USER MOD reduce.3.24.130724 H: found=0, std=0, add=1068, rem=0, adj=25 USER MOD reduce.3.24.130724 removed 1070 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 146 SER OG : rot 180:sc= 0.00192 USER MOD Set 1.2: A 147 GLN : amide:sc= -2.5 K(o=-2.5,f=0.47) USER MOD Set 2.1: A 58 ASN : amide:sc= 0 K(o=-2.6,f=-4.4) USER MOD Set 2.2: A 59 ASN : amide:sc= -2.61 K(o=-2.6,f=-6.9!) USER MOD Set 3.1: A 36 MET CE :methyl 143:sc= -0.0222 (180deg=-2.44!) USER MOD Set 3.2: A 41 GLN : amide:sc= -0.581 K(o=-5.3,f=-6.5!) USER MOD Set 3.3: A 72 MET CE :methyl -151:sc= -0.273 (180deg=-1.93) USER MOD Set 3.4: A 75 GLN : amide:sc= -4.25! C(o=-5.3!,f=-6.6!) USER MOD Set 3.5: A 76 MET CE :methyl -150:sc= -0.218 (180deg=-0.714) USER MOD Set 4.1: A 24 THR OG1 : rot 164:sc= 0.199 USER MOD Set 4.2: A 62 GLN : amide:sc= -12.7! K(o=-12!,f=-2.3) USER MOD Set 5.1: A 5 THR OG1 : rot 102:sc= 0.842 USER MOD Set 5.2: A 8 GLN : amide:sc= -1.96 K(o=-1.1,f=-3.1) USER MOD Single : A 13 LYS NZ :NH3+ -168:sc= -0.022 (180deg=-0.174) USER MOD Single : A 18 GLN : amide:sc= -0.791 K(o=-0.79,f=-2.1) USER MOD Single : A 21 LYS NZ :NH3+ -161:sc= -0.07 (180deg=-0.45) USER MOD Single : A 26 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 29 THR OG1 : rot 180:sc= -0.0726 USER MOD Single : A 34 THR OG1 : rot 180:sc= 0 USER MOD Single : A 38 THR OG1 : rot 1:sc= 0.616 USER MOD Single : A 42 ASN : amide:sc= -0.0393 X(o=-0.039,f=-0.11) USER MOD Single : A 44 THR OG1 : rot 180:sc= 0 USER MOD Single : A 49 GLN : amide:sc= -0.116 K(o=-0.12,f=-0.78) USER MOD Single : A 57 ASN : amide:sc= -1.01 K(o=-1,f=-0.002) USER MOD Single : A 60 ASN : amide:sc= -2.71! K(o=-2.7!,f=-0.16) USER MOD Single : A 64 ASN : amide:sc= -0.544 K(o=-0.54,f=-4.3!) USER MOD Single : A 66 THR OG1 : rot 180:sc= 0.113 USER MOD Single : A 69 CYS SG : rot 76:sc= -0.801 USER MOD Single : A 74 LYS NZ :NH3+ 168:sc= -1.71 (180deg=-1.88) USER MOD Single : A 81 THR OG1 : rot 180:sc= -1.2 USER MOD Single : A 85 MET CE :methyl -175:sc= -0.286 (180deg=-0.372) USER MOD Single : A 90 LYS NZ :NH3+ -177:sc= -1.7 (180deg=-1.72) USER MOD Single : A 101 SER OG : rot 180:sc= 0 USER MOD Single : A 109 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 111 ASN : amide:sc= -0.524 X(o=-0.52,f=-0.73) USER MOD Single : A 115 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 117 THR OG1 : rot 180:sc= -0.457 USER MOD Single : A 124 MET CE :methyl -158:sc= -1.84! (180deg=-3.04!) USER MOD Single : A 135 MET CE :methyl -117:sc= -0.305 (180deg=-2) USER MOD Single : A 137 ASN : amide:sc= -0.565 K(o=-0.56,f=-6.2!) USER MOD Single : A 138 TYR OH : rot 16:sc= -1.22 USER MOD Single : A 144 MET CE :methyl -113:sc= -3.79 (180deg=-4.48!) USER MOD Single : A 148 LYS NZ :NH3+ 133:sc= -0.0401 (180deg=-0.367) USER MOD ----------------------------------------------------------------- ATOM 27 N LEU A 4 -1.100 8.747 2.455 1.00 0.73 N ATOM 28 CA LEU A 4 -2.242 8.811 3.365 1.00 0.45 C ATOM 29 C LEU A 4 -2.041 9.876 4.441 1.00 0.47 C ATOM 30 O LEU A 4 -1.929 9.558 5.627 1.00 0.58 O ATOM 31 CB LEU A 4 -2.472 7.449 4.024 1.00 0.41 C ATOM 32 CG LEU A 4 -3.317 6.454 3.220 1.00 0.50 C ATOM 33 CD1 LEU A 4 -2.734 6.241 1.831 1.00 1.27 C ATOM 34 CD2 LEU A 4 -3.416 5.130 3.962 1.00 1.19 C ATOM 0 HA LEU A 4 -3.118 9.083 2.776 1.00 0.45 H new ATOM 0 HB2 LEU A 4 -1.502 6.995 4.224 1.00 0.41 H new ATOM 0 HB3 LEU A 4 -2.954 7.610 4.989 1.00 0.41 H new ATOM 0 HG LEU A 4 -4.318 6.870 3.106 1.00 0.50 H new ATOM 0 HD11 LEU A 4 -3.352 5.531 1.282 1.00 1.27 H new ATOM 0 HD12 LEU A 4 -2.710 7.191 1.297 1.00 1.27 H new ATOM 0 HD13 LEU A 4 -1.721 5.848 1.918 1.00 1.27 H new ATOM 0 HD21 LEU A 4 -4.018 4.432 3.381 1.00 1.19 H new ATOM 0 HD22 LEU A 4 -2.417 4.717 4.104 1.00 1.19 H new ATOM 0 HD23 LEU A 4 -3.883 5.291 4.933 1.00 1.19 H new ATOM 46 N THR A 5 -1.985 11.135 4.023 1.00 0.47 N ATOM 47 CA THR A 5 -1.805 12.241 4.951 1.00 0.54 C ATOM 48 C THR A 5 -2.980 12.329 5.918 1.00 0.51 C ATOM 49 O THR A 5 -4.004 11.685 5.711 1.00 0.55 O ATOM 50 CB THR A 5 -1.674 13.581 4.203 1.00 0.62 C ATOM 51 OG1 THR A 5 -1.089 13.367 2.914 1.00 1.12 O ATOM 52 CG2 THR A 5 -0.818 14.558 4.988 1.00 0.99 C ATOM 0 H THR A 5 -2.062 11.414 3.045 1.00 0.47 H new ATOM 0 HA THR A 5 -0.886 12.051 5.506 1.00 0.54 H new ATOM 0 HB THR A 5 -2.672 14.004 4.088 1.00 0.62 H new ATOM 0 HG1 THR A 5 -1.791 13.382 2.230 1.00 1.12 H new ATOM 0 HG21 THR A 5 -0.741 15.496 4.439 1.00 0.99 H new ATOM 0 HG22 THR A 5 -1.275 14.743 5.960 1.00 0.99 H new ATOM 0 HG23 THR A 5 0.178 14.137 5.130 1.00 0.99 H new ATOM 60 N GLU A 6 -2.824 13.114 6.976 1.00 0.60 N ATOM 61 CA GLU A 6 -3.882 13.284 7.965 1.00 0.62 C ATOM 62 C GLU A 6 -5.221 13.607 7.301 1.00 0.55 C ATOM 63 O GLU A 6 -6.266 13.102 7.714 1.00 0.53 O ATOM 64 CB GLU A 6 -3.503 14.395 8.946 1.00 0.75 C ATOM 65 CG GLU A 6 -4.630 14.785 9.888 1.00 1.46 C ATOM 66 CD GLU A 6 -4.215 15.850 10.883 1.00 1.74 C ATOM 67 OE1 GLU A 6 -3.729 15.486 11.975 1.00 2.00 O ATOM 68 OE2 GLU A 6 -4.376 17.049 10.571 1.00 2.20 O ATOM 0 H GLU A 6 -1.975 13.644 7.172 1.00 0.60 H new ATOM 0 HA GLU A 6 -3.994 12.344 8.505 1.00 0.62 H new ATOM 0 HB2 GLU A 6 -2.644 14.071 9.534 1.00 0.75 H new ATOM 0 HB3 GLU A 6 -3.190 15.274 8.383 1.00 0.75 H new ATOM 0 HG2 GLU A 6 -5.477 15.148 9.305 1.00 1.46 H new ATOM 0 HG3 GLU A 6 -4.970 13.901 10.428 1.00 1.46 H new ATOM 75 N GLU A 7 -5.182 14.438 6.263 1.00 0.58 N ATOM 76 CA GLU A 7 -6.395 14.829 5.552 1.00 0.58 C ATOM 77 C GLU A 7 -6.877 13.700 4.647 1.00 0.48 C ATOM 78 O GLU A 7 -8.078 13.517 4.453 1.00 0.46 O ATOM 79 CB GLU A 7 -6.149 16.106 4.738 1.00 0.69 C ATOM 80 CG GLU A 7 -5.425 15.880 3.420 1.00 0.69 C ATOM 81 CD GLU A 7 -6.378 15.642 2.264 1.00 1.02 C ATOM 82 OE1 GLU A 7 -7.047 16.605 1.837 1.00 1.35 O ATOM 83 OE2 GLU A 7 -6.457 14.489 1.788 1.00 1.19 O ATOM 0 H GLU A 7 -4.325 14.853 5.896 1.00 0.58 H new ATOM 0 HA GLU A 7 -7.174 15.032 6.287 1.00 0.58 H new ATOM 0 HB2 GLU A 7 -7.108 16.583 4.535 1.00 0.69 H new ATOM 0 HB3 GLU A 7 -5.568 16.802 5.343 1.00 0.69 H new ATOM 0 HG2 GLU A 7 -4.801 16.746 3.199 1.00 0.69 H new ATOM 0 HG3 GLU A 7 -4.758 15.024 3.518 1.00 0.69 H new ATOM 90 N GLN A 8 -5.929 12.947 4.100 1.00 0.44 N ATOM 91 CA GLN A 8 -6.253 11.832 3.219 1.00 0.37 C ATOM 92 C GLN A 8 -6.957 10.725 3.993 1.00 0.31 C ATOM 93 O GLN A 8 -7.956 10.171 3.535 1.00 0.29 O ATOM 94 CB GLN A 8 -4.981 11.292 2.562 1.00 0.40 C ATOM 95 CG GLN A 8 -4.277 12.311 1.678 1.00 0.48 C ATOM 96 CD GLN A 8 -3.069 11.736 0.962 1.00 1.35 C ATOM 97 OE1 GLN A 8 -2.104 12.447 0.683 1.00 2.22 O ATOM 98 NE2 GLN A 8 -3.117 10.444 0.651 1.00 1.68 N ATOM 0 H GLN A 8 -4.930 13.089 4.251 1.00 0.44 H new ATOM 0 HA GLN A 8 -6.927 12.190 2.441 1.00 0.37 H new ATOM 0 HB2 GLN A 8 -4.293 10.959 3.339 1.00 0.40 H new ATOM 0 HB3 GLN A 8 -5.234 10.416 1.964 1.00 0.40 H new ATOM 0 HG2 GLN A 8 -4.982 12.694 0.940 1.00 0.48 H new ATOM 0 HG3 GLN A 8 -3.963 13.158 2.288 1.00 0.48 H new ATOM 0 HE21 GLN A 8 -3.936 9.889 0.900 1.00 1.68 H new ATOM 0 HE22 GLN A 8 -2.335 10.007 0.163 1.00 1.68 H new ATOM 107 N ILE A 9 -6.428 10.411 5.172 1.00 0.33 N ATOM 108 CA ILE A 9 -7.004 9.375 6.015 1.00 0.33 C ATOM 109 C ILE A 9 -8.428 9.733 6.412 1.00 0.34 C ATOM 110 O ILE A 9 -9.347 8.938 6.235 1.00 0.36 O ATOM 111 CB ILE A 9 -6.161 9.149 7.285 1.00 0.42 C ATOM 112 CG1 ILE A 9 -4.744 8.712 6.905 1.00 0.44 C ATOM 113 CG2 ILE A 9 -6.821 8.112 8.184 1.00 0.51 C ATOM 114 CD1 ILE A 9 -3.812 8.575 8.089 1.00 0.54 C ATOM 0 H ILE A 9 -5.601 10.861 5.563 1.00 0.33 H new ATOM 0 HA ILE A 9 -7.012 8.453 5.433 1.00 0.33 H new ATOM 0 HB ILE A 9 -6.098 10.087 7.837 1.00 0.42 H new ATOM 0 HG12 ILE A 9 -4.796 7.757 6.382 1.00 0.44 H new ATOM 0 HG13 ILE A 9 -4.325 9.436 6.206 1.00 0.44 H new ATOM 0 HG21 ILE A 9 -6.213 7.964 9.076 1.00 0.51 H new ATOM 0 HG22 ILE A 9 -7.812 8.460 8.474 1.00 0.51 H new ATOM 0 HG23 ILE A 9 -6.911 7.168 7.646 1.00 0.51 H new ATOM 0 HD11 ILE A 9 -2.827 8.263 7.742 1.00 0.54 H new ATOM 0 HD12 ILE A 9 -3.729 9.534 8.600 1.00 0.54 H new ATOM 0 HD13 ILE A 9 -4.207 7.829 8.779 1.00 0.54 H new ATOM 126 N ALA A 10 -8.600 10.938 6.941 1.00 0.36 N ATOM 127 CA ALA A 10 -9.913 11.405 7.365 1.00 0.40 C ATOM 128 C ALA A 10 -10.863 11.534 6.177 1.00 0.35 C ATOM 129 O ALA A 10 -12.084 11.527 6.344 1.00 0.36 O ATOM 130 CB ALA A 10 -9.781 12.739 8.086 1.00 0.50 C ATOM 0 H ALA A 10 -7.846 11.610 7.086 1.00 0.36 H new ATOM 0 HA ALA A 10 -10.334 10.669 8.050 1.00 0.40 H new ATOM 0 HB1 ALA A 10 -10.767 13.082 8.400 1.00 0.50 H new ATOM 0 HB2 ALA A 10 -9.143 12.618 8.961 1.00 0.50 H new ATOM 0 HB3 ALA A 10 -9.338 13.474 7.413 1.00 0.50 H new ATOM 136 N GLU A 11 -10.299 11.642 4.978 1.00 0.33 N ATOM 137 CA GLU A 11 -11.099 11.784 3.767 1.00 0.33 C ATOM 138 C GLU A 11 -11.806 10.480 3.401 1.00 0.27 C ATOM 139 O GLU A 11 -13.035 10.445 3.281 1.00 0.28 O ATOM 140 CB GLU A 11 -10.218 12.241 2.603 1.00 0.37 C ATOM 141 CG GLU A 11 -10.975 12.416 1.296 1.00 0.41 C ATOM 142 CD GLU A 11 -10.087 12.905 0.168 1.00 1.27 C ATOM 143 OE1 GLU A 11 -9.850 14.129 0.087 1.00 1.19 O ATOM 144 OE2 GLU A 11 -9.629 12.065 -0.634 1.00 2.27 O ATOM 0 H GLU A 11 -9.291 11.634 4.819 1.00 0.33 H new ATOM 0 HA GLU A 11 -11.863 12.537 3.963 1.00 0.33 H new ATOM 0 HB2 GLU A 11 -9.744 13.186 2.867 1.00 0.37 H new ATOM 0 HB3 GLU A 11 -9.420 11.514 2.456 1.00 0.37 H new ATOM 0 HG2 GLU A 11 -11.426 11.465 1.012 1.00 0.41 H new ATOM 0 HG3 GLU A 11 -11.790 13.124 1.445 1.00 0.41 H new ATOM 151 N PHE A 12 -11.038 9.406 3.235 1.00 0.23 N ATOM 152 CA PHE A 12 -11.624 8.120 2.877 1.00 0.22 C ATOM 153 C PHE A 12 -12.258 7.455 4.095 1.00 0.19 C ATOM 154 O PHE A 12 -13.167 6.635 3.960 1.00 0.20 O ATOM 155 CB PHE A 12 -10.587 7.198 2.214 1.00 0.26 C ATOM 156 CG PHE A 12 -9.431 6.796 3.090 1.00 0.25 C ATOM 157 CD1 PHE A 12 -9.614 5.925 4.154 1.00 0.31 C ATOM 158 CD2 PHE A 12 -8.156 7.273 2.835 1.00 0.27 C ATOM 159 CE1 PHE A 12 -8.551 5.543 4.946 1.00 0.37 C ATOM 160 CE2 PHE A 12 -7.088 6.894 3.625 1.00 0.30 C ATOM 161 CZ PHE A 12 -7.287 6.029 4.683 1.00 0.35 C ATOM 0 H PHE A 12 -10.024 9.400 3.341 1.00 0.23 H new ATOM 0 HA PHE A 12 -12.412 8.303 2.146 1.00 0.22 H new ATOM 0 HB2 PHE A 12 -11.094 6.295 1.872 1.00 0.26 H new ATOM 0 HB3 PHE A 12 -10.194 7.698 1.329 1.00 0.26 H new ATOM 0 HD1 PHE A 12 -10.601 5.541 4.365 1.00 0.31 H new ATOM 0 HD2 PHE A 12 -7.995 7.949 2.009 1.00 0.27 H new ATOM 0 HE1 PHE A 12 -8.708 4.864 5.771 1.00 0.37 H new ATOM 0 HE2 PHE A 12 -6.099 7.274 3.416 1.00 0.30 H new ATOM 0 HZ PHE A 12 -6.454 5.733 5.304 1.00 0.35 H new ATOM 171 N LYS A 13 -11.778 7.814 5.284 1.00 0.19 N ATOM 172 CA LYS A 13 -12.325 7.265 6.518 1.00 0.22 C ATOM 173 C LYS A 13 -13.756 7.757 6.699 1.00 0.21 C ATOM 174 O LYS A 13 -14.623 7.025 7.181 1.00 0.23 O ATOM 175 CB LYS A 13 -11.459 7.662 7.720 1.00 0.28 C ATOM 176 CG LYS A 13 -12.139 7.466 9.068 1.00 0.32 C ATOM 177 CD LYS A 13 -12.508 6.010 9.305 1.00 0.33 C ATOM 178 CE LYS A 13 -13.205 5.822 10.644 1.00 0.48 C ATOM 179 NZ LYS A 13 -12.323 6.189 11.786 1.00 1.23 N ATOM 0 H LYS A 13 -11.016 8.479 5.417 1.00 0.19 H new ATOM 0 HA LYS A 13 -12.326 6.177 6.455 1.00 0.22 H new ATOM 0 HB2 LYS A 13 -10.539 7.077 7.701 1.00 0.28 H new ATOM 0 HB3 LYS A 13 -11.173 8.709 7.618 1.00 0.28 H new ATOM 0 HG2 LYS A 13 -11.476 7.808 9.863 1.00 0.32 H new ATOM 0 HG3 