.539 -9.799 1.00 1.06 C ATOM 1552 C ARG A 104 8.260 -18.180 -9.155 1.00 1.09 C ATOM 1553 O ARG A 104 8.014 -19.362 -9.395 1.00 1.25 O ATOM 1554 CB ARG A 104 10.760 -17.968 -9.034 1.00 1.06 C ATOM 1555 CG ARG A 104 11.834 -18.543 -9.960 1.00 1.56 C ATOM 1556 CD ARG A 104 13.162 -18.702 -9.205 1.00 2.35 C ATOM 1557 NE ARG A 104 13.898 -19.900 -9.651 1.00 3.13 N ATOM 1558 CZ ARG A 104 13.972 -21.079 -9.004 1.00 3.68 C ATOM 1559 NH1 ARG A 104 13.309 -21.271 -7.857 1.00 3.90 N ATOM 1560 NH2 ARG A 104 14.719 -22.068 -9.509 1.00 4.79 N ATOM 0 H ARG A 104 10.119 -15.585 -9.358 1.00 1.03 H new ATOM 0 HA ARG A 104 9.549 -17.901 -10.826 1.00 1.06 H new ATOM 0 HB2 ARG A 104 11.167 -17.110 -8.499 1.00 1.06 H new ATOM 0 HB3 ARG A 104 10.493 -18.713 -8.285 1.00 1.06 H new ATOM 0 HG2 ARG A 104 11.510 -19.509 -10.347 1.00 1.56 H new ATOM 0 HG3 ARG A 104 11.973 -17.886 -10.819 1.00 1.56 H new ATOM 0 HD2 ARG A 104 13.778 -17.816 -9.360 1.00 2.35 H new ATOM 0 HD3 ARG A 104 12.967 -18.771 -8.135 1.00 2.35 H new ATOM 0 HE ARG A 104 14.400 -19.829 -10.536 1.00 3.13 H new ATOM 0 HH11 ARG A 104 12.741 -20.520 -7.465 1.00 3.90 H new ATOM 0 HH12 ARG A 104 13.372 -22.168 -7.375 1.00 3.90 H new ATOM 0 HH21 ARG A 104 15.230 -21.927 -10.381 1.00 4.79 H new ATOM 0 HH22 ARG A 104 14.778 -22.962 -9.022 1.00 4.79 H new ATOM 1574 N THR A 105 7.522 -17.478 -8.290 1.00 1.00 N ATOM 1575 CA THR A 105 6.372 -18.031 -7.631 1.00 1.09 C ATOM 1576 C THR A 105 5.224 -18.261 -8.618 1.00 1.24 C ATOM 1577 O THR A 105 5.266 -17.842 -9.771 1.00 1.61 O ATOM 1578 CB THR A 105 5.962 -17.038 -6.548 1.00 1.07 C ATOM 1579 OG1 THR A 105 5.382 -15.895 -7.123 1.00 2.50 O ATOM 1580 CG2 THR A 105 7.057 -16.662 -5.543 1.00 2.63 C ATOM 0 H THR A 105 7.719 -16.510 -8.038 1.00 1.00 H new ATOM 0 HA THR A 105 6.611 -19.003 -7.199 1.00 1.09 H new ATOM 0 HB THR A 105 5.223 -17.567 -5.947 1.00 1.07 H new ATOM 0 HG1 THR A 105 6.088 -15.283 -7.417 1.00 2.50 H new ATOM 0 HG21 THR A 105 6.658 -15.952 -4.819 1.00 2.63 H new ATOM 0 HG22 THR A 105 7.397 -17.558 -5.023 1.00 2.63 H new ATOM 0 HG23 THR A 105 7.896 -16.209 -6.071 1.00 2.63 H new ATOM 1588 N ASN A 106 4.171 -18.912 -8.123 1.00 1.09 N ATOM 1589 CA ASN A 106 2.925 -19.103 -8.848 1.00 1.15 C ATOM 1590 C ASN A 106 1.978 -17.925 -8.596 1.00 1.12 C ATOM 1591 O ASN A 106 1.376 -17.402 -9.527 1.00 1.09 O ATOM 1592 CB ASN A 106 2.321 -20.438 -8.404 1.00 1.33 C ATOM 1593 CG ASN A 106 0.844 -20.545 -8.752 1.00 2.15 C ATOM 1594 OD1 ASN A 106 -0.007 -20.455 -7.737 1.00 3.98 O flip ATOM 1595 ND2 ASN A 106 0.474 -20.717 -9.907 1.00 2.00 N flip ATOM 0 H ASN A 106 4.165 -19.326 -7.191 1.00 1.09 H new ATOM 0 HA ASN A 106 3.101 -19.135 -9.923 1.00 1.15 H new ATOM 0 HB2 ASN A 106 2.864 -21.256 -8.877 1.00 1.33 H new ATOM 0 HB3 ASN A 106 2.448 -20.552 -7.327 1.00 1.33 H new ATOM 0 HD21 ASN A 106 1.161 -20.781 -10.658 1.00 2.00 H new ATOM 0 HD22 ASN A 106 -0.521 -20.797 -10.117 1.00 2.00 H new ATOM 1602 N GLY A 107 1.817 -17.530 -7.329 1.00 1.17 N ATOM 1603 CA GLY A 107 0.800 -16.564 -6.938 1.00 1.19 C ATOM 1604 C GLY A 107 1.149 -15.124 -7.311 1.00 1.08 C ATOM 1605 O GLY A 107 0.248 -14.333 -7.574 1.00 1.09 O ATOM 0 H GLY A 107 2.386 -17.871 -6.555 1.00 1.17 H new ATOM 0 HA2 GLY A 107 -0.145 -16.834 -7.409 1.00 1.19 H new ATOM 0 HA3 GLY A 107 0.648 -16.625 -5.860 1.00 1.19 H new ATOM 1609 N ILE A 108 2.429 -14.734 -7.278 1.00 1.03 N ATOM 1610 CA ILE A 108 2.769 -13.344 -7.558 1.00 0.92 C ATOM 1611 C ILE A 108 2.532 -13.056 -9.040 1.00 0.96 C ATOM 1612 O ILE A 108 2.934 -13.850 -9.887 1.00 1.04 O ATOM 1613 CB ILE A 108 4.193 -13.007 -7.076 1.00 0.91 C ATOM 1614 CG1 ILE A 108 4.226 -11.834 -6.091 1.00 0.95 C ATOM 1615 CG2 ILE A 108 5.189 -12.742 -8.218 1.00 1.09 C ATOM 1616 CD1 ILE A 108 5.588 -11.799 -5.396 1.00 2.34 C ATOM 0 H ILE A 108 3.220 -15.343 -7.067 1.00 1.03 H new ATOM 0 HA ILE A 108 2.116 -12.679 -6.992 1.00 0.92 H new ATOM 0 HB ILE A 108 4.514 -13.911 -6.558 1.00 0.91 H new ATOM 0 HG12 ILE A 108 4.049 -10.896 -6.618 1.00 0.95 H new ATOM 0 HG13 ILE A 108 3.431 -11.940 -5.353 1.00 0.95 H new ATOM 0 HG21 ILE A 108 6.169 -12.512 -7.800 1.00 1.09 H new ATOM 0 HG22 ILE A 108 5.263 -13.628 -8.849 1.00 1.09 H new ATOM 0 HG23 ILE A 108 4.842 -11.899 -8.815 1.00 1.09 H new ATOM 0 HD11 ILE A 108 5.617 -10.966 -4.694 1.00 2.34 H new ATOM 0 HD12 ILE A 108 5.746 -12.733 -4.857 1.00 2.34 H new ATOM 0 HD13 ILE A 108 6.374 -11.673 -6.141 1.00 2.34 H new ATOM 1628 N THR A 109 1.904 -11.921 -9.354 1.00 0.98 N ATOM 1629 CA THR A 109 1.678 -11.508 -10.737 1.00 1.08 C ATOM 1630 C THR A 109 2.613 -10.381 -11.145 1.00 1.04 C ATOM 1631 O THR A 109 3.179 -10.419 -12.237 1.00 1.11 O ATOM 1632 CB THR A 109 0.185 -11.213 -10.988 1.00 1.30 C ATOM 1633 OG1 THR A 109 -0.022 -10.579 -12.237 1.00 2.81 O ATOM 1634 CG2 THR A 109 -0.470 -10.376 -9.885 1.00 2.34 C ATOM 0 H THR A 109 1.541 -11.267 -8.660 1.00 0.98 H new ATOM 0 HA THR A 109 1.931 -12.339 -11.396 1.00 1.08 H new ATOM 0 HB THR A 109 -0.295 -12.191 -10.989 1.00 1.30 H new ATOM 0 HG1 THR A 109 -0.979 -10.409 -12.363 1.00 2.81 H new ATOM 0 HG21 THR A 109 -1.519 -10.209 -10.130 