LYS A 13 -13.037 8.082 9.115 1.00 0.32 H new ATOM 0 HD2 LYS A 13 -13.160 5.664 8.503 1.00 0.33 H new ATOM 0 HD3 LYS A 13 -11.608 5.396 9.273 1.00 0.33 H new ATOM 0 HE2 LYS A 13 -14.108 6.432 10.672 1.00 0.48 H new ATOM 0 HE3 LYS A 13 -13.519 4.783 10.747 1.00 0.48 H new ATOM 0 HZ1 LYS A 13 -12.751 5.860 12.675 1.00 1.23 H new ATOM 0 HZ2 LYS A 13 -11.392 5.742 11.663 1.00 1.23 H new ATOM 0 HZ3 LYS A 13 -12.209 7.222 11.818 1.00 1.23 H new ATOM 193 N ASP A 14 -13.993 9.007 6.311 1.00 0.23 N ATOM 194 CA ASP A 14 -15.322 9.590 6.395 1.00 0.25 C ATOM 195 C ASP A 14 -16.238 8.897 5.394 1.00 0.22 C ATOM 196 O ASP A 14 -17.349 8.480 5.725 1.00 0.23 O ATOM 197 CB ASP A 14 -15.266 11.092 6.109 1.00 0.31 C ATOM 198 CG ASP A 14 -16.599 11.778 6.334 1.00 0.37 C ATOM 199 OD1 ASP A 14 -16.906 12.111 7.499 1.00 0.44 O ATOM 200 OD2 ASP A 14 -17.336 11.981 5.347 1.00 0.41 O ATOM 0 H ASP A 14 -13.280 9.633 5.936 1.00 0.23 H new ATOM 0 HA ASP A 14 -15.713 9.449 7.403 1.00 0.25 H new ATOM 0 HB2 ASP A 14 -14.512 11.552 6.748 1.00 0.31 H new ATOM 0 HB3 ASP A 14 -14.949 11.250 5.078 1.00 0.31 H new ATOM 205 N ALA A 15 -15.754 8.770 4.163 1.00 0.22 N ATOM 206 CA ALA A 15 -16.508 8.109 3.111 1.00 0.24 C ATOM 207 C ALA A 15 -16.686 6.629 3.430 1.00 0.22 C ATOM 208 O ALA A 15 -17.504 5.944 2.818 1.00 0.29 O ATOM 209 CB ALA A 15 -15.810 8.283 1.770 1.00 0.27 C ATOM 0 H ALA A 15 -14.841 9.118 3.872 1.00 0.22 H new ATOM 0 HA ALA A 15 -17.494 8.569 3.052 1.00 0.24 H new ATOM 0 HB1 ALA A 15 -16.387 7.783 0.992 1.00 0.27 H new ATOM 0 HB2 ALA A 15 -15.730 9.345 1.536 1.00 0.27 H new ATOM 0 HB3 ALA A 15 -14.812 7.847 1.820 1.00 0.27 H new ATOM 215 N PHE A 16 -15.909 6.144 4.398 1.00 0.20 N ATOM 216 CA PHE A 16 -15.975 4.747 4.804 1.00 0.22 C ATOM 217 C PHE A 16 -17.194 4.513 5.682 1.00 0.22 C ATOM 218 O PHE A 16 -17.976 3.593 5.447 1.00 0.25 O ATOM 219 CB PHE A 16 -14.698 4.347 5.552 1.00 0.26 C ATOM 220 CG PHE A 16 -14.746 2.963 6.138 1.00 0.31 C ATOM 221 CD1 PHE A 16 -14.462 1.856 5.354 1.00 0.38 C ATOM 222 CD2 PHE A 16 -15.077 2.770 7.469 1.00 0.37 C ATOM 223 CE1 PHE A 16 -14.505 0.582 5.887 1.00 0.46 C ATOM 224 CE2 PHE A 16 -15.123 1.498 8.008 1.00 0.45 C ATOM 225 CZ PHE A 16 -14.835 0.408 7.226 1.00 0.48 C ATOM 0 H PHE A 16 -15.227 6.701 4.914 1.00 0.20 H new ATOM 0 HA PHE A 16 -16.062 4.129 3.911 1.00 0.22 H new ATOM 0 HB2 PHE A 16 -13.852 4.413 4.868 1.00 0.26 H new ATOM 0 HB3 PHE A 16 -14.517 5.064 6.353 1.00 0.26 H new ATOM 0 HD1 PHE A 16 -14.204 1.991 4.314 1.00 0.38 H new ATOM 0 HD2 PHE A 16 -15.302 3.623 8.093 1.00 0.37 H new ATOM 0 HE1 PHE A 16 -14.283 -0.274 5.267 1.00 0.46 H new ATOM 0 HE2 PHE A 16 -15.386 1.362 9.047 1.00 0.45 H new ATOM 0 HZ PHE A 16 -14.865 -0.585 7.651 1.00 0.48 H new ATOM 235 N VAL A 17 -17.354 5.356 6.695 1.00 0.22 N ATOM 236 CA VAL A 17 -18.488 5.243 7.597 1.00 0.23 C ATOM 237 C VAL A 17 -19.780 5.560 6.857 1.00 0.23 C ATOM 238 O VAL A 17 -20.865 5.164 7.278 1.00 0.26 O ATOM 239 CB VAL A 17 -18.344 6.176 8.814 1.00 0.30 C ATOM 240 CG1 VAL A 17 -17.098 5.822 9.612 1.00 1.11 C ATOM 241 CG2 VAL A 17 -18.310 7.634 8.383 1.00 0.91 C ATOM 0 H VAL A 17 -16.715 6.121 6.910 1.00 0.22 H new ATOM 0 HA VAL A 17 -18.517 4.216 7.962 1.00 0.23 H new ATOM 0 HB VAL A 17 -19.215 6.036 9.454 1.00 0.30 H new ATOM 0 HG11 VAL A 17 -17.012 6.491 10.468 1.00 1.11 H new ATOM 0 HG12 VAL A 17 -17.171 4.792 9.962 1.00 1.11 H new ATOM 0 HG13 VAL A 17 -16.218 5.929 8.978 1.00 1.11 H new ATOM 0 HG21 VAL A 17 -18.208 8.271 9.262 1.00 0.91 H new ATOM 0 HG22 VAL A 17 -17.463 7.797 7.716 1.00 0.91 H new ATOM 0 HG23 VAL A 17 -19.235 7.881 7.862 1.00 0.91 H new ATOM 251 N GLN A 18 -19.645 6.281 5.745 1.00 0.24 N ATOM 252 CA GLN A 18 -20.793 6.647 4.922 1.00 0.29 C ATOM 253 C GLN A 18 -21.521 5.407 4.406 1.00 0.32 C ATOM 254 O GLN A 18 -22.748 5.326 4.470 1.00 0.43 O ATOM 255 CB GLN A 18 -20.346 7.509 3.739 1.00 0.33 C ATOM 256 CG GLN A 18 -20.039 8.949 4.110 1.00 0.34 C ATOM 257 CD GLN A 18 -19.648 9.790 2.909 1.00 1.09 C ATOM 258 OE1 GLN A 18 -20.079 9.526 1.786 1.00 1.54 O ATOM 259 NE2 GLN A 18 -18.832 10.811 3.140 1.00 1.60 N ATOM 0 H GLN A 18 -18.750 6.623 5.394 1.00 0.24 H new ATOM 0 HA GLN A 18 -21.481 7.217 5.546 1.00 0.29 H new ATOM 0 HB2 GLN A 18 -19.458 7.062 3.291 1.00 0.33 H new ATOM 0 HB3 GLN A 18 -21.127 7.498 2.978 1.00 0.33 H new ATOM 0 HG2 GLN A 18 -20.912 9.391 4.590 1.00 0.34 H new ATOM 0 HG3 GLN A 18 -19.230 8.968 4.841 1.00 0.34 H new ATOM 0 HE21 GLN A 18 -18.499 10.994 4.087 1.00 1.60 H new ATOM 0 HE22 GLN A 18 -18.538 11.413 2.371 1.00 1.60 H new ATOM 268 N PHE A 19 -20.756 4.442 3.898 1.00 0.28 N ATOM 269 CA PHE A 19 -21.334 3.210 3.361 1.00 0.33 C ATOM 270 C PHE A 19 -21.592 2.185 4.462 1.00 0.35 C ATOM 271 O PHE A 19 -21.682 0.987 4.195 1.00 0.64 O ATOM 272 CB PHE A 19 -20.418 2.611 2.289 1.00 0.36 C ATOM 273 CG PHE A 19 -20.388 3.407 1.013 1.00 0.37 C ATOM 274 CD1 PHE A 19 -19.787 4.655 0.976 1.00 0.41 C ATOM 275 CD2 PHE A 19 -20.960 2.907 -0.147 1.00 0.48 C ATOM 276 CE1 PHE A 19 -19.757 5.390 -0.194 1.00 0.44 C ATOM 277 CE2 PHE A 19 -20.931 3.637 -1.320 1.00 0.54 C ATOM 278 CZ PHE A 19 -20.336 4.876 -1.346 1.00 0.47 C ATOM 0 H PHE A 19 -19.738 4.488 3.847 1.00 0.28 H new ATOM 0 HA PHE A 19 -22.292 3.466 2.909 1.00 0.33 H new ATOM 0 HB2 PHE A 19 -19.406 2.538 2.687 1.00 0.36 H new ATOM 0 HB3 PHE A 19 -20.747 1.596 2.067 1.00 0.36 H new ATOM 0 HD1 PHE A 19 -19.337 5.058 1.871 1.00 0.41 H new ATOM 0 HD2 PHE A 19 -21.433 1.936 -0.134 1.00 0.48 H new ATOM 0 HE1 PHE A 19 -19.285 6.361 -0.212 1.00 0.44 H new ATOM 0 HE2 PHE A 19 -21.376 3.234 -2.217 1.00 0.54 H new ATOM 0 HZ PHE A 19 -20.319 5.449 -2.262 1.00 0.47 H new ATOM 288 N ASP A 20 -21.713 2.660 5.696 1.00 0.29 N ATOM 289 CA ASP A 20 -21.974 1.782 6.831 1.00 0.28 C ATOM 290 C ASP A 20 -23.279 2.172 7.517 1.00 0.37 C ATOM 291 O ASP A 20 -23.286 2.625 8.662 1.00 0.44 O ATOM 292 CB ASP A 20 -20.814 1.833 7.828 1.00 0.25 C ATOM 293 CG ASP A 20 -21.000 0.863 8.977 1.00 0.27 C ATOM 294 OD1 ASP A 20 -20.996 -0.362 8.728 1.00 0.29 O ATOM 295 OD2 ASP A 20 -21.151 1.327 10.127 1.00 0.33 O ATOM 0 H ASP A 20 -21.635 3.648 5.936 1.00 0.29 H new ATOM 0 HA ASP A 20 -22.067 0.761 6.461 1.00 0.28 H new ATOM 0 HB2 ASP A 20 -19.882 1.605 7.310 1.00 0.25 H new ATOM 0 HB3 ASP A 20 -20.720 2.845 8.221 1.00 0.25 H new ATOM 300 N LYS A 21 -24.384 1.993 6.801 1.00 0.47 N ATOM 301 CA LYS A 21 -25.703 2.327 7.321 1.00 0.59 C ATOM 302 C LYS A 21 -26.156 1.317 8.371 1.00 0.64 C ATOM 303 O LYS A 21 -26.958 1.635 9.248 1.00 0.83 O ATOM 304 CB LYS A 21 -26.714 2.380 6.177 1.00 0.68 C ATOM 305 CG LYS A 21 -26.411 3.471 5.163 1.00 1.02 C ATOM 306 CD LYS A 21 -26.796 4.846 5.685 1.00 1.14 C ATOM 307 CE LYS A 21 -28.304 5.037 5.697 1.00 1.67 C ATOM 308 NZ LYS A 21 -28.879 4.997 4.325 1.00 2.10 N ATOM 0 H LYS A 21 -24.391 1.616 5.853 1.00 0.47 H new ATOM 0 HA LYS A 21 -25.642 3.305 7.798 1.00 0.59 H new ATOM 0 HB2 LYS A 21 -26.730 1.415 5.670 1.00 0.68 H new ATOM 0 HB3 LYS A 21 -27.711 2.541 6.588 1.00 0.68 H new ATOM 0 HG2 LYS A 21 -25.348 3.458 4.921 1.00 1.02 H new ATOM 0 HG3 LYS A 21 -26.951 3.268 4.238 1.00 1.02 H new ATOM 0 HD2 LYS A 21 -26.404 4.976 6.694 1.00 1.14 H new ATOM 0 HD3 LYS A 21 -26.336 5.614 5.063 1.00 1.14 H new ATOM 0 HE2 LYS A 21 -28.764 4.259 6.306 1.00 1.67 H new ATOM 0 HE3 LYS A 21 -28.545 5.992 6.164 1.00 1.67 H new ATOM 0 HZ1 LYS A 21 -29.820 5.439 4.330 1.00 2.10 H new ATOM 0 HZ2 LYS A 21 -28.257 5.515 3.673 1.00 2.10 H new ATOM 0 HZ3 LYS A 21 -28.962 4.009 4.012 1.00 2.10 H new ATOM 322 N GLU A 22 -25.636 0.099 8.273 1.00 0.58 N ATOM 323 CA GLU A 22 -25.990 -0.963 9.207 1.00 0.63 C ATOM 324 C GLU A 22 -25.437 -0.682 10.602 1.00 0.60 C ATOM 325 O GLU A 22 -26.125 -0.882 11.603 1.00 0.80 O ATOM 326 CB GLU A 22 -25.469 -2.307 8.696 1.00 0.62 C ATOM 327 CG GLU A 22 -25.945 -2.643 7.291 1.00 0.71 C ATOM 328 CD GLU A 22 -25.377 -3.951 6.779 1.00 0.98 C ATOM 329 OE1 GLU A 22 -24.225 -3.951 6.296 1.00 1.80 O ATOM 330 OE2 GLU A 22 -26.084 -4.977 6.862 1.00 0.96 O ATOM 0 H GLU A 22 -24.967 -0.178 7.555 1.00 0.58 H new ATOM 0 HA GLU A 22 -27.077 -1.002 9.277 1.00 0.63 H new ATOM 0 HB2 GLU A 22 -24.379 -2.295 8.710 1.00 0.62 H new ATOM 0 HB3 GLU A 22 -25.788 -3.095 9.378 1.00 0.62 H new ATOM 0 HG2 GLU A 22 -27.034 -2.697 7.284 1.00 0.71 H new ATOM 0 HG3 GLU A 22 -25.661 -1.838 6.613 1.00 0.71 H new ATOM 337 N GLY A 23 -24.191 -0.218 10.661 1.00 0.45 N ATOM 338 CA GLY A 23 -23.573 0.088 11.939 1.00 0.46 C ATOM 339 C GLY A 23 -22.506 -0.916 12.331 1.00 0.39 C ATOM 340 O GLY A 23 -22.043 -0.923 13.472 1.00 0.45 O ATOM 0 H GLY A 23 -23.600 -0.049 9.847 1.00 0.45 H new ATOM 0 HA2 GLY A 23 -23.130 1.083 11.894 1.00 0.46 H new ATOM 0 HA3 GLY A 23 -24.341 0.115 12.712 1.00 0.46 H new ATOM 344 N THR A 24 -22.115 -1.764 11.386 1.00 0.34 N ATOM 345 CA THR A 24 -21.095 -2.774 11.640 1.00 0.30 C ATOM 346 C THR A 24 -19.695 -2.211 11.421 1.00 0.28 C ATOM 347 O THR A 24 -18.713 -2.955 11.405 1.00 0.29 O ATOM 348 CB THR A 24 -21.287 -4.008 10.736 1.00 0.32 C ATOM 349 OG1 THR A 24 -21.362 -3.603 9.364 1.00 0.33 O ATOM 350 CG2 THR A 24 -22.549 -4.765 11.114 1.00 0.40 C ATOM 0 H THR A 24 -22.489 -1.772 10.437 1.00 0.34 H new ATOM 0 HA THR A 24 -21.203 -3.075 12.682 1.00 0.30 H new ATOM 0 HB THR A 24 -20.431 -4.668 10.874 1.00 0.32 H new ATOM 0 HG1 THR A 24 -21.228 -4.382 8.785 1.00 0.33 H new ATOM 0 HG21 THR A 24 -22.663 -5.631 10.462 1.00 0.40 H new ATOM 0 HG22 THR A 24 -22.478 -5.097 12.150 1.00 0.40 H new ATOM 0 HG23 THR A 24 -23.413 -4.110 11.002 1.00 0.40 H new ATOM 358 N GLY A 25 -19.608 -0.892 11.257 1.00 0.30 N ATOM 359 CA GLY A 25 -18.322 -0.253 11.035 1.00 0.32 C ATOM 360 C GLY A 25 -17.590 -0.841 9.844 1.00 0.28 C ATOM 361 O GLY A 25 -16.373 -0.707 9.723 1.00 0.33 O ATOM 0 H GLY A 25 -20.405 -0.256 11.274 1.00 0.30 H new ATOM 0 HA2 GLY A 25 -18.471 0.815 10.877 1.00 0.32 H new ATOM 0 HA3 GLY A 25 -17.706 -0.360 11.928 1.00 0.32 H new ATOM 365 N LYS A 26 -18.343 -1.500 8.969 1.00 0.22 N ATOM 366 CA LYS A 26 -17.784 -2.125 7.781 1.00 0.19 C ATOM 367 C LYS A 26 -18.571 -1.733 6.532 1.00 0.20 C ATOM 368 O LYS A 26 -19.744 -1.370 6.616 1.00 0.23 O ATOM 369 CB LYS A 26 -17.786 -3.643 7.956 1.00 0.20 C ATOM 370 CG LYS A 26 -16.688 -4.138 8.885 1.00 0.25 C ATOM 371 CD LYS A 26 -17.156 -5.289 9.763 1.00 0.62 C ATOM 372 CE LYS A 26 -17.470 -6.530 8.944 1.00 0.62 C ATOM 373 NZ LYS A 26 -17.761 -7.707 9.807 1.00 1.10 N ATOM 0 H LYS A 26 -19.352 -1.614 9.065 1.00 0.22 H new ATOM 0 HA LYS A 26 -16.760 -1.776 7.652 1.00 0.19 H new ATOM 0 HB2 LYS A 26 -18.754 -3.956 8.348 1.00 0.20 H new ATOM 0 HB3 LYS A 26 -17.669 -4.115 6.981 1.00 0.20 H new ATOM 0 HG2 LYS A 26 -15.831 -4.459 8.293 1.00 0.25 H new ATOM 0 HG3 LYS A 26 -16.350 -3.316 9.516 1.00 0.25 H new ATOM 0 HD2 LYS A 26 -16.385 -5.523 10.497 1.00 0.62 H new ATOM 0 HD3 LYS A 26 -18.043 -4.985 10.318 1.00 0.62 H new ATOM 0 HE2 LYS A 26 -18.326 -6.332 8.299 1.00 0.62 H new ATOM 0 HE3 LYS A 26 -16.626 -6.758 8.292 1.00 0.62 H new ATOM 0 HZ1 LYS A 26 -17.970 -8.532 9.210 1.00 1.10 H new ATOM 0 HZ2 LYS A 26 -16.935 -7.912 10.404 1.00 1.10 H new ATOM 0 HZ3 LYS A 26 -18.582 -7.500 10.411 1.00 1.10 H new ATOM 387 N ILE A 27 -17.919 -1.807 5.374 1.00 0.22 N ATOM 388 CA ILE A 27 -18.559 -1.458 4.108 1.00 0.26 C ATOM 389 C ILE A 27 -18.672 -2.669 3.186 1.00 0.24 C ATOM 390 O ILE A 27 -17.713 -3.418 3.009 1.00 0.25 O ATOM 391 CB ILE A 27 -17.789 -0.343 3.378 1.00 0.34 C ATOM 392 CG1 ILE A 27 -16.334 -0.760 3.153 1.00 0.40 C ATOM 393 CG2 ILE A 27 -17.862 0.950 4.173 1.00 0.33 C ATOM 394 CD1 ILE A 27 -15.546 0.217 2.312 1.00 0.50 C ATOM 0 H ILE A 27 -16.948 -2.106 5.286 1.00 0.22 H new ATOM 0 HA ILE A 27 -19.559 -1.102 4.353 1.00 0.26 H new ATOM 0 HB ILE A 27 -18.250 -0.176 2.404 1.00 0.34 H new ATOM 0 HG12 ILE A 27 -15.844 -0.872 4.120 1.00 0.40 H new ATOM 0 HG13 ILE A 27 -16.316 -1.738 2.671 1.00 0.40 H new ATOM 0 HG21 ILE A 27 -17.314 1.732 3.647 1.00 0.33 H new ATOM 0 HG22 ILE A 27 -18.904 1.250 4.285 1.00 0.33 H new ATOM 0 HG23 ILE A 27 -17.421 0.797 5.158 1.00 0.33 H new ATOM 0 HD11 ILE A 27 -14.524 -0.145 2.195 1.00 0.50 H new ATOM 0 HD12 ILE A 27 -16.012 0.311 1.331 1.00 0.50 H new ATOM 0 HD13 ILE A 27 -15.532 1.191 2.802 1.00 0.50 H new ATOM 406 N ALA A 28 -19.852 -2.850 2.599 1.00 0.26 N ATOM 407 CA ALA A 28 -20.106 -3.971 1.697 1.00 0.26 C ATOM 408 C ALA A 28 -19.008 -4.110 0.647 1.00 0.23 C ATOM 409 O ALA A 28 -18.473 -3.119 0.152 1.00 0.25 O ATOM 410 CB ALA A 28 -21.459 -3.799 1.023 1.00 0.30 C ATOM 0 H ALA A 28 -20.652 -2.231 2.733 1.00 0.26 H new ATOM 0 HA ALA A 28 -20.111 -4.884 2.292 1.00 0.26 H new ATOM 0 HB1 ALA A 28 -21.641 -4.639 0.352 1.00 0.30 H new ATOM 0 HB2 ALA A 28 -22.241 -3.764 1.781 1.00 0.30 H new ATOM 0 HB3 ALA A 28 -21.466 -2.871 0.452 1.00 0.30 H new ATOM 416 N THR A 29 -18.683 -5.358 0.314 1.00 0.27 N ATOM 417 CA THR A 29 -17.648 -5.656 -0.670 1.00 0.30 C ATOM 418 C THR A 29 -18.074 -5.251 -2.078 1.00 0.29 C ATOM 419 O THR A 29 -17.237 -4.911 -2.913 1.00 0.39 O ATOM 420 CB THR A 29 -17.294 -7.156 -0.676 1.00 0.37 C ATOM 421 OG1 THR A 29 -18.440 -7.928 -1.055 1.00 1.03 O ATOM 422 CG2 THR A 29 -16.807 -7.606 0.693 1.00 0.96 C ATOM 0 H THR A 29 -19.127 -6.184 0.716 1.00 0.27 H new ATOM 0 HA THR A 29 -16.773 -5.075 -0.379 1.00 0.30 H new ATOM 0 HB THR A 29 -16.493 -7.313 -1.398 1.00 0.37 H new ATOM 0 HG1 THR A 29 -18.207 -8.880 -1.058 1.00 1.03 H new ATOM 0 HG21 THR A 29 -16.564 -8.668 0.662 1.00 0.96 H new ATOM 0 HG22 THR A 29 -15.918 -7.038 0.968 1.00 0.96 H new ATOM 0 HG23 THR A 29 -17.590 -7.435 1.432 1.00 0.96 H new ATOM 430 N ARG A 30 -19.377 -5.296 -2.337 1.00 0.25 N ATOM 431 CA ARG A 30 -19.905 -4.942 -3.649 1.00 0.29 C ATOM 432 C ARG A 30 -20.144 -3.438 -3.758 1.00 0.28 C ATOM 433 O ARG A 30 -20.596 -2.944 -4.792 1.00 0.44 O ATOM 434 CB ARG A 30 -21.206 -5.701 -3.922 1.00 0.35 C ATOM 435 CG ARG A 30 -21.097 -7.205 -3.707 1.00 0.43 C ATOM 436 CD ARG A 30 -21.394 -7.585 -2.266 1.00 0.83 C ATOM 437 NE ARG A 30 -22.763 -7.255 -1.886 1.00 1.56 N ATOM 438 CZ ARG A 30 -23.212 -7.295 -0.635 1.00 2.17 C ATOM 439 NH1 ARG A 30 -22.401 -7.639 0.355 1.00 2.25 N ATOM 440 NH2 ARG A 30 -24.475 -6.986 -0.373 1.00 3.08 N ATOM 0 H ARG A 30 -20.085 -5.574 -1.657 1.00 0.25 H new ATOM 0 HA ARG A 30 -19.164 -5.225 -4.397 1.00 0.29 H new ATOM 0 HB2 ARG A 30 -21.989 -5.307 -3.274 1.00 0.35 H new ATOM 0 HB3 ARG A 30 -21.517 -5.512 -4.949 1.00 0.35 H new ATOM 0 HG2 ARG A 30 -21.792 -7.720 -4.371 1.00 0.43 H new ATOM 0 HG3 ARG A 30 -20.095 -7.540 -3.973 1.00 0.43 H new ATOM 0 HD2 ARG A 30 -21.228 -8.654 -2.131 1.00 0.83 H new ATOM 0 HD3 ARG A 30 -20.699 -7.068 -1.604 1.00 0.83 H new ATOM 0 HE ARG A 30 -23.413 -6.978 -2.622 1.00 1.56 H new ATOM 0 HH11 ARG A 30 -21.428 -7.874 0.159 1.00 2.25 H new ATOM 0 HH12 ARG A 30 -22.750 -7.668 1.313 1.00 2.25 H new ATOM 0 HH21 ARG A 30 -25.102 -6.718 -1.131 1.00 3.08 H new ATOM 0 HH22 ARG A 30 -24.819 -7.017 0.587 1.00 3.08 H new ATOM 454 N GLU A 31 -19.835 -2.717 -2.684 1.00 0.22 N ATOM 455 CA GLU A 31 -20.009 -1.267 -2.650 1.00 0.23 C ATOM 456 C GLU A 31 -18.659 -0.558 -2.664 1.00 0.21 C ATOM 457 O GLU A 31 -18.594 0.672 -2.707 1.00 0.21 O ATOM 458 CB GLU A 31 -20.800 -0.859 -1.404 1.00 0.30 C ATOM 459 CG GLU A 31 -22.310 -0.918 -1.585 1.00 0.32 C ATOM 460 CD GLU A 31 -22.784 -2.222 -2.197 1.00 1.30 C ATOM 461 OE1 GLU A 31 -22.853 -2.304 -3.442 1.00 1.40 O ATOM 462 OE2 GLU A 31 -23.080 -3.163 -1.433 1.00 2.26 O ATOM 0 H GLU A 31 -19.461 -3.115 -1.822 1.00 0.22 H new ATOM 0 HA GLU A 31 -20.564 -0.970 -3.539 1.00 0.23 H new ATOM 0 HB2 GLU A 31 -20.517 -1.510 -0.577 1.00 0.30 H new ATOM 0 HB3 GLU A 31 -20.517 0.155 -1.122 1.00 0.30 H new ATOM 0 HG2 GLU A 31 -22.792 -0.781 -0.617 1.00 0.32 H new ATOM 0 HG3 GLU A 31 -22.627 -0.090 -2.219 1.00 0.32 H new ATOM 469 N LEU A 32 -17.584 -1.340 -2.629 1.00 0.21 N ATOM 470 CA LEU A 32 -16.235 -0.786 -2.639 1.00 0.24 C ATOM 471 C LEU A 32 -15.992 0.014 -3.916 1.00 0.23 C ATOM 472 O LEU A 32 -15.568 1.171 -3.861 1.00 0.25 O ATOM 473 CB LEU A 32 -15.199 -1.911 -2.507 1.00 0.29 C ATOM 474 CG LEU A 32 -13.822 -1.496 -1.969 1.00 0.44 C ATOM 475 CD1 LEU A 32 -13.054 -0.685 -3.001 1.00 1.04 C ATOM 476 CD2 LEU A 32 -13.964 -0.709 -0.675 1.00 1.37 C ATOM 0 H LEU A 32 -17.621 -2.359 -2.593 1.00 0.21 H new ATOM 0 HA LEU A 32 -16.131 -0.113 -1.788 1.00 0.24 H new ATOM 0 HB2 LEU A 32 -15.607 -2.679 -1.850 1.00 0.29 H new ATOM 0 HB3 LEU A 32 -15.062 -2.369 -3.487 1.00 0.29 H new ATOM 0 HG LEU A 32 -13.257 -2.405 -1.761 1.00 0.44 H new ATOM 0 HD11 LEU A 32 -12.083 -0.404 -2.594 1.00 1.04 H new ATOM 0 HD12 LEU A 32 -12.911 -1.283 -3.901 1.00 1.04 H new ATOM 0 HD13 LEU A 32 -13.617 0.215 -3.249 1.00 1.04 H new ATOM 0 HD21 LEU A 32 -12.976 -0.425 -0.312 1.00 1.37 H new ATOM 0 HD22 LEU A 32 -14.555 0.188 -0.858 1.00 1.37 H new ATOM 0 HD23 LEU A 32 -14.462 -1.326 0.073 1.00 1.37 H new ATOM 488 N GLY A 33 -16.257 -0.606 -5.063 1.00 0.25 N ATOM 489 CA GLY A 33 -16.070 0.074 -6.332 1.00 0.28 C ATOM 490 C GLY A 33 -16.785 1.408 -6.361 1.00 0.27 C ATOM 491 O GLY A 33 -16.253 2.399 -6.859 1.00 0.32 O ATOM 0 H GLY A 33 -16.597 -1.565 -5.136 1.00 0.25 H new ATOM 0 HA2 GLY A 33 -15.006 0.227 -6.510 1.00 0.28 H new ATOM 0 HA3 GLY A 33 -16.441 -0.556 -7.141 1.00 0.28 H new ATOM 495 N THR A 34 -17.997 1.425 -5.817 1.00 0.23 N ATOM 496 CA THR A 34 -18.792 2.642 -5.757 1.00 0.24 C ATOM 497 C THR A 34 -18.108 3.675 -4.868 1.00 0.22 C ATOM 498 O THR A 34 -18.174 4.878 -5.126 1.00 0.23 O ATOM 499 CB THR A 34 -20.205 2.357 -5.213 1.00 0.26 C ATOM 500 OG1 THR A 34 -20.857 1.383 -6.036 1.00 0.31 O ATOM 501 CG2 THR A 34 -21.040 3.629 -5.168 1.00 0.29 C ATOM 0 H THR A 34 -18.450 0.606 -5.411 1.00 0.23 H new ATOM 0 HA THR A 34 -18.880 3.032 -6.771 1.00 0.24 H new ATOM 0 HB THR A 34 -20.107 1.972 -4.198 1.00 0.26 H new ATOM 0 HG1 THR A 34 -21.754 1.205 -5.684 1.00 0.31 H new ATOM 0 HG21 THR A 34 -22.032 3.399 -4.780 1.00 0.29 H new ATOM 0 HG22 THR A 34 -20.557 4.359 -4.518 1.00 0.29 H new ATOM 0 HG23 THR A 34 -21.130 4.041 -6.173 1.00 0.29 H new ATOM 509 N LEU A 35 -17.446 3.188 -3.821 1.00 0.22 N ATOM 510 CA LEU A 35 -16.740 4.056 -2.889 1.00 0.24 C ATOM 511 C LEU A 35 -15.555 4.727 -3.576 1.00 0.25 C ATOM 512 O LEU A 35 -15.088 5.781 -3.144 1.00 0.29 O ATOM 513 CB LEU A 35 -16.272 3.255 -1.669 1.00 0.29 C ATOM 514 CG LEU A 35 -15.491 4.047 -0.614 1.00 0.42 C ATOM 515 CD1 LEU A 35 -16.257 5.291 -0.189 1.00 1.24 C ATOM 516 CD2 LEU A 35 -15.200 3.169 0.592 1.00 1.16 C ATOM 0 H LEU A 35 -17.385 2.194 -3.599 1.00 0.22 H new ATOM 0 HA LEU A 35 -17.425 4.834 -2.552 1.00 0.24 H new ATOM 0 HB2 LEU A 35 -17.146 2.812 -1.191 1.00 0.29 H new ATOM 0 HB3 LEU A 35 -15.647 2.432 -2.016 1.00 0.29 H new ATOM 0 HG LEU A 35 -14.547 4.365 -1.056 1.00 0.42 H new ATOM 0 HD11 LEU A 35 -15.681 5.835 0.560 1.00 1.24 H new ATOM 0 HD12 LEU A 35 -16.421 5.931 -1.056 1.00 1.24 H new ATOM 0 HD13 LEU A 35 -17.218 5.000 0.234 1.00 1.24 H new ATOM 0 HD21 LEU A 35 -14.645 3.743 1.334 1.00 1.16 H new ATOM 0 HD22 LEU A 35 -16.139 2.825 1.027 1.00 1.16 H new ATOM 0 HD23 LEU A 35 -14.607 2.309 0.281 1.00 1.16 H new ATOM 528 N MET A 36 -15.064 4.103 -4.644 1.00 0.28 N ATOM 529 CA MET A 36 -13.947 4.654 -5.405 1.00 0.32 C ATOM 530 C MET A 36 -14.439 5.760 -6.326 1.00 0.30 C ATOM 531 O MET A 36 -13.771 6.775 -6.507 1.00 0.40 O ATOM 532 CB MET A 36 -13.273 3.565 -6.237 1.00 0.45 C ATOM 533 CG MET A 36 -12.558 2.516 -5.408 1.00 0.51 C ATOM 534 SD MET A 36 -11.176 3.197 -4.477 1.00 1.10 S ATOM 535 CE MET A 36 -10.464 1.698 -3.817 1.00 0.69 C ATOM 0 H MET A 36 -15.422 3.217 -5.001 1.00 0.28 H new ATOM 0 HA MET A 36 -13.222 5.061 -4.700 1.00 0.32 H new ATOM 0 HB2 MET A 36 -14.025 3.075 -6.855 1.00 0.45 H new ATOM 0 HB3 MET A 36 -12.557 4.030 -6.915 1.00 0.45 H new ATOM 0 HG2 MET A 36 -13.266 2.058 -4.718 1.00 0.51 H new ATOM 0 HG3 MET A 36 -12.195 1.725 -6.064 1.00 0.51 H new ATOM 0 HE1 MET A 36 -9.378 1.785 -3.806 1.00 0.69 H new ATOM 0 HE2 MET A 36 -10.825 1.540 -2.801 1.00 0.69 H new ATOM 0 HE3 MET A 36 -10.754 0.852 -4.441 1.00 0.69 H new ATOM 545 N ARG A 37 -15.610 5.543 -6.911 1.00 0.30 N ATOM 546 CA ARG A 37 -16.209 6.514 -7.820 1.00 0.34 C ATOM 547 C ARG A 37 -16.432 7.853 -7.123 1.00 0.33 C ATOM 548 O ARG A 37 -16.161 8.912 -7.693 1.00 0.43 O ATOM 549 CB ARG A 37 -17.535 5.977 -8.363 1.00 0.44 C ATOM 550 CG ARG A 37 -17.407 4.621 -9.039 1.00 0.64 C ATOM 551 CD ARG A 37 -18.762 4.060 -9.436 1.00 0.70 C ATOM 552 NE ARG A 37 -18.656 2.697 -9.949 1.00 1.40 N ATOM 553 CZ ARG A 37 -19.495 2.173 -10.838 1.00 1.73 C ATOM 554 NH1 ARG A 37 -20.498 2.897 -11.316 1.00 1.52 N ATOM 555 NH2 ARG A 37 -19.330 0.923 -11.250 1.00 2.69 N ATOM 0 H ARG A 37 -16.167 4.700 -6.772 1.00 0.30 H new ATOM 0 HA ARG A 37 -15.520 6.673 -8.650 1.00 0.34 H new ATOM 0 HB2 ARG A 37 -18.250 5.900 -7.544 1.00 0.44 H new ATOM 0 HB3 ARG A 37 -17.943 6.693 -9.076 1.00 0.44 H new ATOM 0 HG2 ARG A 37 -16.778 4.714 -9.924 1.00 0.64 H new ATOM 0 HG3 ARG A 37 -16.908 3.924 -8.365 1.00 0.64 H new ATOM 0 HD2 ARG A 37 -19.428 4.073 -8.573 1.00 0.70 H new ATOM 0 HD3 ARG A 37 -19.212 4.700 -10.195 1.00 0.70 H new ATOM 0 HE ARG A 37 -17.894 2.113 -9.605 1.00 1.40 H new ATOM 0 HH11 ARG A 37 -20.628 3.859 -11.002 1.00 1.52 H new ATOM 0 HH12 ARG A 37 -21.140 2.492 -11.998 1.00 1.52 H new ATOM 0 HH21 ARG A 37 -18.559 0.363 -10.885 1.00 2.69 H new ATOM 0 HH22 ARG A 37 -19.974 0.522 -11.932 1.00 2.69 H new ATOM 569 N THR A 38 -16.927 7.802 -5.890 1.00 0.31 N ATOM 570 CA THR A 38 -17.183 9.014 -5.117 1.00 0.39 C ATOM 571 C THR A 38 -15.881 9.688 -4.689 1.00 0.36 C ATOM 572 O THR A 38 -15.880 10.836 -4.247 1.00 0.43 O ATOM 573 CB THR A 38 -18.045 8.725 -3.873 1.00 0.50 C ATOM 574 OG1 THR A 38 -18.079 9.876 -3.019 1.00 1.06 O ATOM 575 CG2 THR A 38 -17.511 7.528 -3.105 1.00 0.61 C ATOM 0 H THR A 38 -17.159 6.935 -5.405 1.00 0.31 H new ATOM 0 HA THR A 38 -17.733 9.690 -5.772 1.00 0.39 H new ATOM 0 HB THR A 38 -19.056 8.494 -4.208 1.00 0.50 H new ATOM 0 HG1 THR A 38 -17.560 10.601 -3.426 1.00 1.06 H new ATOM 0 HG21 THR A 38 -18.138 7.347 -2.232 1.00 0.61 H new ATOM 0 HG22 THR A 38 -17.522 6.648 -3.749 1.00 0.61 H new ATOM 0 HG23 THR A 38 -16.489 7.729 -2.782 1.00 0.61 H new ATOM 583 N LEU A 39 -14.773 8.965 -4.826 1.00 0.30 N ATOM 584 CA LEU A 39 -13.460 9.486 -4.456 1.00 0.33 C ATOM 585 C LEU A 39 -12.585 9.663 -5.693 1.00 0.33 C ATOM 586 O LEU A 39 -12.821 9.040 -6.727 1.00 0.31 O ATOM 587 CB LEU A 39 -12.767 8.553 -3.459 1.00 0.38 C ATOM 588 CG LEU A 39 -13.069 8.828 -1.982 1.00 0.64 C ATOM 589 CD1 LEU A 39 -14.550 8.662 -1.686 1.00 1.26 C ATOM 