1.00 2.34 H new ATOM 0 HG22 THR A 109 -0.399 -10.906 -8.935 1.00 2.34 H new ATOM 0 HG23 THR A 109 0.041 -9.417 -9.804 1.00 2.34 H new ATOM 1642 N TYR A 110 2.783 -9.373 -10.294 1.00 1.05 N ATOM 1643 CA TYR A 110 3.695 -8.286 -10.580 1.00 1.16 C ATOM 1644 C TYR A 110 4.400 -7.958 -9.282 1.00 1.10 C ATOM 1645 O TYR A 110 3.721 -7.712 -8.290 1.00 1.18 O ATOM 1646 CB TYR A 110 2.946 -7.111 -11.240 1.00 1.45 C ATOM 1647 CG TYR A 110 2.027 -6.200 -10.426 1.00 1.09 C ATOM 1648 CD1 TYR A 110 0.638 -6.457 -10.343 1.00 1.91 C ATOM 1649 CD2 TYR A 110 2.518 -4.953 -9.991 1.00 1.77 C ATOM 1650 CE1 TYR A 110 -0.233 -5.513 -9.747 1.00 2.09 C ATOM 1651 CE2 TYR A 110 1.651 -4.006 -9.415 1.00 1.75 C ATOM 1652 CZ TYR A 110 0.278 -4.280 -9.299 1.00 1.35 C ATOM 1653 OH TYR A 110 -0.479 -3.485 -8.491 1.00 1.71 O ATOM 0 H TYR A 110 2.297 -9.293 -9.401 1.00 1.05 H new ATOM 0 HA TYR A 110 4.455 -8.553 -11.314 1.00 1.16 H new ATOM 0 HB2 TYR A 110 3.699 -6.473 -11.702 1.00 1.45 H new ATOM 0 HB3 TYR A 110 2.345 -7.530 -12.047 1.00 1.45 H new ATOM 0 HD1 TYR A 110 0.239 -7.380 -10.737 1.00 1.91 H new ATOM 0 HD2 TYR A 110 3.567 -4.722 -10.100 1.00 1.77 H new ATOM 0 HE1 TYR A 110 -1.284 -5.738 -9.637 1.00 2.09 H new ATOM 0 HE2 TYR A 110 2.043 -3.064 -9.060 1.00 1.75 H new ATOM 0 HH TYR A 110 0.021 -2.671 -8.272 1.00 1.71 H new ATOM 1663 N ALA A 111 5.734 -8.014 -9.245 1.00 1.02 N ATOM 1664 CA ALA A 111 6.447 -7.391 -8.144 1.00 0.93 C ATOM 1665 C ALA A 111 7.326 -6.267 -8.670 1.00 1.11 C ATOM 1666 O ALA A 111 7.869 -6.369 -9.766 1.00 1.43 O ATOM 1667 CB ALA A 111 7.234 -8.429 -7.363 1.00 0.73 C ATOM 0 H ALA A 111 6.320 -8.470 -9.944 1.00 1.02 H new ATOM 0 HA ALA A 111 5.733 -6.951 -7.448 1.00 0.93 H new ATOM 0 HB1 ALA A 111 7.762 -7.944 -6.542 1.00 0.73 H new ATOM 0 HB2 ALA A 111 6.551 -9.178 -6.963 1.00 0.73 H new ATOM 0 HB3 ALA A 111 7.955 -8.911 -8.023 1.00 0.73 H new ATOM 1673 N SER A 112 7.438 -5.193 -7.891 1.00 1.02 N ATOM 1674 CA SER A 112 8.261 -4.040 -8.215 1.00 1.04 C ATOM 1675 C SER A 112 9.051 -3.691 -6.964 1.00 0.93 C ATOM 1676 O SER A 112 8.449 -3.427 -5.926 1.00 0.96 O ATOM 1677 CB SER A 112 7.369 -2.873 -8.653 1.00 1.16 C ATOM 1678 OG SER A 112 6.566 -3.259 -9.752 1.00 1.93 O ATOM 0 H SER A 112 6.948 -5.103 -7.001 1.00 1.02 H new ATOM 0 HA SER A 112 8.942 -4.254 -9.039 1.00 1.04 H new ATOM 0 HB2 SER A 112 6.736 -2.558 -7.823 1.00 1.16 H new ATOM 0 HB3 SER A 112 7.986 -2.017 -8.926 1.00 1.16 H new ATOM 0 HG SER A 112 5.999 -2.507 -10.023 1.00 1.93 H new ATOM 1684 N VAL A 113 10.381 -3.723 -7.043 1.00 0.87 N ATOM 1685 CA VAL A 113 11.260 -3.447 -5.921 1.00 0.81 C ATOM 1686 C VAL A 113 12.188 -2.297 -6.287 1.00 0.96 C ATOM 1687 O VAL A 113 12.726 -2.261 -7.391 1.00 1.09 O ATOM 1688 CB VAL A 113 11.978 -4.733 -5.474 1.00 0.68 C ATOM 1689 CG1 VAL A 113 12.568 -5.517 -6.655 1.00 1.83 C ATOM 1690 CG2 VAL A 113 13.065 -4.440 -4.431 1.00 1.90 C ATOM 0 H VAL A 113 10.880 -3.945 -7.904 1.00 0.87 H new ATOM 0 HA VAL A 113 10.692 -3.121 -5.049 1.00 0.81 H new ATOM 0 HB VAL A 113 11.216 -5.361 -5.012 1.00 0.68 H new ATOM 0 HG11 VAL A 113 13.063 -6.415 -6.285 1.00 1.83 H new ATOM 0 HG12 VAL A 113 11.768 -5.800 -7.340 1.00 1.83 H new ATOM 0 HG13 VAL A 113 13.292 -4.894 -7.180 1.00 1.83 H new ATOM 0 HG21 VAL A 113 13.550 -5.372 -4.139 1.00 1.90 H new ATOM 0 HG22 VAL A 113 13.806 -3.763 -4.858 1.00 1.90 H new ATOM 0 HG23 VAL A 113 12.613 -3.977 -3.554 1.00 1.90 H new ATOM 1700 N ALA A 114 12.324 -1.334 -5.371 1.00 1.01 N ATOM 1701 CA ALA A 114 13.012 -0.082 -5.620 1.00 1.18 C ATOM 1702 C ALA A 114 14.057 0.143 -4.529 1.00 1.16 C ATOM 1703 O ALA A 114 13.759 0.603 -3.425 1.00 1.22 O ATOM 1704 CB ALA A 114 11.982 1.045 -5.725 1.00 1.34 C ATOM 0 H ALA A 114 11.951 -1.412 -4.425 1.00 1.01 H new ATOM 0 HA ALA A 114 13.549 -0.106 -6.568 1.00 1.18 H new ATOM 0 HB1 ALA A 114 12.494 1.989 -5.912 1.00 1.34 H new ATOM 0 HB2 ALA A 114 11.296 0.835 -6.545 1.00 1.34 H new ATOM 0 HB3 ALA A 114 11.422 1.114 -4.792 1.00 1.34 H new ATOM 1710 N LEU A 115 15.308 -0.169 -4.874 1.00 1.18 N ATOM 1711 CA LEU A 115 16.480 -0.032 -4.029 1.00 1.20 C ATOM 1712 C LEU A 115 16.683 1.382 -3.482 1.00 1.25 C ATOM 1713 O LEU A 115 17.336 1.549 -2.457 1.00 1.35 O ATOM 1714 CB LEU A 115 17.717 -0.579 -4.763 1.00 1.29 C ATOM 1715 CG LEU A 115 18.133 -0.013 -6.138 1.00 1.50 C ATOM 1716 CD1 LEU A 115 17.158 -0.305 -7.286 1.00 3.09 C ATOM 1717 CD2 LEU A 115 18.512 1.470 -6.130 1.00 2.45 C ATOM 0 H LEU A 115 15.534 -0.541 -5.796 1.00 1.18 H new ATOM 0 HA LEU A 115 16.316 -0.636 -3.136 1.00 1.20 H new ATOM 0 HB2 LEU A 115 18.568 -0.454 -4.094 1.00 1.29 H new ATOM 0 HB3 LEU A 115 17.566 -1.651 -4.890 1.00 1.29 H new ATOM 0 HG LEU A 115 19.040 -0.582 -6.342 1.00 1.50 H new ATOM 0 HD11 LEU A 115 17.540 0.134 -8.208 1.00 3.09 H new ATOM 0 HD12 LEU A 115 17.057 -1.383 -7.412 1.00 3.09 H new ATOM 0 HD13 LEU A 115 16.184 0.126 -7.055 1.00 3.09 H new ATOM 0 HD21 LEU A 115 18.790 1.780 -7.137 1.00 2.45 H new ATOM 0 HD22 LEU A 115 17.662 2.061 -5.790 1.00 2.45 H new ATOM 0 HD23 LEU A 115 19.355 1.627 -5.457 1.00 2.45 H new ATOM 1729 N ALA A 116 16.101 