590 CD2 LEU A 39 -12.242 7.911 -1.092 1.00 1.07 C ATOM 0 H LEU A 39 -14.758 8.013 -5.192 1.00 0.30 H new ATOM 0 HA LEU A 39 -13.605 10.458 -3.984 1.00 0.33 H new ATOM 0 HB2 LEU A 39 -13.056 7.527 -3.686 1.00 0.38 H new ATOM 0 HB3 LEU A 39 -11.690 8.622 -3.611 1.00 0.38 H new ATOM 0 HG LEU A 39 -12.797 9.862 -1.768 1.00 0.64 H new ATOM 0 HD11 LEU A 39 -14.735 8.863 -0.631 1.00 1.26 H new ATOM 0 HD12 LEU A 39 -15.123 9.361 -2.295 1.00 1.26 H new ATOM 0 HD13 LEU A 39 -14.856 7.642 -1.920 1.00 1.26 H new ATOM 0 HD21 LEU A 39 -12.468 8.119 -0.046 1.00 1.07 H new ATOM 0 HD22 LEU A 39 -12.483 6.872 -1.316 1.00 1.07 H new ATOM 0 HD23 LEU A 39 -11.182 8.085 -1.276 1.00 1.07 H new ATOM 602 N GLY A 40 -11.587 10.537 -5.582 1.00 0.42 N ATOM 603 CA GLY A 40 -10.688 10.799 -6.695 1.00 0.47 C ATOM 604 C GLY A 40 -10.151 9.537 -7.348 1.00 0.43 C ATOM 605 O GLY A 40 -9.679 9.581 -8.485 1.00 0.69 O ATOM 0 H GLY A 40 -11.384 11.071 -4.737 1.00 0.42 H new ATOM 0 HA2 GLY A 40 -11.213 11.392 -7.444 1.00 0.47 H new ATOM 0 HA3 GLY A 40 -9.851 11.401 -6.342 1.00 0.47 H new ATOM 609 N GLN A 41 -10.217 8.415 -6.636 1.00 0.44 N ATOM 610 CA GLN A 41 -9.733 7.146 -7.173 1.00 0.40 C ATOM 611 C GLN A 41 -10.471 6.782 -8.458 1.00 0.51 C ATOM 612 O GLN A 41 -11.481 7.397 -8.803 1.00 1.45 O ATOM 613 CB GLN A 41 -9.907 6.021 -6.150 1.00 0.48 C ATOM 614 CG GLN A 41 -9.131 6.227 -4.859 1.00 0.74 C ATOM 615 CD GLN A 41 -7.689 6.634 -5.089 1.00 1.06 C ATOM 616 OE1 GLN A 41 -7.074 6.262 -6.089 1.00 1.97 O ATOM 617 NE2 GLN A 41 -7.141 7.401 -4.154 1.00 1.30 N ATOM 0 H GLN A 41 -10.598 8.358 -5.692 1.00 0.44 H new ATOM 0 HA GLN A 41 -8.672 7.266 -7.394 1.00 0.40 H new ATOM 0 HB2 GLN A 41 -10.966 5.922 -5.912 1.00 0.48 H new ATOM 0 HB3 GLN A 41 -9.593 5.081 -6.604 1.00 0.48 H new ATOM 0 HG2 GLN A 41 -9.627 6.992 -4.262 1.00 0.74 H new ATOM 0 HG3 GLN A 41 -9.154 5.305 -4.278 1.00 0.74 H new ATOM 0 HE21 GLN A 41 -7.689 7.685 -3.342 1.00 1.30 H new ATOM 0 HE22 GLN A 41 -6.172 7.706 -4.248 1.00 1.30 H new ATOM 626 N ASN A 42 -9.959 5.776 -9.161 1.00 0.74 N ATOM 627 CA ASN A 42 -10.570 5.320 -10.404 1.00 0.68 C ATOM 628 C ASN A 42 -9.931 4.014 -10.875 1.00 0.53 C ATOM 629 O ASN A 42 -9.295 3.970 -11.929 1.00 0.62 O ATOM 630 CB ASN A 42 -10.437 6.394 -11.487 1.00 0.85 C ATOM 631 CG ASN A 42 -11.322 6.120 -12.687 1.00 1.87 C ATOM 632 OD1 ASN A 42 -12.476 6.548 -12.732 1.00 2.57 O ATOM 633 ND2 ASN A 42 -10.785 5.407 -13.670 1.00 2.66 N ATOM 0 H ASN A 42 -9.121 5.261 -8.890 1.00 0.74 H new ATOM 0 HA ASN A 42 -11.628 5.137 -10.217 1.00 0.68 H new ATOM 0 HB2 ASN A 42 -10.694 7.365 -11.064 1.00 0.85 H new ATOM 0 HB3 ASN A 42 -9.398 6.452 -11.811 1.00 0.85 H new ATOM 0 HD21 ASN A 42 -11.333 5.194 -14.504 1.00 2.66 H new ATOM 0 HD22 ASN A 42 -9.825 5.072 -13.591 1.00 2.66 H new ATOM 640 N PRO A 43 -10.087 2.932 -10.091 1.00 0.41 N ATOM 641 CA PRO A 43 -9.525 1.620 -10.432 1.00 0.40 C ATOM 642 C PRO A 43 -10.144 1.032 -11.695 1.00 0.39 C ATOM 643 O PRO A 43 -11.273 1.363 -12.056 1.00 0.51 O ATOM 644 CB PRO A 43 -9.869 0.748 -9.221 1.00 0.44 C ATOM 645 CG PRO A 43 -11.018 1.435 -8.565 1.00 0.45 C ATOM 646 CD PRO A 43 -10.819 2.900 -8.811 1.00 0.44 C ATOM 0 HA PRO A 43 -8.456 1.684 -10.637 1.00 0.40 H new ATOM 0 HB2 PRO A 43 -10.136 -0.264 -9.526 1.00 0.44 H new ATOM 0 HB3 PRO A 43 -9.020 0.663 -8.542 1.00 0.44 H new ATOM 0 HG2 PRO A 43 -11.966 1.095 -8.982 1.00 0.45 H new ATOM 0 HG3 PRO A 43 -11.044 1.219 -7.497 1.00 0.45 H new ATOM 0 HD2 PRO A 43 -11.769 3.430 -8.878 1.00 0.44 H new ATOM 0 HD3 PRO A 43 -10.248 3.369 -8.009 1.00 0.44 H new ATOM 654 N THR A 44 -9.395 0.158 -12.359 1.00 0.35 N ATOM 655 CA THR A 44 -9.867 -0.483 -13.579 1.00 0.36 C ATOM 656 C THR A 44 -10.794 -1.650 -13.251 1.00 0.32 C ATOM 657 O THR A 44 -10.735 -2.203 -12.152 1.00 0.33 O ATOM 658 CB THR A 44 -8.691 -0.992 -14.436 1.00 0.43 C ATOM 659 OG1 THR A 44 -7.722 0.050 -14.603 1.00 0.73 O ATOM 660 CG2 THR A 44 -9.171 -1.460 -15.802 1.00 0.69 C ATOM 0 H THR A 44 -8.457 -0.122 -12.072 1.00 0.35 H new ATOM 0 HA THR A 44 -10.416 0.267 -14.148 1.00 0.36 H new ATOM 0 HB THR A 44 -8.238 -1.838 -13.919 1.00 0.43 H new ATOM 0 HG1 THR A 44 -6.977 -0.280 -15.147 1.00 0.73 H new ATOM 0 HG21 THR A 44 -8.321 -1.814 -16.385 1.00 0.69 H new ATOM 0 HG22 THR A 44 -9.888 -2.271 -15.677 1.00 0.69 H new ATOM 0 HG23 THR A 44 -9.649 -0.631 -16.324 1.00 0.69 H new ATOM 668 N GLU A 45 -11.648 -2.016 -14.202 1.00 0.32 N ATOM 669 CA GLU A 45 -12.591 -3.114 -14.008 1.00 0.33 C ATOM 670 C GLU A 45 -11.903 -4.338 -13.406 1.00 0.32 C ATOM 671 O GLU A 45 -12.383 -4.909 -12.427 1.00 0.34 O ATOM 672 CB GLU A 45 -13.250 -3.490 -15.336 1.00 0.40 C ATOM 673 CG GLU A 45 -14.276 -4.604 -15.212 1.00 1.14 C ATOM 674 CD GLU A 45 -14.896 -4.978 -16.544 1.00 1.84 C ATOM 675 OE1 GLU A 45 -15.901 -4.344 -16.930 1.00 2.04 O ATOM 676 OE2 GLU A 45 -14.377 -5.904 -17.200 1.00 2.70 O ATOM 0 H GLU A 45 -11.707 -1.568 -15.116 1.00 0.32 H new ATOM 0 HA GLU A 45 -13.356 -2.775 -13.310 1.00 0.33 H new ATOM 0 HB2 GLU A 45 -13.733 -2.607 -15.755 1.00 0.40 H new ATOM 0 HB3 GLU A 45 -12.478 -3.796 -16.042 1.00 0.40 H new ATOM 0 HG2 GLU A 45 -13.801 -5.483 -14.777 1.00 1.14 H new ATOM 0 HG3 GLU A 45 -15.062 -4.293 -14.524 1.00 1.14 H new ATOM 683 N ALA A 46 -10.775 -4.726 -13.994 1.00 0.33 N ATOM 684 CA ALA A 46 -10.023 -5.886 -13.521 1.00 0.37 C ATOM 685 C ALA A 46 -9.720 -5.786 -12.030 1.00 0.33 C ATOM 686 O ALA A 46 -10.055 -6.687 -11.261 1.00 0.34 O ATOM 687 CB ALA A 46 -8.731 -6.034 -14.310 1.00 0.46 C ATOM 0 H ALA A 46 -10.361 -4.255 -14.798 1.00 0.33 H new ATOM 0 HA ALA A 46 -10.641 -6.770 -13.678 1.00 0.37 H new ATOM 0 HB1 ALA A 46 -8.181 -6.902 -13.947 1.00 0.46 H new ATOM 0 HB2 ALA A 46 -8.963 -6.167 -15.367 1.00 0.46 H new ATOM 0 HB3 ALA A 46 -8.122 -5.139 -14.182 1.00 0.46 H new ATOM 693 N GLU A 47 -9.085 -4.687 -11.630 1.00 0.32 N ATOM 694 CA GLU A 47 -8.734 -4.469 -10.229 1.00 0.32 C ATOM 695 C GLU A 47 -9.940 -4.680 -9.324 1.00 0.28 C ATOM 696 O GLU A 47 -9.869 -5.424 -8.345 1.00 0.28 O ATOM 697 CB GLU A 47 -8.178 -3.056 -10.036 1.00 0.37 C ATOM 698 CG GLU A 47 -7.754 -2.758 -8.606 1.00 0.43 C ATOM 699 CD GLU A 47 -6.670 -3.695 -8.111 1.00 1.24 C ATOM 700 OE1 GLU A 47 -5.479 -3.389 -8.325 1.00 1.27 O ATOM 701 OE2 GLU A 47 -7.014 -4.735 -7.510 1.00 2.23 O ATOM 0 H GLU A 47 -8.803 -3.933 -12.257 1.00 0.32 H new ATOM 0 HA GLU A 47 -7.969 -5.196 -9.956 1.00 0.32 H new ATOM 0 HB2 GLU A 47 -7.322 -2.918 -10.696 1.00 0.37 H new ATOM 0 HB3 GLU A 47 -8.934 -2.332 -10.340 1.00 0.37 H new ATOM 0 HG2 GLU A 47 -7.397 -1.730 -8.544 1.00 0.43 H new ATOM 0 HG3 GLU A 47 -8.622 -2.834 -7.951 1.00 0.43 H new ATOM 708 N LEU A 48 -11.048 -4.029 -9.659 1.00 0.29 N ATOM 709 CA LEU A 48 -12.270 -4.145 -8.871 1.00 0.31 C ATOM 710 C LEU A 48 -12.725 -5.598 -8.785 1.00 0.30 C ATOM 711 O LEU A 48 -13.161 -6.058 -7.730 1.00 0.35 O ATOM 712 CB LEU A 48 -13.379 -3.282 -9.479 1.00 0.35 C ATOM 713 CG LEU A 48 -14.037 -2.288 -8.516 1.00 0.65 C ATOM 714 CD1 LEU A 48 -14.684 -3.016 -7.348 1.00 1.34 C ATOM 715 CD2 LEU A 48 -13.019 -1.275 -8.014 1.00 1.36 C ATOM 0 H LEU A 48 -11.126 -3.416 -10.470 1.00 0.29 H new ATOM 0 HA LEU A 48 -12.058 -3.790 -7.862 1.00 0.31 H new ATOM 0 HB2 LEU A 48 -12.965 -2.727 -10.321 1.00 0.35 H new ATOM 0 HB3 LEU A 48 -14.150 -3.940 -9.879 1.00 0.35 H new ATOM 0 HG LEU A 48 -14.816 -1.754 -9.060 1.00 0.65 H new ATOM 0 HD11 LEU A 48 -15.145 -2.291 -6.677 1.00 1.34 H new ATOM 0 HD12 LEU A 48 -15.446 -3.699 -7.722 1.00 1.34 H new ATOM 0 HD13 LEU A 48 -13.925 -3.580 -6.806 1.00 1.34 H new ATOM 0 HD21 LEU A 48 -13.505 -0.578 -7.332 1.00 1.36 H new ATOM 0 HD22 LEU A 48 -12.216 -1.795 -7.491 1.00 1.36 H new ATOM 0 HD23 LEU A 48 -12.605 -0.726 -8.860 1.00 1.36 H new ATOM 727 N GLN A 49 -12.618 -6.318 -9.897 1.00 0.30 N ATOM 728 CA GLN A 49 -13.019 -7.720 -9.941 1.00 0.35 C ATOM 729 C GLN A 49 -12.097 -8.579 -9.081 1.00 0.35 C ATOM 730 O GLN A 49 -12.513 -9.604 -8.541 1.00 0.38 O ATOM 731 CB GLN A 49 -13.012 -8.231 -11.384 1.00 0.41 C ATOM 732 CG GLN A 49 -14.053 -7.566 -12.271 1.00 0.48 C ATOM 733 CD GLN A 49 -15.472 -7.842 -11.813 1.00 0.78 C ATOM 734 OE1 GLN A 49 -15.759 -8.891 -11.238 1.00 1.22 O ATOM 735 NE2 GLN A 49 -16.368 -6.894 -12.063 1.00 1.19 N ATOM 0 H GLN A 49 -12.257 -5.954 -10.779 1.00 0.30 H new ATOM 0 HA GLN A 49 -14.031 -7.793 -9.542 1.00 0.35 H new ATOM 0 HB2 GLN A 49 -12.024 -8.068 -11.813 1.00 0.41 H new ATOM 0 HB3 GLN A 49 -13.184 -9.307 -11.380 1.00 0.41 H new ATOM 0 HG2 GLN A 49 -13.882 -6.490 -12.282 1.00 0.48 H new ATOM 0 HG3 GLN A 49 -13.931 -7.918 -13.295 1.00 0.48 H new ATOM 0 HE21 GLN A 49 -16.086 -6.039 -12.543 1.00 1.19 H new ATOM 0 HE22 GLN A 49 -17.338 -7.021 -11.775 1.00 1.19 H new ATOM 744 N ASP A 50 -10.844 -8.153 -8.957 1.00 0.34 N ATOM 745 CA ASP A 50 -9.862 -8.886 -8.165 1.00 0.38 C ATOM 746 C ASP A 50 -10.158 -8.783 -6.670 1.00 0.35 C ATOM 747 O ASP A 50 -10.187 -9.791 -5.965 1.00 0.39 O ATOM 748 CB ASP A 50 -8.452 -8.366 -8.453 1.00 0.43 C ATOM 749 CG ASP A 50 -7.938 -8.803 -9.811 1.00 0.49 C ATOM 750 OD1 ASP A 50 -7.642 -10.005 -9.974 1.00 0.62 O ATOM 751 OD2 ASP A 50 -7.828 -7.944 -10.710 1.00 0.53 O ATOM 0 H ASP A 50 -10.485 -7.305 -9.394 1.00 0.34 H new ATOM 0 HA ASP A 50 -9.925 -9.936 -8.451 1.00 0.38 H new ATOM 0 HB2 ASP A 50 -8.452 -7.277 -8.401 1.00 0.43 H new ATOM 0 HB3 ASP A 50 -7.772 -8.722 -7.679 1.00 0.43 H new ATOM 756 N LEU A 51 -10.380 -7.562 -6.192 1.00 0.32 N ATOM 757 CA LEU A 51 -10.660 -7.338 -4.776 1.00 0.33 C ATOM 758 C LEU A 51 -12.061 -7.812 -4.398 1.00 0.32 C ATOM 759 O LEU A 51 -12.304 -8.186 -3.251 1.00 0.35 O ATOM 760 CB LEU A 51 -10.485 -5.862 -4.422 1.00 0.36 C ATOM 761 CG LEU A 51 -11.209 -4.883 -5.343 1.00 0.30 C ATOM 762 CD1 LEU A 51 -12.393 -4.251 -4.627 1.00 0.39 C ATOM 763 CD2 LEU A 51 -10.245 -3.817 -5.836 1.00 0.31 C ATOM 0 H LEU A 51 -10.372 -6.715 -6.761 1.00 0.32 H new ATOM 0 HA LEU A 51 -9.944 -7.926 -4.202 1.00 0.33 H new ATOM 0 HB2 LEU A 51 -10.837 -5.705 -3.402 1.00 0.36 H new ATOM 0 HB3 LEU A 51 -9.421 -5.626 -4.432 1.00 0.36 H new ATOM 0 HG LEU A 51 -11.589 -5.431 -6.205 1.00 0.30 H new ATOM 0 HD11 LEU A 51 -12.896 -3.556 -5.299 1.00 0.39 H new ATOM 0 HD12 LEU A 51 -13.091 -5.030 -4.321 1.00 0.39 H new ATOM 0 HD13 LEU A 51 -12.041 -3.713 -3.747 1.00 0.39 H new ATOM 0 HD21 LEU A 51 -10.773 -3.125 -6.492 1.00 0.31 H new ATOM 0 HD22 LEU A 51 -9.839 -3.272 -4.984 1.00 0.31 H new ATOM 0 HD23 LEU A 51 -9.431 -4.289 -6.386 1.00 0.31 H new ATOM 775 N ILE A 52 -12.984 -7.790 -5.357 1.00 0.31 N ATOM 776 CA ILE A 52 -14.350 -8.234 -5.099 1.00 0.34 C ATOM 777 C ILE A 52 -14.389 -9.745 -4.902 1.00 0.37 C ATOM 778 O ILE A 52 -15.017 -10.242 -3.968 1.00 0.41 O ATOM 779 CB ILE A 52 -15.314 -7.840 -6.242 1.00 0.38 C ATOM 780 CG1 ILE A 52 -15.662 -6.351 -6.152 1.00 0.42 C ATOM 781 CG2 ILE A 52 -16.582 -8.688 -6.201 1.00 0.50 C ATOM 782 CD1 ILE A 52 -16.576 -5.870 -7.261 1.00 0.50 C ATOM 0 H ILE A 52 -12.813 -7.472 -6.311 1.00 0.31 H new ATOM 0 HA ILE A 52 -14.682 -7.734 -4.189 1.00 0.34 H new ATOM 0 HB ILE A 52 -14.813 -8.026 -7.192 1.00 0.38 H new ATOM 0 HG12 ILE A 52 -16.138 -6.156 -5.191 1.00 0.42 H new ATOM 0 HG13 ILE A 52 -14.740 -5.770 -6.175 1.00 0.42 H new ATOM 0 HG21 ILE A 52 -17.244 -8.392 -7.015 1.00 0.50 H new ATOM 0 HG22 ILE A 52 -16.320 -9.740 -6.311 1.00 0.50 H new ATOM 0 HG23 ILE A 52 -17.089 -8.538 -5.248 1.00 0.50 H new ATOM 0 HD11 ILE A 52 -16.778 -4.807 -7.131 1.00 0.50 H new ATOM 0 HD12 ILE A 52 -16.095 -6.032 -8.225 1.00 0.50 H new ATOM 0 HD13 ILE A 52 -17.514 -6.424 -7.226 1.00 0.50 H new ATOM 794 N ALA A 53 -13.709 -10.467 -5.786 1.00 0.41 N ATOM 795 CA ALA A 53 -13.667 -11.922 -5.712 1.00 0.50 C ATOM 796 C ALA A 53 -12.830 -12.387 -4.525 1.00 0.49 C ATOM 797 O ALA A 53 -13.030 -13.486 -4.007 1.00 0.58 O ATOM 798 CB ALA A 53 -13.117 -12.499 -7.007 1.00 0.59 C ATOM 0 H ALA A 53 -13.180 -10.068 -6.562 1.00 0.41 H new ATOM 0 HA ALA A 53 -14.685 -12.284 -5.569 1.00 0.50 H new ATOM 0 HB1 ALA A 53 -13.091 -13.587 -6.939 1.00 0.59 H new ATOM 0 HB2 ALA A 53 -13.757 -12.203 -7.838 1.00 0.59 H new ATOM 0 HB3 ALA A 53 -12.108 -12.122 -7.174 1.00 0.59 H new ATOM 804 N GLU A 54 -11.894 -11.544 -4.101 1.00 0.45 N ATOM 805 CA GLU A 54 -11.029 -11.869 -2.973 1.00 0.51 C ATOM 806 C GLU A 54 -11.766 -11.669 -1.652 1.00 0.50 C ATOM 807 O GLU A 54 -11.718 -12.525 -0.768 1.00 0.59 O ATOM 808 CB GLU A 54 -9.767 -11.004 -3.003 1.00 0.57 C ATOM 809 CG GLU A 54 -8.773 -11.337 -1.902 1.00 1.07 C ATOM 810 CD GLU A 54 -7.571 -10.412 -1.899 1.00 1.77 C ATOM 811 OE1 GLU A 54 -6.599 -10.700 -2.628 1.00 1.99 O ATOM 812 OE2 GLU A 54 -7.603 -9.400 -1.168 1.00 2.54 O ATOM 0 H GLU A 54 -11.715 -10.632 -4.521 1.00 0.45 H new ATOM 0 HA GLU A 54 -10.742 -12.917 -3.056 1.00 0.51 H new ATOM 0 HB2 GLU A 54 -9.278 -11.123 -3.970 1.00 0.57 H new ATOM 0 HB3 GLU A 54 -10.053 -9.956 -2.917 1.00 0.57 H new ATOM 0 HG2 GLU A 54 -9.274 -11.278 -0.936 1.00 1.07 H new ATOM 0 HG3 GLU A 54 -8.434 -12.366 -2.023 1.00 1.07 H new ATOM 819 N ALA A 55 -12.447 -10.534 -1.526 1.00 0.43 N ATOM 820 CA ALA A 55 -13.194 -10.220 -0.314 1.00 0.47 C ATOM 821 C ALA A 55 -14.479 -11.040 -0.224 1.00 0.46 C ATOM 822 O ALA A 55 -14.975 -11.308 0.870 1.00 0.53 O ATOM 823 CB ALA A 55 -13.513 -8.734 -0.260 1.00 0.50 C ATOM 0 H ALA A 55 -12.497 -9.816 -2.249 1.00 0.43 H new ATOM 0 HA ALA A 55 -12.569 -10.481 0.540 1.00 0.47 H new ATOM 0 HB1 ALA A 55 -14.071 -8.514 0.650 1.00 0.50 H new ATOM 0 HB2 ALA A 55 -12.585 -8.162 -0.264 1.00 0.50 H new ATOM 0 HB3 ALA A 55 -14.112 -8.459 -1.128 1.00 0.50 H new ATOM 829 N GLU A 56 -15.012 -11.436 -1.375 1.00 0.41 N ATOM 830 CA GLU A 56 -16.242 -12.221 -1.416 1.00 0.44 C ATOM 831 C GLU A 56 -16.039 -13.589 -0.771 1.00 0.49 C ATOM 832 O GLU A 56 -16.948 -14.130 -0.141 1.00 0.63 O ATOM 833 CB GLU A 56 -16.721 -12.390 -2.858 1.00 0.47 C ATOM 834 CG GLU A 56 -18.070 -13.082 -2.973 1.00 0.52 C ATOM 835 CD GLU A 56 -18.531 -13.226 -4.410 1.00 1.26 C ATOM 836 OE1 GLU A 56 -18.198 -14.251 -5.040 1.00 1.95 O ATOM 837 OE2 GLU A 56 -19.225 -12.314 -4.906 1.00 1.66 O ATOM 0 H GLU A 56 -14.613 -11.227 -2.290 1.00 0.41 H new ATOM 0 HA GLU A 56 -17.002 -11.682 -0.851 1.00 0.44 H new ATOM 0 HB2 GLU A 56 -16.784 -11.409 -3.329 1.00 0.47 H new ATOM 0 HB3 GLU A 56 -15.979 -12.963 -3.414 1.00 0.47 H new ATOM 0 HG2 GLU A 56 -18.008 -14.069 -2.515 1.00 0.52 H new ATOM 0 HG3 GLU A 56 -18.814 -12.516 -2.412 1.00 0.52 H new ATOM 844 N ASN A 57 -14.839 -14.142 -0.930 1.00 0.53 N ATOM 845 CA ASN A 57 -14.517 -15.449 -0.365 1.00 0.68 C ATOM 846 C ASN A 57 -13.496 -15.323 0.764 1.00 0.79 C ATOM 847 O ASN A 57 -12.408 -15.896 0.697 1.00 1.19 O ATOM 848 CB ASN A 57 -13.979 -16.381 -1.454 1.00 0.87 C ATOM 849 CG ASN A 57 -14.977 -16.599 -2.576 1.00 1.67 C ATOM 850 OD1 ASN A 57 -14.596 -16.784 -3.731 1.00 2.38 O ATOM 851 ND2 ASN A 57 -16.262 -16.582 -2.239 1.00 2.48 N ATOM 0 H ASN A 57 -14.074 -13.705 -1.445 1.00 0.53 H new ATOM 0 HA ASN A 57 -15.433 -15.872 0.047 1.00 0.68 H new ATOM 0 HB2 ASN A 57 -13.060 -15.962 -1.865 1.00 0.87 H new ATOM 0 HB3 ASN A 57 -13.720 -17.342 -1.010 1.00 0.87 H new ATOM 0 HD21 ASN A 57 -16.978 -16.726 -2.951 1.00 2.48 H new ATOM 0 HD22 ASN A 57 -16.533 -16.425 -1.268 1.00 2.48 H new ATOM 858 N ASN A 58 -13.859 -14.571 1.798 1.00 0.84 N ATOM 859 CA ASN A 58 -12.978 -14.367 2.944 1.00 1.03 C ATOM 860 C ASN A 58 -13.719 -13.660 4.074 1.00 1.09 C ATOM 861 O ASN A 58 -13.767 -14.149 5.203 1.00 1.84 O ATOM 862 CB ASN A 58 -11.752 -13.549 2.535 1.00 1.12 C ATOM 863 CG ASN A 58 -10.790 -13.338 3.687 1.00 1.81 C ATOM 864 OD1 ASN A 58 -10.895 -12.361 4.429 1.00 2.48 O ATOM 865 ND2 ASN A 58 -9.846 -14.257 3.844 1.00 2.14 N ATOM 0 H ASN A 58 -14.757 -14.092 1.867 1.00 0.84 H new ATOM 0 HA ASN A 58 -12.650 -15.344 3.299 1.00 1.03 H new ATOM 0 HB2 ASN A 58 -11.235 -14.057 1.721 1.00 1.12 H new ATOM 0 HB3 ASN A 58 -12.075 -12.581 2.153 1.00 1.12 H new ATOM 0 HD21 ASN A 58 -9.170 -14.170 4.603 1.00 2.14 H new ATOM 0 HD22 ASN A 58 -9.796 -15.051 3.206 1.00 2.14 H new ATOM 872 N ASN A 59 -14.293 -12.505 3.757 1.00 1.04 N ATOM 873 CA ASN A 59 -15.034 -11.721 4.737 1.00 1.01 C ATOM 874 C ASN A 59 -16.526 -11.723 4.417 1.00 0.88 C ATOM 875 O ASN A 59 -17.244 -10.786 4.765 1.00 0.91 O ATOM 876 CB ASN A 59 -14.505 -10.286 4.769 1.00 1.08 C ATOM 877 CG ASN A 59 -14.192 -9.758 3.383 1.00 1.31 C ATOM 878 OD1 ASN A 59 -15.066 -9.240 2.690 1.00 2.05 O ATOM 879 ND2 ASN A 59 -12.935 -9.886 2.973 1.00 1.51 N ATOM 0 H ASN A 59 -14.259 -12.090 2.826 1.00 1.04 H new ATOM 0 HA ASN A 59 -14.893 -12.175 5.718 1.00 1.01 H new ATOM 0 HB2 ASN A 59 -15.243 -9.639 5.244 1.00 1.08 H new ATOM 0 HB3 ASN A 59 -13.605 -10.246 5.382 1.00 1.08 H new ATOM 0 HD21 ASN A 59 -12.663 -9.548 2.050 1.00 1.51 H new ATOM 0 HD22 ASN A 59 -12.242 -10.322 3.581 1.00 1.51 H new ATOM 886 N ASN A 60 -16.978 -12.785 3.751 1.00 0.80 N ATOM 887 CA ASN A 60 -18.383 -12.930 3.376 1.00 0.76 C ATOM 888 C ASN A 60 -18.820 -11.822 2.419 1.00 0.74 C ATOM 889 O ASN A 60 -18.862 -12.022 1.205 1.00 1.42 O ATOM 890 CB ASN A 60 -19.280 -12.933 4.618 1.00 0.86 C ATOM 891 CG ASN A 60 -19.146 -14.205 5.437 1.00 0.95 C ATOM 892 OD1 ASN A 60 -20.103 -14.648 6.072 1.00 1.47 O ATOM 893 ND2 ASN A 60 -17.957 -14.798 5.431 1.00 1.19 N ATOM 0 H ASN A 60 -16.386 -13.563 3.459 1.00 0.80 H new ATOM 0 HA ASN A 60 -18.488 -13.886 2.863 1.00 0.76 H new ATOM 0 HB2 ASN A 60 -19.030 -12.076 5.243 1.00 0.86 H new ATOM 0 HB3 ASN A 60 -20.319 -12.812 4.311 1.00 0.86 H new ATOM 0 HD21 ASN A 60 -17.811 -15.654 5.966 1.00 1.19 H new ATOM 0 HD22 ASN A 60 -17.190 -14.397 4.891 1.00 1.19 H new ATOM 900 N GLY A 61 -19.146 -10.657 2.973 1.00 0.43 N ATOM 901 CA GLY A 61 -19.575 -9.540 2.153 1.00 0.40 C ATOM 902 C GLY A 61 -19.402 -8.207 2.851 1.00 0.32 C ATOM 903 O GLY A 61 -20.210 -7.295 2.670 1.00 0.38 O ATOM 0 H GLY A 61 -19.120 -10.468 3.975 1.00 0.43 H new ATOM 0 HA2 GLY A 61 -19.006 -9.536 1.224 1.00 0.40 H new ATOM 0 HA3 GLY A 61 -20.623 -9.672 1.884 1.00 0.40 H new ATOM 907 N GLN A 62 -18.347 -8.091 3.653 1.00 0.36 N ATOM 908 CA GLN A 62 -18.072 -6.857 4.378 1.00 0.29 C ATOM 909 C GLN A 62 -16.579 -6.546 4.400 1.00 0.31 C ATOM 910 O GLN A 62 -15.743 -7.448 4.377 1.00 0.38 O ATOM 911 CB GLN A 62 -18.610 -6.942 5.809 1.00 0.27 C ATOM 912 CG GLN A 62 -20.067 -6.529 5.942 1.00 0.27 C ATOM 913 CD GLN A 62 -20.243 -5.024 6.011 1.00 0.23 C ATOM 914 OE1 GLN A 62 -21.184 -4.522 6.629 1.00 0.25 O ATOM 915 NE2 GLN A 62 -19.335 -4.291 5.377 1.00 0.21 N ATOM 0 H GLN A 62 -17.670 -8.836 3.816 1.00 0.36 H new ATOM 0 HA GLN A 62 -18.581 -6.047 3.855 1.00 0.29 H new ATOM 0 HB2 GLN A 62 -18.498 -7.965 6.169 1.00 0.27 H new ATOM 0 HB3 GLN A 62 -18.002 -6.308 6.454 1.00 0.27 H new ATOM 0 HG2 GLN A 62 -20.630 -6.918 5.094 1.00 0.27 H new ATOM 0 HG3 GLN A 62 -20.489 -6.982 6.839 1.00 0.27 H new ATOM 0 HE21 GLN A 62 -18.571 -4.746 4.877 1.00 0.21 H new ATOM 0 HE22 GLN A 62 -19.401 -3.273 5.390 1.00 0.21 H new ATOM 924 N LEU A 63 -16.257 -5.257 4.453 1.00 0.30 N ATOM 925 CA LEU A 63 -14.869 -4.801 4.478 1.00 0.36 C ATOM 926 C LEU A 63 -14.603 -3.966 5.722 1.00 0.31 C ATOM 927 O LEU A 63 -15.516 -3.364 6.277 1.00 0.27 O ATOM 928 CB LEU A 63 -14.560 -3.964 3.236 1.00 0.45 C ATOM 929 CG LEU A 63 -14.878 -4.630 1.899 1.00 0.79 C ATOM 930 CD1 LEU A 63 -15.042 -3.576 0.816 1.00 1.41 C ATOM 931 CD2 LEU A 63 -13.787 -5.619 1.523 1.00 1.43 C ATOM 0 H LEU A 63 -16.944 -4.504 4.480 1.00 0.30 H new ATOM 0 HA LEU A 63 -14.226 -5.681 4.491 1.00 0.36 H new ATOM 0 HB2 LEU A 63 -15.120 -3.031 3.300 1.00 0.45 H new ATOM 0 HB3 LEU A 63 -13.502 -3.703 3.249 1.00 0.45 H new ATOM 0 HG LEU A 63 -15.815 -5.178 1.996 1.00 0.79 H new ATOM 0 HD11 LEU A 63 -15.268 -4.062 -0.133 1.00 1.41 H new ATOM 0 HD12 LEU A 63 -15.857 -2.904 1.083 1.00 1.41 H new ATOM 0 HD13 LEU A 63 -14.118 -3.006 0.720 1.00 1.41 H new ATOM 0 HD21 LEU A 63 -14.031 -6.084 0.568 1.00 1.43 H new ATOM 0 HD22 LEU A 63 -12.835 -5.096 1.439 1.00 1.43 H new ATOM 0 HD23 LEU A 63 -13.712 -6.388 2.292 1.00 1.43 H new ATOM 943 N ASN A 64 -13.347 -3.911 6.139 1.00 0.33 N ATOM 944 CA ASN A 64 -12.972 -3.149 7.323 1.00 0.31 C ATOM 945 C ASN A 64 -12.092 -1.962 6.948 1.00 0.31 C ATOM 946 O ASN A 64 -11.463 -1.961 5.891 1.00 0.33 O ATOM 947 CB ASN A 64 -12.220 -4.026 8.325 1.00 0.34 C ATOM 948 CG ASN A 64 -12.579 -5.494 8.217 1.00 0.53 C ATOM 949 OD1 ASN A 64 -13.722 -5.853 7.935 1.00 1.19 O ATOM 950 ND2 ASN A 64 -11.588 -6.352 8.439 1.00 0.99 N ATOM 0 H ASN A 64 -12.570 -4.384 5.677 1.00 0.33 H new ATOM 0 HA ASN A 64 -13.893 -2.788 7.781 1.00 0.31 H new ATOM 0 HB2 ASN A 64 -11.148 -3.908 8.169 1.00 0.34 H new ATOM 0 HB3 ASN A 64 -12.435 -3.679 9.336 1.00 0.34 H new ATOM 0 HD21 ASN A 64 -11.759 -7.356 8.378 1.00 0.99 H new ATOM 0 HD22 ASN A 64 -10.656 -6.007 8.670 1.00 0.99 H new ATOM 957 N PHE A 65 -12.068 -0.948 7.808 1.00 0.30 N ATOM 958 CA PHE A 65 -11.259 0.245 7.573 1.00 0.30 C ATOM 959 C PHE A 65 -9.866 -0.123 7.055 1.00 0.29 C ATOM 960 O PHE A 65 -9.297 0.586 6.224 1.00 0.31 O ATOM 961 CB PHE A 65 -11.140 1.057 8.869 1.00 0.32 C ATOM 962 CG PHE A 65 -10.108 2.151 8.814 1.00 0.33 C ATOM 963 CD1 PHE A 65 -10.395 3.360 8.201 1.00 0.37 C ATOM 964 CD2 PHE A 65 -8.854 1.968 9.373 1.00 0.35 C ATOM 965 CE1 PHE A 65 -9.450 4.367 8.146 1.00 0.40 C ATOM 966 CE2 PHE A 65 -7.905 2.972 9.320 1.00 0.38 C ATOM 967 CZ PHE A 65 -8.201 4.171 8.721 1.00 0.39 C ATOM 0 H PHE A 65 -12.601 -0.928 8.677 1.00 0.30 H new ATOM 0 HA PHE A 65 -11.754 0.848 6.811 1.00 0.30 H new ATOM 0 HB2 PHE A 65 -12.110 1.498 9.100 1.00 0.32 H new ATOM 0 HB3 PHE A 65 -10.894 0.381 9.688 1.00 0.32 H new ATOM 0 HD1 PHE A 65 -11.369 3.517 7.761 1.00 0.37 H new ATOM 0 HD2 PHE A 65 -8.615 1.032 9.855 1.00 0.35 H new ATOM 0 HE1 PHE A 65 -9.682 5.302 7.658 1.00 0.40 H new ATOM 0 HE2 PHE A 65 -6.928 2.812 9.751 1.00 0.38 H new ATOM 0 HZ PHE A 65 -7.464 4.960 8.697 1.00 0.39 H new ATOM 977 N THR A 66 -9.332 -1.240 7.541 1.00 0.31 N ATOM 978 CA THR A 66 -8.006 -1.697 7.135 1.00 0.32 C ATOM 979 C THR A 66 -8.011 -2.305 5.739 1.00 0.31 C ATOM 980 O THR A 66 -7.067 -2.121 4.975 1.00 0.30 O ATOM 981 CB THR A 66 -7.440 -2.733 8.119 1.00 0.40 C ATOM 982 OG1 THR A 66 -8.505 -3.349 8.852 1.00 0.56 O ATOM 983 CG2 THR A 66 -6.459 -2.085 9.078 1.00 0.81 C ATOM 0 H THR A 66 -9.797 -1.846 8.217 1.00 0.31 H new ATOM 0 HA THR A 66 -7.372 -0.810 7.133 1.00 0.32 H new ATOM 0 HB THR A 66 -6.911 -3.495 7.547 1.00 0.40 H new ATOM 0 HG1 THR A 66 -8.135 -4.009 9.475 1.00 0.56 H new ATOM 0 HG21 THR A 66 -6.071 -2.837 9.765 1.00 0.81 H new ATOM 0 HG22 THR A 66 -5.634 -1.648 8.515 1.00 0.81 H new