2.397 -4.126 1.00 1.22 N ATOM 1730 CA ALA A 116 16.230 3.776 -3.687 1.00 1.30 C ATOM 1731 C ALA A 116 15.377 3.980 -2.440 1.00 1.26 C ATOM 1732 O ALA A 116 15.784 4.636 -1.486 1.00 1.34 O ATOM 1733 CB ALA A 116 15.798 4.714 -4.816 1.00 1.43 C ATOM 0 H ALA A 116 15.530 2.280 -4.963 1.00 1.22 H new ATOM 0 HA ALA A 116 17.267 4.001 -3.439 1.00 1.30 H new ATOM 0 HB1 ALA A 116 15.895 5.749 -4.487 1.00 1.43 H new ATOM 0 HB2 ALA A 116 16.431 4.550 -5.688 1.00 1.43 H new ATOM 0 HB3 ALA A 116 14.760 4.513 -5.079 1.00 1.43 H new ATOM 1739 N THR A 117 14.180 3.395 -2.463 1.00 1.23 N ATOM 1740 CA THR A 117 13.217 3.446 -1.384 1.00 1.29 C ATOM 1741 C THR A 117 13.446 2.307 -0.382 1.00 1.14 C ATOM 1742 O THR A 117 12.895 2.337 0.713 1.00 1.26 O ATOM 1743 CB THR A 117 11.827 3.370 -2.019 1.00 1.54 C ATOM 1744 OG1 THR A 117 11.803 2.395 -3.041 1.00 3.27 O ATOM 1745 CG2 THR A 117 11.430 4.693 -2.674 1.00 1.78 C ATOM 0 H THR A 117 13.851 2.856 -3.264 1.00 1.23 H new ATOM 0 HA THR A 117 13.322 4.371 -0.817 1.00 1.29 H new ATOM 0 HB THR A 117 11.136 3.124 -1.213 1.00 1.54 H new ATOM 0 HG1 THR A 117 12.446 1.686 -2.832 1.00 3.27 H new ATOM 0 HG21 THR A 117 10.437 4.598 -3.113 1.00 1.78 H new ATOM 0 HG22 THR A 117 11.420 5.483 -1.923 1.00 1.78 H new ATOM 0 HG23 THR A 117 12.149 4.943 -3.454 1.00 1.78 H new ATOM 1753 N SER A 118 14.228 1.288 -0.762 1.00 1.00 N ATOM 1754 CA SER A 118 14.537 0.121 0.060 1.00 0.92 C ATOM 1755 C SER A 118 13.274 -0.706 0.327 1.00 0.90 C ATOM 1756 O SER A 118 13.227 -1.439 1.313 1.00 0.96 O ATOM 1757 CB SER A 118 15.276 0.554 1.347 1.00 1.01 C ATOM 1758 OG SER A 118 15.743 -0.516 2.156 1.00 1.98 O ATOM 0 H SER A 118 14.674 1.256 -1.679 1.00 1.00 H new ATOM 0 HA SER A 118 15.217 -0.537 -0.481 1.00 0.92 H new ATOM 0 HB2 SER A 118 16.126 1.178 1.069 1.00 1.01 H new ATOM 0 HB3 SER A 118 14.606 1.175 1.942 1.00 1.01 H new ATOM 0 HG SER A 118 15.077 -1.235 2.164 1.00 1.98 H new ATOM 1764 N LYS A 119 12.265 -0.630 -0.557 1.00 0.94 N ATOM 1765 CA LYS A 119 11.008 -1.347 -0.402 1.00 0.94 C ATOM 1766 C LYS A 119 10.680 -2.154 -1.660 1.00 0.84 C ATOM 1767 O LYS A 119 11.068 -1.783 -2.772 1.00 0.82 O ATOM 1768 CB LYS A 119 9.889 -0.398 0.063 1.00 1.14 C ATOM 1769 CG LYS A 119 9.389 0.521 -1.057 1.00 1.72 C ATOM 1770 CD LYS A 119 8.474 1.666 -0.581 1.00 2.37 C ATOM 1771 CE LYS A 119 7.288 1.237 0.305 1.00 2.56 C ATOM 1772 NZ LYS A 119 7.541 1.463 1.742 1.00 2.77 N ATOM 0 H LYS A 119 12.309 -0.062 -1.403 1.00 0.94 H new ATOM 0 HA LYS A 119 11.107 -2.086 0.393 1.00 0.94 H new ATOM 0 HB2 LYS A 119 9.054 -0.986 0.444 1.00 1.14 H new ATOM 0 HB3 LYS A 119 10.255 0.210 0.890 1.00 1.14 H new ATOM 0 HG2 LYS A 119 10.250 0.950 -1.570 1.00 1.72 H new ATOM 0 HG3 LYS A 119 8.848 -0.079 -1.789 1.00 1.72 H new ATOM 0 HD2 LYS A 119 9.078 2.385 -0.028 1.00 2.37 H new ATOM 0 HD3 LYS A 119 8.083 2.184 -1.457 1.00 2.37 H new ATOM 0 HE2 LYS A 119 6.397 1.789 0.006 1.00 2.56 H new ATOM 0 HE3 LYS A 119 7.079 0.180 0.139 1.00 2.56 H new ATOM 0 HZ1 LYS A 119 6.933 0.835 2.305 1.00 2.77 H new ATOM 0 HZ2 LYS A 119 8.539 1.261 1.955 1.00 2.77 H new ATOM 0 HZ3 LYS A 119 7.330 2.453 1.980 1.00 2.77 H new ATOM 1786 N ALA A 120 9.988 -3.275 -1.448 1.00 0.87 N ATOM 1787 CA ALA A 120 9.609 -4.279 -2.421 1.00 0.89 C ATOM 1788 C ALA A 120 8.100 -4.464 -2.350 1.00 0.92 C ATOM 1789 O ALA A 120 7.601 -4.912 -1.322 1.00 0.93 O ATOM 1790 CB ALA A 120 10.336 -5.588 -2.103 1.00 0.86 C ATOM 0 H ALA A 120 9.656 -3.515 -0.514 1.00 0.87 H new ATOM 0 HA ALA A 120 9.886 -3.970 -3.429 1.00 0.89 H new ATOM 0 HB1 ALA A 120 10.054 -6.347 -2.833 1.00 0.86 H new ATOM 0 HB2 ALA A 120 11.413 -5.426 -2.146 1.00 0.86 H new ATOM 0 HB3 ALA A 120 10.059 -5.924 -1.104 1.00 0.86 H new ATOM 1796 N LEU A 121 7.395 -4.127 -3.434 1.00 0.99 N ATOM 1797 CA LEU A 121 5.951 -4.213 -3.555 1.00 1.03 C ATOM 1798 C LEU A 121 5.640 -5.534 -4.244 1.00 0.91 C ATOM 1799 O LEU A 121 6.029 -5.718 -5.398 1.00 0.91 O ATOM 1800 CB LEU A 121 5.393 -3.063 -4.415 1.00 1.28 C ATOM 1801 CG LEU A 121 5.612 -1.622 -3.922 1.00 1.44 C ATOM 1802 CD1 LEU A 121 5.245 -1.498 -2.449 1.00 1.57 C ATOM 1803 CD2 LEU A 121 7.026 -1.086 -4.168 1.00 2.19 C ATOM 0 H LEU A 121 7.840 -3.774 -4.281 1.00 0.99 H new ATOM 0 HA LEU A 121 5.495 -4.147 -2.567 1.00 1.03 H new ATOM 0 HB2 LEU A 121 5.832 -3.146 -5.409 1.00 1.28 H new ATOM 0 HB3 LEU A 121 4.320 -3.219 -4.526 1.00 1.28 H new ATOM 0 HG LEU A 121 4.947 -1.000 -4.521 1.00 1.44 H new ATOM 0 HD11 LEU A 121 5.407 -0.472 -2.119 1.00 1.57 H new ATOM 0 HD12 LEU A 121 4.197 -1.762 -2.312 1.00 1.57 H new ATOM 0 HD13 LEU A 121 5.869 -2.171 -1.861 1.00 1.57 H new ATOM 0 HD21 LEU A 121 7.099 -0.065 -3.792 1.00 2.19 H new ATOM 0 HD22 LEU A 121 7.749 -1.716 -3.650 1.00 2.19 H new ATOM 0 HD23 LEU A 121 7.238 -1.095 -5.237 1.00 2.19 H new ATOM 1815 N VAL A 122 4.946 -6.436 -3.547 1.00 0.91 N ATOM 1816 CA VAL A 122 4.576 -7.749 -4.055 1.00 0.82 C ATOM 1817 C VAL A 122 3.066 -7.818 -4.257 1.00 0.97 C ATOM 1818 O VAL A 122 2.334 -7.255 -3.447 1.00 1.19 O ATOM 1819 CB VAL A 122 5.062 -8.828 -3.074 1.00 0.69 C ATOM 1820 CG1 VAL A 122 6.592 -8.832 -3.037 1.00 2.05 C ATOM 1821 CG2 VAL A 122 4.551 -8.694 -1.635 1.00 2.07 C ATOM 0 H VAL A 122 4.621 -6.266 -2.595 1.00 0.91 H new ATOM 0 HA VAL A 122 5.050 -7.924 -5.021 1.00 0.82 H new ATOM 0 HB VAL A 122 4.647 -9.760 -3.459 1.00 0.69 H new ATOM 0 HG11 VAL A 122 6.937 -9.597 -2.341 1.00 2.05 H new ATOM 0 HG12 VAL A 122 6.979 -9.046 -4.033 1.00 2.05 H new ATOM 0 HG13 VAL A 122 6.951 -7.856 -2.710 1.00 2.05 H new ATOM 0 HG21 VAL A 122 4.954 -9.505 -1.029 1.00 2.07 H new ATOM 0 HG22 VAL A 122 4.873 -7.738 -1.222 1.00 2.07 H new ATOM 0 HG23 VAL A 122 3.462 -8.744 -1.629 1.00 2.07 H new ATOM 1831 N LYS A 123 2.606 -8.452 -5.347 1.00 1.00 N ATOM 1832 CA LYS A 123 1.188 -8.608 -5.649 1.00 1.14 C ATOM 1833 C LYS A 123 0.846 -10.086 -5.806 1.00 1.09 C ATOM 1834 O LYS A 123 1.060 -10.627 -6.892 1.00 1.09 O ATOM 1835 CB LYS A 123 0.859 -7.807 -6.915 1.00 1.33 C ATOM 1836 CG LYS A 123 1.484 -6.410 -6.850 1.00 1.56 C ATOM 1837 CD LYS A 123 0.819 -5.511 -5.811 1.00 1.44 C ATOM 1838 CE LYS A 123 1.828 -4.525 -5.211 1.00 3.22 C ATOM 1839 NZ LYS A 123 1.650 -3.172 -5.780 1.00 3.68 N ATOM 0 H LYS A 123 3.219 -8.872 -6.045 1.00 1.00 H new ATOM 0 HA LYS A 123 0.582 -8.222 -4.830 1.00 1.14 H new ATOM 0 HB2 LYS A 123 1.230 -8.336 -7.793 1.00 1.33 H new ATOM 0 HB3 LYS A 123 -0.222 -7.722 -7.027 1.00 1.33 H new ATOM 0 HG2 LYS A 123 2.545 -6.502 -6.618 1.00 1.56 H new ATOM 0 HG3 LYS A 123 1.412 -5.939 -7.830 1.00 1.56 H new ATOM 0 HD2 LYS A 123 -0.002 -4.961 -6.272 1.00 1.44 H new ATOM 0 HD3 LYS A 123 0.387 -6.123 -5.019 1.00 1.44 H new ATOM 0 HE2 LYS A 123 1.705 -4.487 -4.129 1.00 3.22 H new ATOM 0 HE3 LYS A 123 2.842 -4.874 -5.405 1.00 3.22 H new ATOM 0 HZ1 LYS A 123 2.426 -2.557 -5.462 1.00 3.68 H new ATOM 0 HZ2 LYS A 123 1.656 -3.229 -6.818 1.00 3.68 H new ATOM 0 HZ3 LYS A 123 0.743 -2.777 -5.460 1.00 3.68 H new ATOM 1853 N PHE A 124 0.351 -10.725 -4.733 1.00 1.11 N ATOM 1854 CA PHE A 124 0.017 -12.163 -4.753 1.00 1.15 C ATOM 1855 C PHE A 124 -1.449 -12.460 -4.417 1.00 1.28 C ATOM 1856 O PHE A 124 -2.196 -11.548 -4.099 1.00 1.36 O ATOM 1857 CB PHE A 124 0.956 -12.949 -3.826 1.00 1.13 C ATOM 1858 CG PHE A 124 1.034 -12.462 -2.393 1.00 1.17 C ATOM 1859 CD1 PHE A 124 -0.013 -12.742 -1.495 1.00 1.78 C ATOM 1860 CD2 PHE A 124 2.174 -11.771 -1.940 1.00 2.00 C ATOM 1861 CE1 PHE A 124 0.057 -12.285 -0.170 1.00 1.87 C ATOM 1862 CE2 PHE A 124 2.280 -11.400 -0.589 1.00 2.08 C ATOM 1863 CZ PHE A 124 1.219 -11.655 0.293 1.00 1.41 C ATOM 0 H PHE A 124 0.172 -10.269 -3.838 1.00 1.11 H new ATOM 0 HA PHE A 124 0.163 -12.493 -5.781 1.00 1.15 H new ATOM 0 HB2 PHE A 124 0.638 -13.991 -3.818 1.00 1.13 H new ATOM 0 HB3 PHE A 124 1.959 -12.925 -4.252 1.00 1.13 H new ATOM 0 HD1 PHE A 124 -0.871 -13.309 -1.826 1.00 1.78 H new ATOM 0 HD2 PHE A 124 2.967 -11.526 -2.631 1.00 2.00 H new ATOM 0 HE1 PHE A 124 -0.785 -12.419 0.493 1.00 1.87 H new ATOM 0 HE2 PHE A 124 3.178 -10.919 -0.230 1.00 2.08 H new ATOM 0 HZ PHE A 124 1.298 -11.365 1.330 1.00 1.41 H new ATOM 1873 N ASP A 125 -1.843 -13.741 -4.443 1.00 1.32 N ATOM 1874 CA ASP A 125 -3.162 -14.205 -4.014 1.00 1.41 C ATOM 1875 C ASP A 125 -3.023 -14.884 -2.642 1.00 1.43 C ATOM 1876 O ASP A 125 -2.408 -15.955 -2.575 1.00 1.41 O ATOM 1877 CB ASP A 125 -3.699 -15.220 -5.029 1.00 1.42 C ATOM 1878 CG ASP A 125 -3.940 -14.625 -6.409 1.00 2.23 C ATOM 1879 OD1 ASP A 125 -4.769 -13.694 -6.494 1.00 2.61 O ATOM 1880 OD2 ASP A 125 -3.294 -15.123 -7.355 1.00 3.48 O ATOM 0 H ASP A 125 -1.239 -14.495 -4.770 1.00 1.32 H new ATOM 0 HA ASP A 125 -3.850 -13.362 -3.946 1.00 1.41 H new ATOM 0 HB2 ASP A 125 -2.992 -16.045 -5.116 1.00 1.42 H new ATOM 0 HB3 ASP A 125 -4.633 -15.639 -4.654 1.00 1.42 H new ATOM 1885 N PRO A 126 -3.539 -14.299 -1.542 1.00 1.49 N ATOM 1886 CA PRO A 126 -3.354 -14.818 -0.186 1.00 1.53 C ATOM 1887 C PRO A 126 -4.230 -16.043 0.106 1.00 1.63 C ATOM 1888 O PRO A 126 -5.044 -16.048 1.027 1.00 1.71 O ATOM 1889 CB PRO A 126 -3.657 -13.651 0.752 1.00 1.57 C ATOM 1890 CG PRO A 126 -4.599 -12.765 -0.053 1.00 1.64 C ATOM 1891 CD PRO A 126 -4.209 -13.007 -1.509 1.00 1.56 C ATOM 0 HA PRO A 126 -2.336 -15.182 -0.047 1.00 1.53 H new ATOM 0 HB2 PRO A 126 -4.123 -13.993 1.676 1.00 1.57 H new ATOM 0 HB3 PRO A 126 -2.749 -13.117 1.031 1.00 1.57 H new ATOM 0 HG2 PRO A 126 -5.641 -13.029 0.127 1.00 1.64 H new ATOM 0 HG3 PRO A 126 -4.484 -11.716 0.219 1.00 1.64 H new ATOM 0 HD2 PRO A 126 -5.089 -13.009 -2.152 1.00 1.56 H new ATOM 0 HD3 PRO A 126 -3.550 -12.218 -1.872 1.00 1.56 H new ATOM 1899 N GLU A 127 -3.987 -17.109 -0.649 1.00 1.65 N ATOM 1900 CA GLU A 127 -4.560 -18.433 -0.472 1.00 1.74 C ATOM 1901 C GLU A 127 -3.526 -19.452 -0.937 1.00 1.65 C ATOM 1902 O GLU A 127 -3.190 -20.387 -0.214 1.00 1.67 O ATOM 1903 CB GLU A 127 -5.858 -18.598 -1.278 1.00 1.89 C ATOM 1904 CG GLU A 127 -7.025 -17.766 -0.735 1.00 2.23 C ATOM 1905 CD GLU A 127 -8.350 -18.296 -1.269 1.00 2.35 C ATOM 1906 OE1 GLU A 127 -8.612 -18.066 -2.468 1.00 2.79 O ATOM 1907 OE2 GLU A 127 -9.053 -18.966 -0.480 1.00 2.97 O ATOM 0 H GLU A 127 -3.349 -17.067 -1.444 1.00 1.65 H new ATOM 0 HA GLU A 127 -4.812 -18.582 0.578 1.00 1.74 H new