ATOM 0 HG23 THR A 66 -6.966 -1.303 9.644 1.00 0.81 H new ATOM 991 N GLU A 67 -9.061 -3.050 5.415 1.00 0.34 N ATOM 992 CA GLU A 67 -9.170 -3.673 4.100 1.00 0.37 C ATOM 993 C GLU A 67 -9.261 -2.608 3.018 1.00 0.32 C ATOM 994 O GLU A 67 -8.491 -2.608 2.055 1.00 0.35 O ATOM 995 CB GLU A 67 -10.393 -4.587 4.043 1.00 0.42 C ATOM 996 CG GLU A 67 -10.386 -5.660 5.115 1.00 0.49 C ATOM 997 CD GLU A 67 -10.770 -7.026 4.580 1.00 0.88 C ATOM 998 OE1 GLU A 67 -9.875 -7.741 4.081 1.00 1.21 O ATOM 999 OE2 GLU A 67 -11.964 -7.383 4.663 1.00 1.36 O ATOM 0 H GLU A 67 -9.845 -3.237 6.040 1.00 0.34 H new ATOM 0 HA GLU A 67 -8.277 -4.274 3.927 1.00 0.37 H new ATOM 0 HB2 GLU A 67 -11.295 -3.984 4.147 1.00 0.42 H new ATOM 0 HB3 GLU A 67 -10.439 -5.062 3.063 1.00 0.42 H new ATOM 0 HG2 GLU A 67 -9.393 -5.715 5.561 1.00 0.49 H new ATOM 0 HG3 GLU A 67 -11.077 -5.378 5.909 1.00 0.49 H new ATOM 1006 N PHE A 68 -10.209 -1.697 3.192 1.00 0.29 N ATOM 1007 CA PHE A 68 -10.410 -0.608 2.245 1.00 0.27 C ATOM 1008 C PHE A 68 -9.148 0.241 2.120 1.00 0.26 C ATOM 1009 O PHE A 68 -8.658 0.479 1.017 1.00 0.32 O ATOM 1010 CB PHE A 68 -11.596 0.258 2.680 1.00 0.26 C ATOM 1011 CG PHE A 68 -11.714 1.555 1.927 1.00 0.30 C ATOM 1012 CD1 PHE A 68 -11.764 1.572 0.541 1.00 0.38 C ATOM 1013 CD2 PHE A 68 -11.779 2.757 2.611 1.00 0.35 C ATOM 1014 CE1 PHE A 68 -11.874 2.765 -0.147 1.00 0.48 C ATOM 1015 CE2 PHE A 68 -11.889 3.951 1.929 1.00 0.45 C ATOM 1016 CZ PHE A 68 -11.936 3.956 0.548 1.00 0.51 C ATOM 0 H PHE A 68 -10.853 -1.691 3.983 1.00 0.29 H new ATOM 0 HA PHE A 68 -10.629 -1.038 1.267 1.00 0.27 H new ATOM 0 HB2 PHE A 68 -12.516 -0.312 2.549 1.00 0.26 H new ATOM 0 HB3 PHE A 68 -11.504 0.474 3.744 1.00 0.26 H new ATOM 0 HD1 PHE A 68 -11.716 0.642 -0.006 1.00 0.38 H new ATOM 0 HD2 PHE A 68 -11.743 2.760 3.690 1.00 0.35 H new ATOM 0 HE1 PHE A 68 -11.911 2.766 -1.226 1.00 0.48 H new ATOM 0 HE2 PHE A 68 -11.938 4.882 2.474 1.00 0.45 H new ATOM 0 HZ PHE A 68 -12.021 4.890 0.013 1.00 0.51 H new ATOM 1026 N CYS A 69 -8.628 0.696 3.259 1.00 0.23 N ATOM 1027 CA CYS A 69 -7.416 1.512 3.275 1.00 0.23 C ATOM 1028 C CYS A 69 -6.274 0.782 2.590 1.00 0.27 C ATOM 1029 O CYS A 69 -5.583 1.346 1.744 1.00 0.31 O ATOM 1030 CB CYS A 69 -7.011 1.841 4.710 1.00 0.23 C ATOM 1031 SG CYS A 69 -5.672 3.042 4.847 1.00 0.75 S ATOM 0 H CYS A 69 -9.026 0.514 4.180 1.00 0.23 H new ATOM 0 HA CYS A 69 -7.627 2.437 2.738 1.00 0.23 H new ATOM 0 HB2 CYS A 69 -7.882 2.223 5.242 1.00 0.23 H new ATOM 0 HB3 CYS A 69 -6.710 0.920 5.210 1.00 0.23 H new ATOM 0 HG CYS A 69 -6.132 4.234 4.606 1.00 0.75 H new ATOM 1037 N GLY A 70 -6.081 -0.473 2.981 1.00 0.30 N ATOM 1038 CA GLY A 70 -5.030 -1.288 2.403 1.00 0.35 C ATOM 1039 C GLY A 70 -4.953 -1.144 0.898 1.00 0.37 C ATOM 1040 O GLY A 70 -3.882 -0.886 0.343 1.00 0.41 O ATOM 0 H GLY A 70 -6.639 -0.943 3.694 1.00 0.30 H new ATOM 0 HA2 GLY A 70 -4.073 -1.007 2.842 1.00 0.35 H new ATOM 0 HA3 GLY A 70 -5.203 -2.334 2.657 1.00 0.35 H new ATOM 1044 N ILE A 71 -6.093 -1.303 0.232 1.00 0.37 N ATOM 1045 CA ILE A 71 -6.140 -1.182 -1.215 1.00 0.41 C ATOM 1046 C ILE A 71 -5.862 0.243 -1.652 1.00 0.40 C ATOM 1047 O ILE A 71 -5.153 0.474 -2.620 1.00 0.44 O ATOM 1048 CB ILE A 71 -7.490 -1.612 -1.796 1.00 0.42 C ATOM 1049 CG1 ILE A 71 -7.737 -3.086 -1.498 1.00 0.47 C ATOM 1050 CG2 ILE A 71 -7.508 -1.346 -3.296 1.00 0.46 C ATOM 1051 CD1 ILE A 71 -9.189 -3.406 -1.223 1.00 0.51 C ATOM 0 H ILE A 71 -6.989 -1.514 0.671 1.00 0.37 H new ATOM 0 HA ILE A 71 -5.367 -1.850 -1.596 1.00 0.41 H new ATOM 0 HB ILE A 71 -8.290 -1.034 -1.333 1.00 0.42 H new ATOM 0 HG12 ILE A 71 -7.395 -3.683 -2.343 1.00 0.47 H new ATOM 0 HG13 ILE A 71 -7.138 -3.381 -0.636 1.00 0.47 H new ATOM 0 HG21 ILE A 71 -8.469 -1.652 -3.708 1.00 0.46 H new ATOM 0 HG22 ILE A 71 -7.357 -0.282 -3.479 1.00 0.46 H new ATOM 0 HG23 ILE A 71 -6.710 -1.913 -3.776 1.00 0.46 H new ATOM 0 HD11 ILE A 71 -9.294 -4.471 -1.019 1.00 0.51 H new ATOM 0 HD12 ILE A 71 -9.530 -2.835 -0.359 1.00 0.51 H new ATOM 0 HD13 ILE A 71 -9.791 -3.142 -2.093 1.00 0.51 H new ATOM 1063 N MET A 72 -6.450 1.193 -0.946 1.00 0.38 N ATOM 1064 CA MET A 72 -6.247 2.601 -1.262 1.00 0.41 C ATOM 1065 C MET A 72 -4.764 2.913 -1.311 1.00 0.45 C ATOM 1066 O MET A 72 -4.297 3.651 -2.171 1.00 0.52 O ATOM 1067 CB MET A 72 -6.917 3.492 -0.222 1.00 0.39 C ATOM 1068 CG MET A 72 -8.425 3.364 -0.196 1.00 0.41 C ATOM 1069 SD MET A 72 -9.211 4.087 -1.650 1.00 1.01 S ATOM 1070 CE MET A 72 -8.772 5.814 -1.459 1.00 0.58 C ATOM 0 H MET A 72 -7.069 1.019 -0.154 1.00 0.38 H new ATOM 0 HA MET A 72 -6.696 2.799 -2.236 1.00 0.41 H new ATOM 0 HB2 MET A 72 -6.523 3.245 0.764 1.00 0.39 H new ATOM 0 HB3 MET A 72 -6.652 4.531 -0.421 1.00 0.39 H new ATOM 0 HG2 MET A 72 -8.695 2.310 -0.129 1.00 0.41 H new ATOM 0 HG3 MET A 72 -8.811 3.850 0.700 1.00 0.41 H new ATOM 0 HE1 MET A 72 -9.541 6.438 -1.914 1.00 0.58 H new ATOM 0 HE2 MET A 72 -8.691 6.054 -0.399 1.00 0.58 H new ATOM 0 HE3 MET A 72 -7.816 6.003 -1.948 1.00 0.58 H new ATOM 1080 N ALA A 73 -4.035 2.343 -0.366 1.00 0.46 N ATOM 1081 CA ALA A 73 -2.596 2.532 -0.280 1.00 0.53 C ATOM 1082 C ALA A 73 -1.900 2.045 -1.552 1.00 0.59 C ATOM 1083 O ALA A 73 -1.138 2.787 -2.176 1.00 0.70 O ATOM 1084 CB ALA A 73 -2.053 1.806 0.942 1.00 0.54 C ATOM 0 H ALA A 73 -4.421 1.739 0.360 1.00 0.46 H new ATOM 0 HA ALA A 73 -2.391 3.598 -0.179 1.00 0.53 H new ATOM 0 HB1 ALA A 73 -0.974 1.951 1.002 1.00 0.54 H new ATOM 0 HB2 ALA A 73 -2.523 2.205 1.841 1.00 0.54 H new ATOM 0 HB3 ALA A 73 -2.272 0.741 0.860 1.00 0.54 H new ATOM 1090 N LYS A 74 -2.171 0.798 -1.936 1.00 0.55 N ATOM 1091 CA LYS A 74 -1.562 0.219 -3.135 1.00 0.62 C ATOM 1092 C LYS A 74 -2.076 0.899 -4.403 1.00 0.63 C ATOM 1093 O LYS A 74 -1.387 0.938 -5.422 1.00 0.70 O ATOM 1094 CB LYS A 74 -1.839 -1.288 -3.206 1.00 0.63 C ATOM 1095 CG LYS A 74 -3.306 -1.649 -3.357 1.00 0.65 C ATOM 1096 CD LYS A 74 -3.497 -3.156 -3.441 1.00 0.74 C ATOM 1097 CE LYS A 74 -4.903 -3.519 -3.892 1.00 0.73 C ATOM 1098 NZ LYS A 74 -5.231 -2.925 -5.217 1.00 1.38 N ATOM 0 H LYS A 74 -2.804 0.172 -1.438 1.00 0.55 H new ATOM 0 HA LYS A 74 -0.486 0.383 -3.069 1.00 0.62 H new ATOM 0 HB2 LYS A 74 -1.286 -1.708 -4.046 1.00 0.63 H new ATOM 0 HB3 LYS A 74 -1.452 -1.759 -2.302 1.00 0.63 H new ATOM 0 HG2 LYS A 74 -3.869 -1.255 -2.511 1.00 0.65 H new ATOM 0 HG3 LYS A 74 -3.708 -1.178 -4.254 1.00 0.65 H new ATOM 0 HD2 LYS A 74 -2.771 -3.577 -4.137 1.00 0.74 H new ATOM 0 HD3 LYS A 74 -3.300 -3.603 -2.466 1.00 0.74 H new ATOM 0 HE2 LYS A 74 -4.998 -4.603 -3.947 1.00 0.73 H new ATOM 0 HE3 LYS A 74 -5.623 -3.173 -3.151 1.00 0.73 H new ATOM 0 HZ1 LYS A 74 -6.105 -3.353 -5.582 1.00 1.38 H new ATOM 0 HZ2 LYS A 74 -5.365 -1.899 -5.114 1.00 1.38 H new ATOM 0 HZ3 LYS A 74 -4.452 -3.108 -5.882 1.00 1.38 H new ATOM 1112 N GLN A 75 -3.289 1.432 -4.329 1.00 0.59 N ATOM 1113 CA GLN A 75 -3.915 2.101 -5.464 1.00 0.63 C ATOM 1114 C GLN A 75 -3.408 3.531 -5.630 1.00 0.67 C ATOM 1115 O GLN A 75 -3.392 4.067 -6.738 1.00 0.79 O ATOM 1116 CB GLN A 75 -5.430 2.100 -5.290 1.00 0.63 C ATOM 1117 CG GLN A 75 -6.192 2.626 -6.492 1.00 1.04 C ATOM 1118 CD GLN A 75 -7.692 2.556 -6.290 1.00 1.23 C ATOM 1119 OE1 GLN A 75 -8.308 3.503 -5.806 1.00 1.98 O ATOM 1120 NE2 GLN A 75 -8.286 1.426 -6.652 1.00 1.54 N ATOM 0 H GLN A 75 -3.864 1.414 -3.487 1.00 0.59 H new ATOM 0 HA GLN A 75 -3.648 1.551 -6.366 1.00 0.63 H new ATOM 0 HB2 GLN A 75 -5.760 1.083 -5.081 1.00 0.63 H new ATOM 0 HB3 GLN A 75 -5.685 2.703 -4.419 1.00 0.63 H new ATOM 0 HG2 GLN A 75 -5.900 3.659 -6.682 1.00 1.04 H new ATOM 0 HG3 GLN A 75 -5.918 2.049 -7.375 1.00 1.04 H new ATOM 0 HE21 GLN A 75 -7.735 0.665 -7.050 1.00 1.54 H new ATOM 0 HE22 GLN A 75 -9.293 1.318 -6.532 1.00 1.54 H new ATOM 1129 N MET A 76 -2.996 4.144 -4.527 1.00 0.65 N ATOM 1130 CA MET A 76 -2.502 5.507 -4.548 1.00 0.73 C ATOM 1131 C MET A 76 -1.090 5.583 -5.126 1.00 0.89 C ATOM 1132 O MET A 76 -0.778 6.484 -5.904 1.00 1.06 O ATOM 1133 CB MET A 76 -2.518 6.076 -3.134 1.00 0.76 C ATOM 1134 CG MET A 76 -3.879 6.595 -2.701 1.00 0.80 C ATOM 1135 SD MET A 76 -3.828 7.414 -1.097 1.00 1.20 S ATOM 1136 CE MET A 76 -5.570 7.455 -0.689 1.00 0.75 C ATOM 0 H MET A 76 -2.996 3.712 -3.603 1.00 0.65 H new ATOM 0 HA MET A 76 -3.156 6.097 -5.191 1.00 0.73 H new ATOM 0 HB2 MET A 76 -2.195 5.303 -2.437 1.00 0.76 H new ATOM 0 HB3 MET A 76 -1.792 6.887 -3.070 1.00 0.76 H new ATOM 0 HG2 MET A 76 -4.253 7.293 -3.450 1.00 0.80 H new ATOM 0 HG3 MET A 76 -4.584 5.765 -2.659 1.00 0.80 H new ATOM 0 HE1 MET A 76 -5.778 8.328 -0.070 1.00 0.75 H new ATOM 0 HE2 MET A 76 -6.157 7.512 -1.606 1.00 0.75 H new ATOM 0 HE3 MET A 76 -5.837 6.550 -0.143 1.00 0.75 H new ATOM 1211 N THR A 81 -2.506 9.521 -12.825 1.00 5.18 N ATOM 1212 CA THR A 81 -3.194 10.092 -13.987 1.00 6.15 C ATOM 1213 C THR A 81 -2.633 11.468 -14.343 1.00 6.80 C ATOM 1214 O THR A 81 -2.729 12.404 -13.556 1.00 7.13 O ATOM 1215 CB THR A 81 -4.710 10.209 -13.738 1.00 6.60 C ATOM 1216 OG1 THR A 81 -5.326 10.943 -14.801 1.00 7.29 O ATOM 1217 CG2 THR A 81 -4.997 10.895 -12.409 1.00 6.89 C ATOM 0 HA THR A 81 -3.023 9.412 -14.822 1.00 6.15 H new ATOM 0 HB THR A 81 -5.124 9.202 -13.702 1.00 6.60 H new ATOM 0 HG1 THR A 81 -6.290 11.011 -14.636 1.00 7.29 H new ATOM 0 HG21 THR A 81 -6.075 10.964 -12.260 1.00 6.89 H new ATOM 0 HG22 THR A 81 -4.555 10.316 -11.598 1.00 6.89 H new ATOM 0 HG23 THR A 81 -4.567 11.897 -12.416 1.00 6.89 H new ATOM 1225 N GLU A 82 -2.059 11.583 -15.539 1.00 7.25 N ATOM 1226 CA GLU A 82 -1.452 12.835 -15.984 1.00 8.05 C ATOM 1227 C GLU A 82 -2.483 13.845 -16.494 1.00 8.92 C ATOM 1228 O GLU A 82 -2.260 15.052 -16.410 1.00 9.53 O ATOM 1229 CB GLU A 82 -0.422 12.553 -17.078 1.00 8.64 C ATOM 1230 CG GLU A 82 0.733 11.681 -16.614 1.00 8.69 C ATOM 1231 CD GLU A 82 1.760 11.445 -17.703 1.00 9.34 C ATOM 1232 OE1 GLU A 82 2.684 12.273 -17.839 1.00 9.74 O ATOM 1233 OE2 GLU A 82 1.640 10.429 -18.420 1.00 9.63 O ATOM 0 H GLU A 82 -2.002 10.824 -16.217 1.00 7.25 H new ATOM 0 HA GLU A 82 -0.967 13.281 -15.115 1.00 8.05 H new ATOM 0 HB2 GLU A 82 -0.919 12.067 -17.917 1.00 8.64 H new ATOM 0 HB3 GLU A 82 -0.027 13.500 -17.446 1.00 8.64 H new ATOM 0 HG2 GLU A 82 1.218 12.152 -15.759 1.00 8.69 H new ATOM 0 HG3 GLU A 82 0.344 10.722 -16.272 1.00 8.69 H new ATOM 1240 N GLU A 83 -3.601 13.359 -17.024 1.00 9.15 N ATOM 1241 CA GLU A 83 -4.634 14.252 -17.548 1.00 10.17 C ATOM 1242 C GLU A 83 -5.169 15.187 -16.462 1.00 10.27 C ATOM 1243 O GLU A 83 -5.246 16.402 -16.661 1.00 11.05 O ATOM 1244 CB GLU A 83 -5.779 13.447 -18.174 1.00 10.55 C ATOM 1245 CG GLU A 83 -6.489 12.520 -17.202 1.00 10.83 C ATOM 1246 CD GLU A 83 -7.590 11.715 -17.865 1.00 11.60 C ATOM 1247 OE1 GLU A 83 -7.285 10.643 -18.429 1.00 11.85 O ATOM 1248 OE2 GLU A 83 -8.758 12.157 -17.819 1.00 12.11 O ATOM 0 H GLU A 83 -3.816 12.365 -17.103 1.00 9.15 H new ATOM 0 HA GLU A 83 -4.176 14.867 -18.322 1.00 10.17 H new ATOM 0 HB2 GLU A 83 -6.507 14.139 -18.597 1.00 10.55 H new ATOM 0 HB3 GLU A 83 -5.384 12.856 -19.000 1.00 10.55 H new ATOM 0 HG2 GLU A 83 -5.763 11.839 -16.758 1.00 10.83 H new ATOM 0 HG3 GLU A 83 -6.913 13.108 -16.388 1.00 10.83 H new ATOM 1255 N GLU A 84 -5.524 14.622 -15.313 1.00 9.63 N ATOM 1256 CA GLU A 84 -6.048 15.415 -14.206 1.00 9.95 C ATOM 1257 C GLU A 84 -4.951 16.287 -13.603 1.00 9.87 C ATOM 1258 O GLU A 84 -5.228 17.301 -12.962 1.00 10.51 O ATOM 1259 CB GLU A 84 -6.644 14.502 -13.132 1.00 9.47 C ATOM 1260 CG GLU A 84 -7.272 15.255 -11.970 1.00 9.88 C ATOM 1261 CD GLU A 84 -8.373 16.200 -12.414 1.00 10.40 C ATOM 1262 OE1 GLU A 84 -9.512 15.730 -12.617 1.00 10.49 O ATOM 1263 OE2 GLU A 84 -8.095 17.409 -12.561 1.00 10.87 O ATOM 0 H GLU A 84 -5.459 13.622 -15.124 1.00 9.63 H new ATOM 0 HA GLU A 84 -6.834 16.064 -14.592 1.00 9.95 H new ATOM 0 HB2 GLU A 84 -7.399 13.862 -13.589 1.00 9.47 H new ATOM 0 HB3 GLU A 84 -5.861 13.847 -12.749 1.00 9.47 H new ATOM 0 HG2 GLU A 84 -7.679 14.539 -11.255 1.00 9.88 H new ATOM 0 HG3 GLU A 84 -6.500 15.822 -11.449 1.00 9.88 H new ATOM 1270 N MET A 85 -3.704 15.884 -13.824 1.00 9.31 N ATOM 1271 CA MET A 85 -2.559 16.621 -13.308 1.00 9.45 C ATOM 1272 C MET A 85 -2.351 17.918 -14.076 1.00 10.49 C ATOM 1273 O MET A 85 -2.169 18.978 -13.479 1.00 11.09 O ATOM 1274 CB MET A 85 -1.301 15.759 -13.389 1.00 8.75 C ATOM 1275 CG MET A 85 -1.297 14.603 -12.407 1.00 7.71 C ATOM 1276 SD MET A 85 0.006 13.411 -12.743 1.00 7.19 S ATOM 1277 CE MET A 85 0.293 12.775 -11.096 1.00 6.73 C ATOM 0 H MET A 85 -3.462 15.049 -14.358 1.00 9.31 H new ATOM 0 HA MET A 85 -2.758 16.870 -12.266 1.00 9.45 H new ATOM 0 HB2 MET A 85 -1.204 15.366 -14.401 1.00 8.75 H new ATOM 0 HB3 MET A 85 -0.428 16.385 -13.205 1.00 8.75 H new ATOM 0 HG2 MET A 85 -1.176 14.991 -11.396 1.00 7.71 H new ATOM 0 HG3 MET A 85 -2.263 14.099 -12.442 1.00 7.71 H new ATOM 0 HE1 MET A 85 1.137 12.086 -11.114 1.00 6.73 H new ATOM 0 HE2 MET A 85 0.514 13.601 -10.420 1.00 6.73 H new ATOM 0 HE3 MET A 85 -0.597 12.250 -10.749 1.00 6.73 H new ATOM 1287 N ARG A 86 -2.376 17.830 -15.403 1.00 10.82 N ATOM 1288 CA ARG A 86 -2.192 19.007 -16.241 1.00 11.88 C ATOM 1289 C ARG A 86 -3.306 20.011 -15.988 1.00 12.66 C ATOM 1290 O ARG A 86 -3.074 21.221 -15.978 1.00 13.43 O ATOM 1291 CB ARG A 86 -2.151 18.620 -17.719 1.00 12.21 C ATOM 1292 CG ARG A 86 -1.550 19.696 -18.608 1.00 13.16 C ATOM 1293 CD ARG A 86 -1.329 19.191 -20.023 1.00 13.63 C ATOM 1294 NE ARG A 86 -0.722 20.206 -20.879 1.00 14.25 N ATOM 1295 CZ ARG A 86 -0.529 20.051 -22.186 1.00 14.86 C ATOM 1296 NH1 ARG A 86 -0.902 18.930 -22.786 1.00 14.96 N ATOM 1297 NH2 ARG A 86 0.037 21.020 -22.893 1.00 15.52 N ATOM 0 H ARG A 86 -2.521 16.961 -15.917 1.00 10.82 H new ATOM 0 HA ARG A 86 -1.238 19.467 -15.983 1.00 11.88 H new ATOM 0 HB2 ARG A 86 -1.573 17.702 -17.831 1.00 12.21 H new ATOM 0 HB3 ARG A 86 -3.164 18.403 -18.058 1.00 12.21 H new ATOM 0 HG2 ARG A 86 -2.211 20.563 -18.629 1.00 13.16 H new ATOM 0 HG3 ARG A 86 -0.601 20.029 -18.187 1.00 13.16 H new ATOM 0 HD2 ARG A 86 -0.689 18.309 -19.997 1.00 13.63 H new ATOM 0 HD3 ARG A 86 -2.283 18.880 -20.450 1.00 13.63 H new ATOM 0 HE ARG A 86 -0.429 21.084 -20.450 1.00 14.25 H new ATOM 0 HH11 ARG A 86 -1.338 18.183 -22.246 1.00 14.96 H new ATOM 0 HH12 ARG A 86 -0.753 18.814 -23.788 1.00 14.96 H new ATOM 0 HH21 ARG A 86 0.325 21.885 -22.435 1.00 15.52 H new ATOM 0 HH22 ARG A 86 0.185 20.901 -23.895 1.00 15.52 H new ATOM 1311 N GLU A 87 -4.520 19.505 -15.789 1.00 12.58 N ATOM 1312 CA GLU A 87 -5.659 20.369 -15.510 1.00 13.44 C ATOM 1313 C GLU A 87 -5.377 21.177 -14.249 1.00 13.54 C ATOM 1314 O GLU A 87 -5.600 22.389 -14.203 1.00 14.45 O ATOM 1315 CB GLU A 87 -6.928 19.531 -15.337 1.00 13.42 C ATOM 1316 CG GLU A 87 -8.217 20.321 -15.512 1.00 14.12 C ATOM 1317 CD GLU A 87 -8.448 21.326 -14.403 1.00 14.57 C ATOM 1318 OE1 GLU A 87 -8.836 20.906 -13.293 1.00 14.85 O ATOM 1319 OE2 GLU A 87 -8.244 22.534 -14.645 1.00 14.77 O ATOM 0 H GLU A 87 -4.738 18.509 -15.816 1.00 12.58 H new ATOM 0 HA GLU A 87 -5.813 21.051 -16.346 1.00 13.44 H new ATOM 0 HB2 GLU A 87 -6.913 18.714 -16.058 1.00 13.42 H new ATOM 0 HB3 GLU A 87 -6.922 19.080 -14.345 1.00 13.42 H new ATOM 0 HG2 GLU A 87 -8.190 20.843 -16.469 1.00 14.12 H new ATOM 0 HG3 GLU A 87 -9.059 19.629 -15.550 1.00 14.12 H new ATOM 1326 N ALA A 88 -4.866 20.490 -13.232 1.00 12.70 N ATOM 1327 CA ALA A 88 -4.529 21.127 -11.967 1.00 12.92 C ATOM 1328 C ALA A 88 -3.332 22.054 -12.137 1.00 13.38 C ATOM 1329 O ALA A 88 -3.186 23.034 -11.408 1.00 14.11 O ATOM 1330 CB ALA A 88 -4.241 20.077 -10.905 1.00 12.02 C ATOM 0 H ALA A 88 -4.676 19.488 -13.261 1.00 12.70 H new ATOM 0 HA ALA A 88 -5.382 21.723 -11.643 1.00 12.92 H new ATOM 0 HB1 ALA A 88 -3.991 20.569 -9.965 1.00 12.02 H new ATOM 0 HB2 ALA A 88 -5.122 19.451 -10.763 1.00 12.02 H new ATOM 0 HB3 ALA A 88 -3.403 19.457 -11.224 1.00 12.02 H new ATOM 1336 N PHE A 89 -2.475 21.735 -13.106 1.00 13.10 N ATOM 1337 CA PHE A 89 -1.295 22.545 -13.382 1.00 13.68 C ATOM 1338 C PHE A 89 -1.706 23.937 -13.837 1.00 14.81 C ATOM 1339 O PHE A 89 -1.118 24.938 -13.429 1.00 15.53 O ATOM 1340 CB PHE A 89 -0.426 21.874 -14.448 1.00 13.32 C ATOM 1341 CG PHE A 89 0.697 22.739 -14.948 1.00 14.09 C ATOM 1342 CD1 PHE A 89 1.778 23.030 -14.134 1.00 14.41 C ATOM 1343 CD2 PHE A 89 0.669 23.260 -16.232 1.00 14.63 C ATOM 1344 CE1 PHE A 89 2.812 23.825 -14.591 1.00 15.22 C ATOM 1345 CE2 PHE A 89 1.700 24.055 -16.694 1.00 15.44 C ATOM 1346 CZ PHE A 89 2.771 24.339 -15.874 1.00 15.73 C ATOM 0 H PHE A 89 -2.578 20.921 -13.712 1.00 13.10 H new ATOM 0 HA PHE A 89 -0.713 22.635 -12.465 1.00 13.68 H new ATOM 0 HB2 PHE A 89 -0.009 20.955 -14.037 1.00 13.32 H new ATOM 0 HB3 PHE A 89 -1.056 21.590 -15.291 1.00 13.32 H new ATOM 0 HD1 PHE A 89 1.814 22.631 -13.131 1.00 14.41 H new ATOM 0 HD2 PHE A 89 -0.168 23.042 -16.879 1.00 14.63 H new ATOM 0 HE1 PHE A 89 3.651 24.044 -13.947 1.00 15.22 H new ATOM 0 HE2 PHE A 89 1.667 24.454 -17.697 1.00 15.44 H new ATOM 0 HZ PHE A 89 3.577 24.962 -16.233 1.00 15.73 H new ATOM 1356 N LYS A 90 -2.724 23.989 -14.687 1.00 15.06 N ATOM 1357 CA LYS A 90 -3.231 25.257 -15.197 1.00 16.18 C ATOM 1358 C LYS A 90 -3.866 26.066 -14.074 1.00 16.76 C ATOM 1359 O LYS A 90 -3.677 27.280 -13.984 1.00 17.66 O ATOM 1360 CB LYS A 90 -4.255 25.017 -16.307 1.00 16.38 C ATOM 1361 CG LYS A 90 -3.727 24.167 -17.452 1.00 16.21 C ATOM 1362 CD LYS A 90 -4.737 24.062 -18.579 1.00 16.55 C ATOM 1363 CE LYS A 90 -4.339 22.998 -19.588 1.00 16.86 C ATOM 1364 NZ LYS A 90 -4.331 21.637 -18.985 1.00 17.18 N ATOM 0 H LYS A 90 -3.215 23.167 -15.038 1.00 15.06 H new ATOM 0 HA LYS A 90 -2.392 25.819 -15.607 1.00 16.18 H new ATOM 0 HB2 LYS A 90 -5.133 24.532 -15.881 1.00 16.38 H new ATOM 0 HB3 LYS A 90 -4.583 25.979 -16.701 1.00 16.38 H new ATOM 0 HG2 LYS A 90 -2.801 24.600 -17.831 1.00 16.21 H new ATOM 0 HG3 LYS A 90 -3.485 23.170 -17.085 1.00 16.21 H new ATOM 0 HD2 LYS A 90 -5.719 23.826 -18.168 1.00 16.55 H new ATOM 0 HD3 LYS A 90 -4.825 25.026 -19.081 1.00 16.55 H new ATOM 0 HE2 LYS A 90 -5.032 23.018 -20.429 1.00 16.86 H new ATOM 0 HE3 LYS A 90 -3.349 23.225 -19.984 1.00 16.86 H new ATOM 0 HZ1 LYS A 90 -4.006 20.946 -19.691 1.00 17.18 H new ATOM 0 HZ2 LYS A 90 -3.690 21.624 -18.166 1.00 17.18 H new ATOM 0 HZ3 LYS A 90 -5.292 21.389 -18.675 1.00 17.18 H new ATOM 1378 N ILE A 91 -4.621 25.385 -13.217 1.00 16.32 N ATOM 1379 CA ILE A 91 -5.283 26.041 -12.096 1.00 16.96 C ATOM 1380 C ILE A 91 -4.263 26.609 -11.112 1.00 17.21 C ATOM 1381 O ILE A 91 -4.447 27.703 -10.577 1.00 18.15 O ATOM 1382 CB ILE A 91 -6.223 25.072 -11.349 1.00 16.50 C ATOM 1383 CG1 ILE A 91 -7.288 24.527 -12.304 1.00 16.43 C ATOM 1384 CG2 ILE A 91 -6.873 25.773 -10.162 1.00 17.34 C ATOM 1385 CD1 ILE A 91 -8.174 23.465 -11.687 1.00 16.26 C ATOM 0 H ILE A 91 -4.789 24.381 -13.278 1.00 16.32 H new ATOM 0 HA ILE A 91 -5.875 26.856 -12.511 1.00 16.96 H new ATOM 0 HB ILE A 91 -5.636 24.234 -10.972 1.00 16.50 H new ATOM 0 HG12 ILE A 91 -7.911 25.352 -12.648 1.00 16.43 H new ATOM 0 HG13 ILE A 91 -6.796 24.111 -13.183 1.00 16.43 H new ATOM 0 HG21 ILE A 91 -7.533 25.077 -9.645 1.00 17.34 H new ATOM 0 HG22 ILE A 91 -6.100 26.118 -9.475 1.00 17.34 H new ATOM 0 HG23 ILE A 91 -7.451 26.627 -10.516 1.00 17.34 H new ATOM 0 HD11 ILE A 91 -8.903 23.127 -12.423 1.00 16.26 H new ATOM 0 HD12 ILE A 91 -7.562 22.621 -11.368 1.00 16.26 H new ATOM 0 HD13 ILE A 91 -8.695 23.882 -10.825 1.00 16.26 H new ATOM 1397 N PHE A 92 -3.189 25.861 -10.878 1.00 16.44 N ATOM 1398 CA PHE A 92 -2.142 26.293 -9.957 1.00 16.75 C ATOM 1399 C PHE A 92 -1.297 27.405 -10.569 1.00 17.52 C ATOM 1400 O PHE A 92 -0.825 28.296 -9.863 1.00 18.34 O ATOM 1401 CB PHE A 92 -1.249 25.114 -9.563 1.00 15.83 C ATOM 1402 CG PHE A 92 -1.570 24.547 -8.209 1.00 15.63 C ATOM 1403 CD1 PHE A 92 -1.336 25.290 -7.064 1.00 15.79 C ATOM 1404 CD2 PHE A 92 -2.107 23.277 -8.079 1.00 15.41 C ATOM 1405 CE1 PHE A 92 -1.630 24.779 -5.815 1.00 15.74 C ATOM 1406 CE2 PHE A 92 -2.404 22.759 -6.833 1.00 15.39 C ATOM 1407 CZ PHE A 92 -2.165 23.511 -5.698 1.00 15.56 C ATOM 0 H PHE A 92 -3.021 24.954 -11.313 1.00 16.44 H new ATOM 0 HA PHE A 92 -2.628 26.682 -9.062 1.00 16.75 H new ATOM 0 HB2 PHE A 92 -1.348 24.327 -10.311 1.00 15.83 H new ATOM 0 HB3 PHE A 92 -0.208 25.436 -9.576 1.00 15.83 H new ATOM 0 HD1 PHE A 92 -0.918 26.282 -7.149 1.00 15.79 H new ATOM 0 HD2 PHE A 92 -2.296 22.685 -8.962 1.00 15.41 H new ATOM 0 HE1 PHE A 92 -1.442 25.370 -4.931 1.00 15.74 H new ATOM 0 HE2 PHE A 92 -2.823 21.767 -6.746 1.00 15.39 H new ATOM 0 HZ PHE A 92 -2.396 23.108 -4.723 1.00 15.56 H new ATOM 1417 N ASP A 93 -1.109 27.348 -11.883 1.00 17.35 N ATOM 1418 CA ASP A 93 -0.323 28.357 -12.586 1.00 18.13 C ATOM 1419 C ASP A 93 -1.166 29.598 -12.856 1.00 19.15 C ATOM 1420 O ASP A 93 -2.139 29.549 -13.609 1.00 19.29 O ATOM 1421 CB ASP A 93 0.217 27.791 -13.901 1.00 17.78 C ATOM 1422 CG ASP A 93 1.176 28.742 -14.592 1.00 18.61 C ATOM 1423 OD1 ASP A 93 1.659 29.687 -13.930 1.00 18.99 O ATOM 1424 OD2 ASP A 93 1.449 28.539 -15.793 1.00 18.94 O ATOM 0 H ASP A 93 -1.489 26.615 -12.482 1.00 17.35 H new ATOM 0 HA ASP A 93 0.519 28.639 -11.954 1.00 18.13 H new ATOM 0 HB2 ASP A 93 0.725 26.847 -13.705 1.00 17.78 H new ATOM 0 HB3 ASP A 93 -0.617 27.572 -14.568 1.00 17.78 H new ATOM 1429 N ARG A 94 -0.783 30.710 -12.234 1.00 19.94 N ATOM 1430 CA ARG A 94 -1.506 31.968 -12.397 1.00 20.98 C ATOM 1431 C ARG A 94 -1.402 32.476 -13.831 1.00 21.56 C ATOM 1432 O ARG A 94 -2.412 32.688 -14.501 1.00 22.25 O ATOM 1433 CB ARG A 94 -0.959 33.033 -11.441 1.00 21.74 C ATOM 1434 CG ARG A 94 -0.683 32.527 -10.032 1.00 21.43 C ATOM 1435 CD ARG A 94 -1.949 32.055 -9.336 1.00 21.19 C ATOM 1436 NE ARG A 94 -3.007 33.061 -9.382 1.00 21.42 N ATOM 1437 CZ ARG A 94 -4.264 32.825 -9.015 1.00 21.61 C ATOM 1438 NH1 ARG A 94 -4.619 31.622 -8.582 1.00 21.58 N ATOM 1439 NH2 ARG A 94 -5.168 33.794 -9.081 1.00 21.94 N ATOM 0 H ARG A 94 0.024 30.765 -11.613 1.00 19.94 H new ATOM 0 HA ARG A 94 -2.554 31.778 -12.164 1.00 20.98 H new ATOM 0 HB2 ARG A 94 -0.036 33.438 -11.856 1.00 21.74 H new ATOM 0 HB3 ARG A 94 -1.672 33.856 -11.386 1.00 21.74 H new ATOM 0 HG2 ARG A 94 0.034 31.707 -10.076 1.00 21.43 H new ATOM 0 HG3 ARG A 94 -0.222 33.322 -9.446 1.00 21.43 H new ATOM 0 HD2 ARG A 94 -2.301 31.137 -9.807 1.00 21.19 H new ATOM 0 HD3 ARG A 94 -1.723 31.814 -8.297 1.00 21.19 H new ATOM 0 HE ARG A 94 -2.769 33.996 -9.714 1.00 21.42 H new ATOM 0 HH11 ARG A 94 -3.927 30.874 -8.530 1.00 21.58 H new ATOM 0 HH12 ARG A 94 -5.584 31.445 -8.302 1.00 21.58 H new ATOM 0 HH21 ARG A 94 -4.899 34.720 -9.413 1.00 21.94 H new ATOM 0 HH22 ARG A 94 -6.131 33.613 -8.800 1.00 21.94 H new ATOM 