ATOM 0 HB2 GLU A 127 -5.671 -18.315 -2.314 1.00 1.89 H new ATOM 0 HB3 GLU A 127 -6.143 -19.650 -1.281 1.00 1.89 H new ATOM 0 HG2 GLU A 127 -7.026 -17.798 0.355 1.00 2.23 H new ATOM 0 HG3 GLU A 127 -6.901 -16.722 -1.024 1.00 2.23 H new ATOM 1914 N ILE A 128 -3.024 -19.266 -2.162 1.00 1.59 N ATOM 1915 CA ILE A 128 -2.153 -20.222 -2.824 1.00 1.56 C ATOM 1916 C ILE A 128 -0.693 -19.991 -2.457 1.00 1.56 C ATOM 1917 O ILE A 128 0.090 -20.937 -2.407 1.00 1.58 O ATOM 1918 CB ILE A 128 -2.361 -20.173 -4.348 1.00 1.56 C ATOM 1919 CG1 ILE A 128 -2.692 -18.758 -4.851 1.00 1.61 C ATOM 1920 CG2 ILE A 128 -3.468 -21.170 -4.723 1.00 1.61 C ATOM 1921 CD1 ILE A 128 -2.501 -18.617 -6.359 1.00 1.81 C ATOM 0 H ILE A 128 -3.218 -18.436 -2.722 1.00 1.59 H new ATOM 0 HA ILE A 128 -2.419 -21.220 -2.476 1.00 1.56 H new ATOM 0 HB ILE A 128 -1.427 -20.452 -4.837 1.00 1.56 H new ATOM 0 HG12 ILE A 128 -3.723 -18.516 -4.594 1.00 1.61 H new ATOM 0 HG13 ILE A 128 -2.058 -18.035 -4.338 1.00 1.61 H new ATOM 0 HG21 ILE A 128 -3.628 -21.148 -5.801 1.00 1.61 H new ATOM 0 HG22 ILE A 128 -3.171 -22.174 -4.421 1.00 1.61 H new ATOM 0 HG23 ILE A 128 -4.392 -20.897 -4.213 1.00 1.61 H new ATOM 0 HD11 ILE A 128 -2.748 -17.600 -6.663 1.00 1.81 H new ATOM 0 HD12 ILE A 128 -1.464 -18.831 -6.616 1.00 1.81 H new ATOM 0 HD13 ILE A 128 -3.155 -19.319 -6.876 1.00 1.81 H new ATOM 1933 N ILE A 129 -0.321 -18.734 -2.225 1.00 1.55 N ATOM 1934 CA ILE A 129 1.023 -18.346 -1.844 1.00 1.57 C ATOM 1935 C ILE A 129 0.874 -17.294 -0.743 1.00 1.64 C ATOM 1936 O ILE A 129 -0.226 -16.791 -0.514 1.00 1.66 O ATOM 1937 CB ILE A 129 1.791 -17.902 -3.111 1.00 1.58 C ATOM 1938 CG1 ILE A 129 2.983 -18.819 -3.426 1.00 1.66 C ATOM 1939 CG2 ILE A 129 2.165 -16.419 -3.134 1.00 1.58 C ATOM 1940 CD1 ILE A 129 4.170 -18.678 -2.473 1.00 1.66 C ATOM 0 H ILE A 129 -0.963 -17.945 -2.300 1.00 1.55 H new ATOM 0 HA ILE A 129 1.626 -19.154 -1.430 1.00 1.57 H new ATOM 0 HB ILE A 129 1.078 -18.019 -3.927 1.00 1.58 H new ATOM 0 HG12 ILE A 129 2.642 -19.854 -3.408 1.00 1.66 H new ATOM 0 HG13 ILE A 129 3.323 -18.613 -4.441 1.00 1.66 H new ATOM 0 HG21 ILE A 129 2.700 -16.193 -4.056 1.00 1.58 H new ATOM 0 HG22 ILE A 129 1.259 -15.815 -3.083 1.00 1.58 H new ATOM 0 HG23 ILE A 129 2.802 -16.191 -2.280 1.00 1.58 H new ATOM 0 HD11 ILE A 129 4.962 -19.364 -2.774 1.00 1.66 H new ATOM 0 HD12 ILE A 129 4.544 -17.655 -2.506 1.00 1.66 H new ATOM 0 HD13 ILE A 129 3.852 -18.915 -1.458 1.00 1.66 H new ATOM 1952 N GLY A 130 1.957 -16.992 -0.029 1.00 1.70 N ATOM 1953 CA GLY A 130 1.926 -16.070 1.091 1.00 1.79 C ATOM 1954 C GLY A 130 3.300 -15.442 1.282 1.00 1.68 C ATOM 1955 O GLY A 130 4.289 -15.957 0.755 1.00 1.55 O ATOM 0 H GLY A 130 2.880 -17.384 -0.216 1.00 1.70 H new ATOM 0 HA2 GLY A 130 1.183 -15.293 0.913 1.00 1.79 H new ATOM 0 HA3 GLY A 130 1.627 -16.596 1.998 1.00 1.79 H new ATOM 1959 N PRO A 131 3.376 -14.347 2.051 1.00 1.74 N ATOM 1960 CA PRO A 131 4.583 -13.554 2.180 1.00 1.70 C ATOM 1961 C PRO A 131 5.709 -14.400 2.767 1.00 1.67 C ATOM 1962 O PRO A 131 6.835 -14.336 2.295 1.00 1.62 O ATOM 1963 CB PRO A 131 4.203 -12.353 3.050 1.00 1.83 C ATOM 1964 CG PRO A 131 3.001 -12.845 3.858 1.00 1.93 C ATOM 1965 CD PRO A 131 2.327 -13.860 2.930 1.00 1.82 C ATOM 0 HA PRO A 131 4.963 -13.202 1.221 1.00 1.70 H new ATOM 0 HB2 PRO A 131 5.026 -12.055 3.700 1.00 1.83 H new ATOM 0 HB3 PRO A 131 3.947 -11.485 2.442 1.00 1.83 H new ATOM 0 HG2 PRO A 131 3.311 -13.305 4.796 1.00 1.93 H new ATOM 0 HG3 PRO A 131 2.328 -12.026 4.112 1.00 1.93 H new ATOM 0 HD2 PRO A 131 1.883 -14.677 3.500 1.00 1.82 H new ATOM 0 HD3 PRO A 131 1.523 -13.395 2.360 1.00 1.82 H new ATOM 1973 N ARG A 132 5.398 -15.236 3.760 1.00 1.73 N ATOM 1974 CA ARG A 132 6.363 -16.134 4.381 1.00 1.71 C ATOM 1975 C ARG A 132 7.191 -16.930 3.372 1.00 1.60 C ATOM 1976 O ARG A 132 8.372 -17.161 3.612 1.00 1.53 O ATOM 1977 CB ARG A 132 5.657 -17.081 5.356 1.00 1.85 C ATOM 1978 CG ARG A 132 4.750 -18.063 4.603 1.00 3.16 C ATOM 1979 CD ARG A 132 3.853 -18.834 5.568 1.00 3.63 C ATOM 1980 NE ARG A 132 2.712 -19.435 4.855 1.00 5.28 N ATOM 1981 CZ ARG A 132 1.724 -20.140 5.430 1.00 6.08 C ATOM 1982 NH1 ARG A 132 1.817 -20.476 6.721 1.00 5.48 N ATOM 1983 NH2 ARG A 132 0.650 -20.497 4.715 1.00 7.79 N ATOM 0 H ARG A 132 4.461 -15.306 4.156 1.00 1.73 H new ATOM 0 HA ARG A 132 7.066 -15.502 4.924 1.00 1.71 H new ATOM 0 HB2 ARG A 132 6.398 -17.634 5.934 1.00 1.85 H new ATOM 0 HB3 ARG A 132 5.065 -16.504 6.066 1.00 1.85 H new ATOM 0 HG2 ARG A 132 4.135 -17.518 3.887 1.00 3.16 H new ATOM 0 HG3 ARG A 132 5.361 -18.762 4.032 1.00 3.16 H new ATOM 0 HD2 ARG A 132 4.430 -19.615 6.063 1.00 3.63 H new ATOM 0 HD3 ARG A 132 3.489 -18.164 6.347 1.00 3.63 H new ATOM 0 HE ARG A 132 2.669 -19.305 3.844 1.00 5.28 H new ATOM 0 HH11 ARG A 132 2.635 -20.197 7.263 1.00 5.48 H new ATOM 0 HH12 ARG A 132 1.070 -21.011 7.164 1.00 5.48 H new ATOM 0 HH21 ARG A 132 0.581 -20.234 3.732 1.00 7.79 H new ATOM 0 HH22 ARG A 132 -0.099 -21.032 5.153 1.00 7.79 H new ATOM 1997 N ASP A 133 6.580 -17.381 2.271 1.00 1.61 N ATOM 1998 CA ASP A 133 7.288 -18.209 1.313 1.00 1.48 C ATOM 1999 C ASP A 133 8.357 -17.361 0.630 1.00 1.35 C ATOM 2000 O ASP A 133 9.520 -17.746 0.533 1.00 1.25 O ATOM 2001 CB ASP A 133 6.292 -18.779 0.305 1.00 1.56 C ATOM 2002 CG ASP A 133 6.995 -19.768 -0.608 1.00 2.18 C ATOM 2003 OD1 ASP A 133 7.239 -20.896 -0.128 1.00 2.50 O ATOM 2004 OD2 ASP A 133 7.278 -19.372 -1.757 1.00 3.44 O ATOM 0 H ASP A 133 5.608 -17.185 2.031 1.00 1.61 H new ATOM 0 HA ASP A 133 7.777 -19.047 1.810 1.00 1.48 H new ATOM 0 HB2 ASP A 133 5.473 -19.272 0.828 1.00 1.56 H new ATOM 0 HB3 ASP A 133 5.855 -17.973 -0.284 1.00 1.56 H new ATOM 2009 N ILE A 134 7.954 -16.149 0.239 1.00 1.37 N ATOM 2010 CA ILE A 134 8.833 -15.167 -0.370 1.00 1.29 C ATOM 2011 C ILE A 134 9.954 -14.844 0.619 1.00 1.20 C ATOM 2012 O ILE A 134 11.127 -14.835 0.246 1.00 1.06 O ATOM 2013 CB ILE A 134 8.027 -13.917 -0.774 1.00 1.39 C ATOM 2014 CG1 ILE A 134 6.971 -14.273 -1.840 1.00 1.56 C ATOM 2015 CG2 ILE A 134 8.973 -12.825 -1.287 1.00 1.29 C ATOM 2016 CD1 ILE A 134 5.883 -13.202 -1.978 1.00 1.34 C ATOM 0 H ILE A 134 6.992 -15.825 0.341 1.00 1.37 H new ATOM 0 HA ILE A 134 9.282 -15.560 -1.282 1.00 1.29 H new ATOM 0 HB ILE A 134 7.504 -13.538 0.104 1.00 1.39 H new ATOM 0 HG12 ILE A 134 7.464 -14.410 -2.802 1.00 1.56 H new ATOM 0 HG13 ILE A 134 6.507 -15.225 -1.582 1.00 1.56 H new ATOM 0 HG21 ILE A 134 8.394 -11.946 -1.570 1.00 1.29 H new ATOM 0 HG22 ILE A 134 9.679 -12.557 -0.501 1.00 1.29 H new ATOM 0 HG23 ILE A 134 9.519 -13.195 -2.155 1.00 1.29 H new ATOM 0 HD11 ILE A 134 5.168 -13.506 -2.742 1.00 1.34 H new ATOM 0 HD12 ILE A 134 5.367 -13.082 -1.025 1.00 1.34 H new ATOM 0 HD13 ILE A 134 6.339 -12.255 -2.265 1.00 1.34 H new ATOM 2028 N ILE A 135 9.588 -14.585 1.879 1.00 1.31 N ATOM 2029 CA ILE A 135 10.535 -14.310 2.945 1.00 1.30 C ATOM 2030 C ILE A 135 11.552 -15.450 3.014 1.00 1.18 C ATOM 2031 O ILE A 135 12.728 -15.206 2.771 1.00 1.09 O ATOM 2032 CB ILE A 135 9.820 -14.011 4.274 1.00 1.56 C ATOM 2033 CG1 ILE A 135 9.057 -12.677 4.161 1.00 1.95 C ATOM 2034 CG2 ILE A 135 10.840 -13.936 5.419 1.00 1.78 C ATOM 2035 CD1 ILE A 135 8.170 -12.371 5.372 1.00 2.13 C ATOM 0 H ILE A 135 8.614 -14.562 2.182 1.00 1.31 H new ATOM 0 HA ILE A 135 11.092 -13.398 2.730 1.00 1.30 H new ATOM 0 HB ILE A 135 9.114 -14.813 4.487 1.00 1.56 H new ATOM 0 HG12 ILE A 135 9.775 -11.867 4.034 1.00 1.95 H new ATOM 0 HG13 ILE A 135 8.438 -12.697 3.264 1.00 1.95 H new ATOM 0 HG21 ILE A 135 10.322 -13.724 6.354 1.00 1.78 H new ATOM 0 HG22 ILE A 135 11.364 -14.888 5.502 1.00 1.78 H new ATOM 0 HG23 ILE A 135 11.559 -13.143 5.214 1.00 1.78 H new ATOM 0 HD11 ILE A 135 7.665 -11.417 5.221 1.00 2.13 H new ATOM 0 HD12 ILE A 135 7.428 -13.161 5.488 1.00 2.13 H new ATOM 0 HD13 ILE A 135 8.786 -12.317 6.270 1.00 2.13 H new ATOM 2047 N LYS A 136 11.133 -16.694 3.267 1.00 1.21 N ATOM 2048 CA LYS A 136 12.038 -17.820 3.324 1.00 1.18 C ATOM 2049 C LYS A 136 12.922 -17.883 2.066 1.00 1.04 C ATOM 2050 O LYS A 136 14.130 -18.094 2.170 1.00 1.01 O ATOM 2051 CB LYS A 136 11.194 -19.080 3.591 1.00 1.32 C ATOM 2052 CG LYS A 136 11.772 -20.298 2.892 1.00 2.05 C ATOM 2053 CD LYS A 136 11.232 -21.593 3.496 1.00 1.87 C ATOM 2054 CE LYS A 136 11.609 -22.815 2.644 1.00 3.09 C ATOM 2055 NZ LYS A 136 13.043 -23.170 2.751 1.00 3.62 N ATOM 0 H LYS A 136 10.157 -16.937 3.436 1.00 1.21 H new ATOM 0 HA LYS A 136 12.754 -17.724 4.140 1.00 1.18 H new ATOM 0 HB2 LYS A 136 11.144 -19.265 4.664 1.00 1.32 H new ATOM 0 HB3 LYS A 136 10.173 -18.914 3.249 1.00 1.32 H new ATOM 0 HG2 LYS A 136 11.528 -20.260 1.830 1.00 2.05 H new ATOM 0 HG3 LYS A 136 12.859 -20.283 2.970 1.00 2.05 H new ATOM 0 HD2 LYS A 136 11.626 -21.717 4.505 1.00 1.87 H new ATOM 0 HD3 LYS A 136 10.147 -21.530 3.583 1.00 1.87 H new ATOM 0 HE2 LYS A 136 11.004 -23.668 2.953 1.00 3.09 H new ATOM 0 HE3 LYS A 136 11.366 -22.613 1.601 1.00 3.09 H new ATOM 0 HZ1 LYS A 136 13.240 -24.000 2.156 1.00 3.62 H new ATOM 0 HZ2 LYS A 136 13.624 -22.369 2.431 1.00 3.62 H new ATOM 0 HZ3 LYS A 136 13.273 -23.391 3.741 1.00 3.62 H new ATOM 2069 N ILE A 137 12.339 -17.719 0.876 1.00 0.99 N ATOM 2070 CA ILE A 137 13.115 -17.706 -0.356 1.00 0.91 C ATOM 2071 C ILE A 137 14.237 -16.659 -0.262 1.00 0.81 C ATOM 2072 O ILE A 137 15.402 -16.993 -0.470 1.00 0.81 O ATOM 2073 CB ILE A 137 12.186 -17.532 -1.576 1.00 0.97 C ATOM 2074 CG1 ILE A 137 11.408 -18.835 -1.834 1.00 1.12 C ATOM 2075 CG2 ILE A 137 12.990 -17.156 -2.826 1.00 1.00 C ATOM 2076 CD1 ILE A 137 10.194 -18.630 -2.747 1.00 2.33 C ATOM 0 H ILE A 137 11.335 -17.594 0.745 1.00 0.99 H new ATOM 0 HA ILE A 137 13.611 -18.666 -0.499 1.00 0.91 H new ATOM 0 HB ILE A 137 11.485 -16.726 -1.359 1.00 0.97 H new ATOM 0 HG12 ILE A 137 12.076 -19.569 -2.285 1.00 1.12 H new ATOM 0 HG13 ILE A 137 11.075 -19.249 -0.882 1.00 1.12 H new ATOM 0 HG21 ILE A 137 12.313 -17.039 -3.672 1.00 1.00 H new ATOM 0 HG22 ILE A 137 13.518 -16.218 -2.651 1.00 1.00 H new ATOM 0 HG23 ILE A 137 13.712 -17.943 -3.045 1.00 1.00 H new ATOM 0 HD11 ILE A 137 9.684 -19.582 -2.894 1.00 2.33 H new ATOM 0 HD12 ILE A 137 9.509 -17.918 -2.287 1.00 2.33 H new ATOM 0 HD13 ILE A 137 10.525 -18.243 -3.711 1.00 2.33 H new ATOM 2088 N ILE A 138 13.927 -15.400 0.063 1.00 0.82 N ATOM 2089 CA ILE A 138 14.972 -14.381 0.141 1.00 0.80 C ATOM 2090 C ILE A 138 15.946 -14.612 1.306 1.00 0.81 C ATOM 2091 O ILE A 138 17.126 -14.275 1.185 1.00 0.80 O ATOM 2092 CB ILE A 138 14.432 -12.944 0.039 1.00 0.86 C ATOM 2093 CG1 ILE A 138 13.497 -12.487 1.166 1.00 0.98 C ATOM 2094 CG2 ILE A 138 13.714 -12.739 -1.301 1.00 0.91 C ATOM 2095 CD1 ILE A 138 14.197 -12.129 2.480 1.00 1.24 C ATOM 0 H ILE A 138 12.985 -15.070 0.271 1.00 0.82 H new ATOM 0 HA ILE A 138 15.579 -14.503 -0.756 1.00 0.80 H new ATOM 0 HB ILE A 138 15.325 -12.326 0.128 1.00 0.86 H new ATOM 0 HG12 ILE A 138 12.935 -11.618 0.822 1.00 0.98 H new ATOM 0 HG13 ILE A 138 12.773 -13.278 1.361 1.00 0.98 H new ATOM 0 HG21 ILE A 138 13.337 -11.718 -1.359 1.00 0.91 H new ATOM 0 HG22 ILE A 138 14.413 -12.915 -2.119 1.00 0.91 H new ATOM 0 HG23 ILE A 138 12.881 -13.438 -1.378 1.00 0.91 H new ATOM 0 HD11 ILE A 138 13.454 -11.818 3.215 1.00 1.24 H new ATOM 0 HD12 ILE A 138 14.735 -13.000 2.854 1.00 1.24 H new ATOM 0 HD13 ILE A 138 14.900 -11.314 2.307 1.00 1.24 H new ATOM 2107 N GLU A 139 15.493 -15.203 2.417 1.00 0.89 N ATOM 2108 CA GLU A 139 16.386 -15.638 3.488 1.00 0.97 C ATOM 2109 C GLU A 139 17.449 -16.589 2.933 1.00 0.94 C ATOM 2110 O GLU A 139 18.609 -16.509 3.324 1.00 0.97 O ATOM 2111 CB GLU A 139 15.645 -16.347 4.631 1.00 1.10 C ATOM 2112 CG GLU A 139 14.686 -15.469 5.448 1.00 1.20 C ATOM 2113 CD GLU A 139 14.159 -16.211 6.674 1.00 1.69 C ATOM 2114 OE1 GLU A 139 14.965 -16.937 7.295 1.00 1.92 O ATOM 2115 OE2 GLU A 139 12.959 -16.042 6.972 1.00 2.98 O ATOM 0 H GLU A 139 14.506 -15.390 2.595 1.00 0.89 H new ATOM 0 HA GLU A 139 16.845 -14.736 3.892 1.00 0.97 H new ATOM 0 HB2 GLU A 139 15.079 -17.179 4.212 1.00 1.10 H new ATOM 0 HB3 GLU A 139 16.384 -16.774 5.309 1.00 1.10 H new ATOM 0 HG2 GLU A 139 15.201 -14.561 5.764 1.00 1.20 H new ATOM 0 HG3 GLU A 139 13.850 -15.160 4.821 1.00 1.20 H new ATOM 2122 N GLU A 140 17.058 -17.484 2.018 1.00 0.94 N ATOM 2123 CA GLU A 140 17.972 -18.457 1.434 1.00 0.98 C ATOM 2124 C GLU A 140 19.071 -17.731 0.653 1.00 0.93 C ATOM 2125 O GLU A 140 20.228 -18.145 0.661 1.00 1.00 O ATOM 2126 CB GLU A 140 17.169 -19.439 0.566 1.00 1.06 C ATOM 2127 CG GLU A 140 17.892 -20.769 0.330 1.00 1.49 C ATOM 2128 CD GLU A 140 16.959 -21.757 -0.360 1.00 1.94 C ATOM 2129 OE1 GLU A 140 16.102 -22.326 0.357 1.00 2.65 O ATOM 2130 OE2 GLU A 140 17.093 -21.895 -1.595 1.00 2.61 O ATOM 0 H GLU A 140 16.103 -17.549 1.667 1.00 0.94 H new ATOM 0 HA GLU A 140 18.470 -19.037 2.211 1.00 0.98 H new ATOM 0 HB2 GLU A 140 16.209 -19.635 1.044 1.00 1.06 H new ATOM 0 HB3 GLU A 140 16.957 -18.973 -0.396 1.00 1.06 H new ATOM 0 HG2 GLU A 140 18.779 -20.606 -0.282 1.00 1.49 H new ATOM 0 HG3 GLU A 140 18.232 -21.181 1.280 1.00 1.49 H new ATOM 2137 N ILE A 141 18.715 -16.618 0.003 1.00 0.85 N ATOM 2138 CA ILE A 141 19.690 -15.750 -0.642 1.00 0.84 C ATOM 2139 C ILE A 141 20.552 -15.067 0.423 1.00 0.84 C ATOM 2140 O ILE A 141 21.767 -14.955 0.272 1.00 0.92 O ATOM 2141 CB ILE A 141 18.999 -14.693 -1.524 1.00 0.79 C ATOM 2142 CG1 ILE A 141 17.924 -15.291 -2.442 1.00 0.77 C ATOM 2143 CG2 ILE A 141 20.081 -14.015 -2.364 1.00 0.96 C ATOM 2144 CD1 ILE A 141 17.175 -14.205 -3.219 1.00 0.91 C ATOM 0 H ILE A 141 17.750 -16.300 -0.087 1.00 0.85 H new ATOM 0 HA ILE A 141 20.322 -16.361 -1.287 1.00 0.84 H new ATOM 0 HB ILE A 141 18.486 -13.982 -0.877 1.00 0.79 H new ATOM 0 HG12 ILE A 141 18.389 -15.985 -3.143 1.00 0.77 H new ATOM 0 HG13 ILE A 141 17.216 -15.866 -1.846 1.00 0.77 H new ATOM 0 HG21 ILE A 141 19.625 -13.258 -3.002 1.00 0.96 H new ATOM 0 HG22 ILE A 141 20.810 -13.543 -1.706 1.00 0.96 H new ATOM 0 HG23 ILE A 141 20.580 -14.760 -2.984 1.00 0.96 H new ATOM 0 HD11 ILE A 141 16.423 -14.668 -3.858 1.00 0.91 H new ATOM 0 HD12 ILE A 141 16.689 -13.526 -2.518 1.00 0.91 H new ATOM 0 HD13 ILE A 141 17.880 -13.647 -3.835 1.00 0.91 H new ATOM 2156 N GLY A 142 19.897 -14.578 1.476 1.00 0.79 N ATOM 2157 CA GLY A 142 20.502 -13.845 2.573 1.00 0.82 C ATOM 2158 C GLY A 142 20.070 -12.382 2.563 1.00 0.78 C ATOM 2159 O GLY A 142 20.842 -11.520 2.978 1.00 0.86 O ATOM 0 H GLY A 142 18.889 -14.690 1.586 1.00 0.79 H new ATOM 0 HA2 GLY A 142 20.219 -14.304 3.520 1.00 0.82 H new ATOM 0 HA3 GLY A 142 21.588 -13.907 2.500 1.00 0.82 H new ATOM 2163 N PHE A 143 18.840 -12.090 2.120 1.00 0.70 N ATOM 2164 CA PHE A 143 18.234 -10.785 2.361 1.00 0.67 C ATOM 2165 C PHE A 143 17.281 -10.894 3.552 1.00 0.65 C ATOM 2166 O PHE A 143 17.100 -11.972 4.119 1.00 0.69 O ATOM 2167 CB PHE A 143 17.526 -10.282 1.095 1.00 0.65 C ATOM 2168 CG PHE A 143 18.358 -10.321 -0.178 1.00 0.84 C ATOM 2169 CD1 PHE A 143 19.690 -9.864 -0.171 1.00 1.55 C ATOM 2170 CD2 PHE A 143 17.797 -10.803 -1.376 1.00 2.19 C ATOM 2171 CE1 PHE A 143 20.466 -9.925 -1.342 1.00 1.64 C ATOM 2172 CE2 PHE A 143 18.573 -10.856 -2.547 1.00 2.44 C ATOM 2173 CZ PHE A 143 19.910 -10.430 -2.528 1.00 1.48 C ATOM 0 H PHE A 143 18.253 -12.739 1.597 1.00 0.70 H new ATOM 0 HA PHE A 143 19.003 -10.051 2.604 1.00 0.67 H new ATOM 0 HB2 PHE A 143 16.628 -10.880 0.940 1.00 0.65 H new ATOM 0 HB3 PHE A 143 17.201 -9.256 1.265 1.00 0.65 H new ATOM 0 HD1 PHE A 143 20.117 -9.465 0.737 1.00 1.55 H new ATOM 0 HD2 PHE A 143 16.769 -11.133 -1.395 1.00 2.19 H new ATOM 0 HE1 PHE A 143 21.490 -9.583 -1.329 1.00 1.64 H new ATOM 0 HE2 PHE A 143 18.139 -11.226 -3.464 1.00 2.44 H new ATOM 0 HZ PHE A 143 20.510 -10.491 -3.424 1.00 1.48 H new ATOM 2183 N HIS A 144 16.664 -9.774 3.929 1.00 0.68 N ATOM 2184 CA HIS A 144 15.691 -9.691 5.004 1.00 0.72 C ATOM 2185 C HIS A 144 14.612 -8.724 4.539 1.00 0.71 C ATOM 2186 O HIS A 144 14.944 -7.613 4.130 1.00 0.71 O ATOM 2187 CB HIS A 144 16.372 -9.195 6.283 1.00 0.81 C ATOM 2188 CG HIS A 144 17.350 -10.188 6.857 1.00 1.54 C ATOM 2189 ND1 HIS A 144 17.083 -11.506 7.156 1.00 3.01 N ATOM 2190 CD2 HIS A 144 18.669 -9.957 7.139 1.00 2.82 C ATOM 2191 CE1 HIS A 144 18.220 -12.052 7.617 1.00 3.72 C ATOM 2192 NE2 HIS A 144 19.213 -11.147 7.633 1.00 3.66 N ATOM 0 H HIS A 144 16.837 -8.876 3.478 1.00 0.68 H new ATOM 0 HA HIS A 144 15.254 -10.663 5.231 1.00 0.72 H new ATOM 0 HB2 HIS A 144 16.894 -8.262 6.071 1.00 0.81 H new ATOM 0 HB3 HIS A 144 15.610 -8.972 7.030 1.00 0.81 H new ATOM 0 HD2 HIS A 144 19.195 -9.024 7.004 1.00 2.82 H new ATOM 0 HE1 HIS A 144 18.322 -13.080 7.932 1.00 3.72 H new ATOM 0 HE2 HIS A 144 20.173 -11.298 7.944 1.00 3.66 H new ATOM 2200 N ALA A 145 13.355 -9.176 4.540 1.00 0.77 N ATOM 2201 CA ALA A 145 12.202 -8.455 4.024 1.00 0.82 C ATOM 2202 C ALA A 145 11.271 -8.120 5.190 1.00 0.98 C ATOM 2203 O ALA A 145 10.454 -8.950 5.582 1.00 1.18 O ATOM 2204 CB ALA A 145 11.518 -9.328 2.967 1.00 0.84 C ATOM 0 H ALA A 145 13.109 -10.092 4.917 1.00 0.77 H new ATOM 0 HA ALA A 145 12.493 -7.517 3.551 1.00 0.82 H new ATOM 0 HB1 ALA A 145 10.650 -8.803 2.568 1.00 0.84 H new ATOM 0 HB2 ALA A 145 12.219 -9.537 2.159 1.00 0.84 H new ATOM 0 HB3 ALA A 145 11.198 -10.266 3.421 1.00 0.84 H new ATOM 2210 N SER A 146 11.405 -6.917 5.754 1.00 0.97 N ATOM 2211 CA SER A 146 10.663 -6.481 6.936 1.00 1.08 C ATOM 2212 C SER A 146 9.526 -5.538 6.536 1.00 1.17 C ATOM 2213 O SER A 146 9.777 -4.471 5.991 1.00 1.29 O ATOM 2214 CB SER A 146 11.614 -5.811 7.940 1.00 1.21 C ATOM 2215 OG SER A 146 12.222 -6.792 8.758 1.00 1.67 O ATOM 0 H SER A 146 12.044 -6.208 5.395 1.00 0.97 H new ATOM 0 HA SER A 146 10.220 -7.353 7.417 1.00 1.08 H new ATOM 0 HB2 SER A 146 12.378 -5.245 7.408 1.00 1.21 H new ATOM 0 HB3 SER A 146 11.063 -5.101 8.557 1.00 1.21 H new ATOM 0 HG SER A 146 12.828 -6.358 9.394 1.00 1.67 H new ATOM 2221 N LEU A 147 8.279 -5.927 6.799 1.00 1.35 N ATOM 2222 CA LEU A 147 7.075 -5.150 6.549 1.00 1.60 C ATOM 2223 C LEU A 147 7.268 -3.713 7.030 1.00 1.75 C ATOM 2224 O LEU A 147 7.494 -3.495 8.219 1.00 2.12 O ATOM 2225 CB LEU A 147 5.873 -5.781 7.272 1.00 2.26 C ATOM 2226 CG LEU A 147 5.680 -7.276 6.955 1.00 3.32 C ATOM 2227 CD1 LEU A 147 5.977 -8.131 8.195 1.00 4.15 C ATOM 2228 CD2 LEU A 147 4.252 -7.549 6.473 1.00 4.29 C ATOM 0 H LEU A 147 8.076 -6.837 7.212 1.00 1.35 H new ATOM 0 HA LEU A 147 6.882 -5.146 5.476 1.00 1.60 H new ATOM 0 HB2 LEU A 147 6.002 -5.660 8.348 1.00 2.26 H new ATOM 0 HB3 LEU A 147 4.968 -5.240 6.996 1.00 2.26 H new ATOM 0 HG LEU A 147 6.377 -7.543 6.161 1.00 3.32 H new ATOM 0 HD11 LEU A 147 5.836 -9.184 7.953 1.00 4.15 H new ATOM 0 HD12 LEU A 147 7.007 -7.967 8.512 1.00 4.15 H new ATOM 0 HD13 LEU A 147 5.300 -7.850 9.001 1.00 4.15 H new ATOM 0 HD21 LEU A 147 4.138 -8.611 6.255 1.00 4.29 H new ATOM 0 HD22 LEU A 147 3.544 -7.260 7.250 1.00 4.29 H new ATOM 0 HD23 LEU A 147 4.056 -6.970 5.570 1.00 4.29 H new ATOM 2240 N ALA A 148 7.197 -2.755 6.105 1.00 1.78 N ATOM 2241 CA ALA A 148 7.245 -1.327 6.420 1.00 2.37 C ATOM 2242 C ALA A 148 5.891 -0.637 6.204 1.00 2.65 C ATOM 2243 O ALA A 148 5.814 0.588 6.249 1.00 3.44 O ATOM 2244 CB ALA A 148 8.398 -0.683 5.650 1.00 3.43 C ATOM 0 H ALA A 148 7.104 -2.950 5.108 1.00 1.78 H new ATOM 0 HA ALA A 148 7.444 -1.197 7.484 1.00 2.37 H new ATOM 0 HB1 ALA A 148 8.440 0.382 5.880 1.00 3.43 H new ATOM 0 HB2 ALA A 148 9.337 -1.154 5.940 1.00 3.43 H new ATOM 0 HB3 ALA A 148 8.240 -0.817 4.580 1.00 3.43 H new ATOM 2250 N GLN A 149 4.831 -1.433 6.045 1.00 2.89 N ATOM 2251 CA GLN A 149 3.441 -1.033 6.212 1.00 3.95 C ATOM 2252 C GLN A 149 3.019 -1.216 7.678 1.00 4.88 C ATOM 2253 O GLN A 149 3.710 -1.989 8.377 1.00 5.55 O ATOM 2254 CB GLN A 149 2.597 -1.921 5.293 1.00 5.11 C ATOM 2255 CG GLN A 149 1.108 -1.548 5.245 1.00 6.30 C ATOM 2256 CD GLN A 149 0.235 -2.145 6.351 1.00 6.61 C ATOM 2257 OE1 GLN A 149 -0.660 -1.480 6.876 1.00 7.39 O ATOM 2258 NE2 GLN A 149 0.426 -3.421 6.689 1.00 6.52 N ATOM 2259 OXT GLN A 149 1.969 -0.649 8.061 1.00 5.83 O ATOM 0 H GLN A 149 4.927 -2.415 5.785 1.00 2.89 H new ATOM 0 HA GLN A 149 3.302 0.017 5.954 1.00 3.95 H new ATOM 0 HB2 GLN A 149 3.005 -1.870 4.283 1.00 5.11 H new ATOM 0 HB3 GLN A 149 2.690 -2.956 5.622 1.00 5.11 H new ATOM 0 HG2 GLN A 149 1.023 -0.462 5.288 1.00 6.30 H new ATOM 0 HG3 GLN A 149 0.705 -1.861 4.282 1.00 6.30 H new ATOM 0 HE21 GLN A 149 1.171 -3.960 6.247 1.00 6.52 H new ATOM 0 HE22 GLN A 149 -0.172 -3.858 7.390 1.00 6.52 H new