1453 N ASP A 95 -0.170 32.671 -14.295 1.00 21.37 N ATOM 1454 CA ASP A 95 0.071 33.161 -15.648 1.00 21.99 C ATOM 1455 C ASP A 95 0.021 32.021 -16.658 1.00 21.37 C ATOM 1456 O ASP A 95 0.162 30.853 -16.299 1.00 20.39 O ATOM 1457 CB ASP A 95 1.434 33.854 -15.727 1.00 22.48 C ATOM 1458 CG ASP A 95 1.855 34.463 -14.406 1.00 22.92 C ATOM 1459 OD1 ASP A 95 1.349 35.554 -14.065 1.00 22.92 O ATOM 1460 OD2 ASP A 95 2.692 33.849 -13.711 1.00 23.34 O ATOM 0 H ASP A 95 0.676 32.497 -13.753 1.00 21.37 H new ATOM 0 HA ASP A 95 -0.714 33.877 -15.890 1.00 21.99 H new ATOM 0 HB2 ASP A 95 2.186 33.133 -16.046 1.00 22.48 H new ATOM 0 HB3 ASP A 95 1.397 34.634 -16.487 1.00 22.48 H new ATOM 1465 N GLY A 96 -0.180 32.370 -17.924 1.00 22.00 N ATOM 1466 CA GLY A 96 -0.238 31.369 -18.971 1.00 21.64 C ATOM 1467 C GLY A 96 1.141 30.987 -19.475 1.00 21.55 C ATOM 1468 O GLY A 96 1.270 30.226 -20.434 1.00 21.40 O ATOM 0 H GLY A 96 -0.304 33.331 -18.244 1.00 22.00 H new ATOM 0 HA2 GLY A 96 -0.744 30.480 -18.594 1.00 21.64 H new ATOM 0 HA3 GLY A 96 -0.834 31.748 -19.801 1.00 21.64 H new ATOM 1472 N ASP A 97 2.172 31.522 -18.824 1.00 21.75 N ATOM 1473 CA ASP A 97 3.553 31.242 -19.204 1.00 21.82 C ATOM 1474 C ASP A 97 3.845 29.746 -19.157 1.00 20.80 C ATOM 1475 O ASP A 97 4.634 29.233 -19.952 1.00 20.85 O ATOM 1476 CB ASP A 97 4.518 31.992 -18.281 1.00 22.28 C ATOM 1477 CG ASP A 97 4.454 31.501 -16.847 1.00 21.72 C ATOM 1478 OD1 ASP A 97 3.333 31.313 -16.331 1.00 21.34 O ATOM 1479 OD2 ASP A 97 5.527 31.310 -16.237 1.00 21.74 O ATOM 0 H ASP A 97 2.075 32.153 -18.029 1.00 21.75 H new ATOM 0 HA ASP A 97 3.696 31.585 -20.229 1.00 21.82 H new ATOM 0 HB2 ASP A 97 5.535 31.878 -18.655 1.00 22.28 H new ATOM 0 HB3 ASP A 97 4.286 33.057 -18.307 1.00 22.28 H new ATOM 1484 N GLY A 98 3.204 29.050 -18.221 1.00 19.93 N ATOM 1485 CA GLY A 98 3.405 27.618 -18.090 1.00 18.92 C ATOM 1486 C GLY A 98 4.439 27.268 -17.037 1.00 18.54 C ATOM 1487 O GLY A 98 5.086 26.225 -17.118 1.00 17.94 O ATOM 0 H GLY A 98 2.549 29.453 -17.551 1.00 19.93 H new ATOM 0 HA2 GLY A 98 2.457 27.144 -17.835 1.00 18.92 H new ATOM 0 HA3 GLY A 98 3.718 27.209 -19.051 1.00 18.92 H new ATOM 1491 N PHE A 99 4.598 28.143 -16.046 1.00 19.01 N ATOM 1492 CA PHE A 99 5.561 27.919 -14.972 1.00 18.88 C ATOM 1493 C PHE A 99 5.008 28.407 -13.636 1.00 18.97 C ATOM 1494 O PHE A 99 4.326 29.432 -13.576 1.00 19.56 O ATOM 1495 CB PHE A 99 6.880 28.636 -15.279 1.00 19.81 C ATOM 1496 CG PHE A 99 7.474 28.274 -16.611 1.00 19.89 C ATOM 1497 CD1 PHE A 99 8.293 27.165 -16.741 1.00 19.90 C ATOM 1498 CD2 PHE A 99 7.212 29.044 -17.733 1.00 20.07 C ATOM 1499 CE1 PHE A 99 8.841 26.829 -17.964 1.00 20.10 C ATOM 1500 CE2 PHE A 99 7.757 28.713 -18.959 1.00 20.28 C ATOM 1501 CZ PHE A 99 8.571 27.605 -19.076 1.00 20.30 C ATOM 0 H PHE A 99 4.072 29.013 -15.965 1.00 19.01 H new ATOM 0 HA PHE A 99 5.745 26.847 -14.903 1.00 18.88 H new ATOM 0 HB2 PHE A 99 6.713 29.713 -15.247 1.00 19.81 H new ATOM 0 HB3 PHE A 99 7.600 28.402 -14.495 1.00 19.81 H new ATOM 0 HD1 PHE A 99 8.506 26.555 -15.876 1.00 19.90 H new ATOM 0 HD2 PHE A 99 6.575 29.912 -17.648 1.00 20.07 H new ATOM 0 HE1 PHE A 99 9.479 25.962 -18.051 1.00 20.10 H new ATOM 0 HE2 PHE A 99 7.546 29.322 -19.826 1.00 20.28 H new ATOM 0 HZ PHE A 99 8.996 27.345 -20.034 1.00 20.30 H new ATOM 1511 N ILE A 100 5.307 27.673 -12.564 1.00 18.48 N ATOM 1512 CA ILE A 100 4.836 28.043 -11.234 1.00 18.67 C ATOM 1513 C ILE A 100 6.001 28.418 -10.321 1.00 19.37 C ATOM 1514 O ILE A 100 6.959 27.659 -10.171 1.00 19.21 O ATOM 1515 CB ILE A 100 4.028 26.902 -10.586 1.00 17.64 C ATOM 1516 CG1 ILE A 100 2.870 26.491 -11.501 1.00 16.97 C ATOM 1517 CG2 ILE A 100 3.506 27.327 -9.220 1.00 18.04 C ATOM 1518 CD1 ILE A 100 2.103 25.285 -11.006 1.00 15.92 C ATOM 0 H ILE A 100 5.871 26.823 -12.592 1.00 18.48 H new ATOM 0 HA ILE A 100 4.186 28.909 -11.357 1.00 18.67 H new ATOM 0 HB ILE A 100 4.685 26.043 -10.448 1.00 17.64 H new ATOM 0 HG12 ILE A 100 2.183 27.331 -11.602 1.00 16.97 H new ATOM 0 HG13 ILE A 100 3.262 26.278 -12.495 1.00 16.97 H new ATOM 0 HG21 ILE A 100 2.938 26.509 -8.777 1.00 18.04 H new ATOM 0 HG22 ILE A 100 4.345 27.578 -8.572 1.00 18.04 H new ATOM 0 HG23 ILE A 100 2.861 28.198 -9.332 1.00 18.04 H new ATOM 0 HD11 ILE A 100 1.299 25.053 -11.705 1.00 15.92 H new ATOM 0 HD12 ILE A 100 2.776 24.431 -10.931 1.00 15.92 H new ATOM 0 HD13 ILE A 100 1.680 25.500 -10.025 1.00 15.92 H new ATOM 1530 N SER A 101 5.905 29.598 -9.711 1.00 20.25 N ATOM 1531 CA SER A 101 6.943 30.093 -8.813 1.00 21.07 C ATOM 1532 C SER A 101 6.416 30.201 -7.382 1.00 21.23 C ATOM 1533 O SER A 101 5.207 30.304 -7.177 1.00 20.98 O ATOM 1534 CB SER A 101 7.447 31.457 -9.286 1.00 22.16 C ATOM 1535 OG SER A 101 8.104 31.355 -10.538 1.00 22.49 O ATOM 0 H SER A 101 5.113 30.231 -9.824 1.00 20.25 H new ATOM 0 HA SER A 101 7.770 29.383 -8.826 1.00 21.07 H new ATOM 0 HB2 SER A 101 6.609 32.149 -9.368 1.00 22.16 H new ATOM 0 HB3 SER A 101 8.132 31.871 -8.546 1.00 22.16 H new ATOM 0 HG SER A 101 8.415 32.241 -10.818 1.00 22.49 H new ATOM 1541 N PRO A 102 7.309 30.167 -6.371 1.00 21.74 N ATOM 1542 CA PRO A 102 6.907 30.259 -4.964 1.00 22.05 C ATOM 1543 C PRO A 102 5.860 31.345 -4.731 1.00 22.55 C ATOM 1544 O PRO A 102 4.959 31.185 -3.906 1.00 22.43 O ATOM 1545 CB PRO A 102 8.213 30.606 -4.252 1.00 23.00 C ATOM 1546 CG PRO A 102 9.275 29.992 -5.097 1.00 22.78 C ATOM 1547 CD PRO A 102 8.775 30.055 -6.518 1.00 22.19 C ATOM 0 HA PRO A 102 6.442 29.340 -4.606 1.00 22.05 H new ATOM 0 HB2 PRO A 102 8.346 31.685 -4.170 1.00 23.00 H new ATOM 0 HB3 PRO A 102 8.231 30.205 -3.239 1.00 23.00 H new ATOM 0 HG2 PRO A 102 10.216 30.532 -4.992 1.00 22.78 H new ATOM 0 HG3 PRO A 102 9.463 28.961 -4.797 1.00 22.78 H new ATOM 0 HD2 PRO A 102 9.190 30.911 -7.051 1.00 22.19 H new ATOM 0 HD3 PRO A 102 9.054 29.164 -7.080 1.00 22.19 H new ATOM 1555 N ALA A 103 5.981 32.444 -5.469 1.00 23.17 N ATOM 1556 CA ALA A 103 5.042 33.554 -5.348 1.00 23.77 C ATOM 1557 C ALA A 103 3.640 33.123 -5.765 1.00 23.02 C ATOM 1558 O ALA A 103 2.662 33.380 -5.062 1.00 23.22 O ATOM 1559 CB ALA A 103 5.506 34.728 -6.195 1.00 24.56 C ATOM 0 H ALA A 103 6.720 32.590 -6.157 1.00 23.17 H new ATOM 0 HA ALA A 103 5.008 33.864 -4.304 1.00 23.77 H new ATOM 0 HB1 ALA A 103 4.797 35.550 -6.097 1.00 24.56 H new ATOM 0 HB2 ALA A 103 6.490 35.054 -5.857 1.00 24.56 H new ATOM 0 HB3 ALA A 103 5.564 34.422 -7.240 1.00 24.56 H new ATOM 1565 N GLU A 104 3.555 32.465 -6.915 1.00 22.23 N ATOM 1566 CA GLU A 104 2.284 31.986 -7.437 1.00 21.53 C ATOM 1567 C GLU A 104 1.786 30.789 -6.637 1.00 20.75 C ATOM 1568 O GLU A 104 0.600 30.464 -6.662 1.00 20.59 O ATOM 1569 CB GLU A 104 2.442 31.589 -8.905 1.00 20.94 C ATOM 1570 CG GLU A 104 2.779 32.752 -9.821 1.00 21.74 C ATOM 1571 CD GLU A 104 2.947 32.320 -11.265 1.00 21.28 C ATOM 1572 OE1 GLU A 104 1.926 32.031 -11.923 1.00 21.43 O ATOM 1573 OE2 GLU A 104 4.102 32.271 -11.738 1.00 20.84 O ATOM 0 H GLU A 104 4.358 32.251 -7.506 1.00 22.23 H new ATOM 0 HA GLU A 104 1.554 32.791 -7.351 1.00 21.53 H new ATOM 0 HB2 GLU A 104 3.226 30.836 -8.986 1.00 20.94 H new ATOM 0 HB3 GLU A 104 1.517 31.125 -9.248 1.00 20.94 H new ATOM 0 HG2 GLU A 104 1.990 33.501 -9.758 1.00 21.74 H new ATOM 0 HG3 GLU A 104 3.698 33.227 -9.477 1.00 21.74 H new ATOM 1580 N LEU A 105 2.703 30.139 -5.926 1.00 20.36 N ATOM 1581 CA LEU A 105 2.368 28.966 -5.128 1.00 19.67 C ATOM 1582 C LEU A 105 1.740 29.353 -3.793 1.00 20.33 C ATOM 1583 O LEU A 105 0.805 28.703 -3.326 1.00 19.95 O ATOM 1584 CB LEU A 105 3.617 28.125 -4.881 1.00 19.42 C ATOM 1585 CG LEU A 105 3.355 26.743 -4.286 1.00 18.62 C ATOM 1586 CD1 LEU A 105 2.850 25.790 -5.355 1.00 17.90 C ATOM 1587 CD2 LEU A 105 4.613 26.196 -3.638 1.00 18.59 C ATOM 0 H LEU A 105 3.686 30.407 -5.887 1.00 20.36 H new ATOM 0 HA LEU A 105 1.638 28.384 -5.690 1.00 19.67 H new ATOM 0 HB2 LEU A 105 4.148 28.003 -5.825 1.00 19.42 H new ATOM 0 HB3 LEU A 105 4.280 28.673 -4.211 1.00 19.42 H new ATOM 0 HG LEU A 105 2.586 26.839 -3.519 1.00 18.62 H new ATOM 0 HD11 LEU A 105 2.669 24.810 -4.913 1.00 17.90 H new ATOM 0 HD12 LEU A 105 1.922 26.175 -5.777 1.00 17.90 H new ATOM 0 HD13 LEU A 105 3.597 25.699 -6.144 1.00 17.90 H new ATOM 0 HD21 LEU A 105 4.408 25.211 -3.219 1.00 18.59 H new ATOM 0 HD22 LEU A 105 5.402 26.115 -4.386 1.00 18.59 H new ATOM 0 HD23 LEU A 105 4.934 26.868 -2.843 1.00 18.59 H new ATOM 1599 N ARG A 106 2.263 30.403 -3.172 1.00 21.40 N ATOM 1600 CA ARG A 106 1.742 30.857 -1.889 1.00 22.20 C ATOM 1601 C ARG A 106 0.399 31.553 -2.074 1.00 22.44 C ATOM 1602 O ARG A 106 -0.493 31.437 -1.234 1.00 22.57 O ATOM 1603 CB ARG A 106 2.739 31.798 -1.206 1.00 23.35 C ATOM 1604 CG ARG A 106 2.926 33.128 -1.917 1.00 24.22 C ATOM 1605 CD ARG A 106 2.045 34.209 -1.314 1.00 25.21 C ATOM 1606 NE ARG A 106 2.242 35.502 -1.963 1.00 25.76 N ATOM 1607 CZ ARG A 106 1.473 36.564 -1.740 1.00 26.69 C ATOM 1608 NH1 ARG A 106 0.459 36.487 -0.888 1.00 27.16 N ATOM 1609 NH2 ARG A 106 1.718 37.705 -2.368 1.00 27.19 N ATOM 0 H ARG A 106 3.042 30.953 -3.533 1.00 21.40 H new ATOM 0 HA ARG A 106 1.596 29.985 -1.251 1.00 22.20 H new ATOM 0 HB2 ARG A 106 2.403 31.988 -0.187 1.00 23.35 H new ATOM 0 HB3 ARG A 106 3.705 31.297 -1.135 1.00 23.35 H new ATOM 0 HG2 ARG A 106 3.971 33.432 -1.855 1.00 24.22 H new ATOM 0 HG3 ARG A 106 2.690 33.013 -2.975 1.00 24.22 H new ATOM 0 HD2 ARG A 106 0.999 33.915 -1.402 1.00 25.21 H new ATOM 0 HD3 ARG A 106 2.262 34.301 -0.250 1.00 25.21 H new ATOM 0 HE ARG A 106 3.013 35.596 -2.625 1.00 25.76 H new ATOM 0 HH11 ARG A 106 0.267 35.611 -0.401 1.00 27.16 H new ATOM 0 HH12 ARG A 106 -0.129 37.304 -0.719 1.00 27.16 H new ATOM 0 HH21 ARG A 106 2.497 37.769 -3.023 1.00 27.19 H new ATOM 0 HH22 ARG A 106 1.127 38.519 -2.196 1.00 27.19 H new ATOM 1623 N PHE A 107 0.265 32.272 -3.181 1.00 22.61 N ATOM 1624 CA PHE A 107 -0.967 32.992 -3.485 1.00 22.97 C ATOM 1625 C PHE A 107 -2.106 32.029 -3.813 1.00 22.14 C ATOM 1626 O PHE A 107 -3.227 32.197 -3.331 1.00 22.53 O ATOM 1627 CB PHE A 107 -0.745 33.953 -4.656 1.00 23.24 C ATOM 1628 CG PHE A 107 -1.918 34.854 -4.924 1.00 23.93 C ATOM 1629 CD1 PHE A 107 -2.053 36.056 -4.247 1.00 24.48 C ATOM 1630 CD2 PHE A 107 -2.884 34.500 -5.852 1.00 24.11 C ATOM 1631 CE1 PHE A 107 -3.130 36.888 -4.491 1.00 25.19 C ATOM 1632 CE2 PHE A 107 -3.963 35.327 -6.101 1.00 24.82 C ATOM 1633 CZ PHE A 107 -4.086 36.523 -5.419 1.00 25.36 C ATOM 0 H PHE A 107 0.996 32.373 -3.885 1.00 22.61 H new ATOM 0 HA PHE A 107 -1.247 33.562 -2.599 1.00 22.97 H new ATOM 0 HB2 PHE A 107 0.134 34.565 -4.452 1.00 23.24 H new ATOM 0 HB3 PHE A 107 -0.529 33.375 -5.554 1.00 23.24 H new ATOM 0 HD1 PHE A 107 -1.308 36.346 -3.521 1.00 24.48 H new ATOM 0 HD2 PHE A 107 -2.793 33.566 -6.387 1.00 24.11 H new ATOM 0 HE1 PHE A 107 -3.224 37.822 -3.957 1.00 25.19 H new ATOM 0 HE2 PHE A 107 -4.709 35.039 -6.827 1.00 24.82 H new ATOM 0 HZ PHE A 107 -4.928 37.171 -5.611 1.00 25.36 H new ATOM 1643 N VAL A 108 -1.815 31.021 -4.632 1.00 21.06 N ATOM 1644 CA VAL A 108 -2.825 30.043 -5.025 1.00 20.23 C ATOM 1645 C VAL A 108 -3.329 29.244 -3.826 1.00 20.08 C ATOM 1646 O VAL A 108 -4.529 29.018 -3.684 1.00 20.21 O ATOM 1647 CB VAL A 108 -2.292 29.076 -6.091 1.00 19.12 C ATOM 1648 CG1 VAL A 108 -1.082 28.355 -5.560 1.00 18.33 C ATOM 1649 CG2 VAL A 108 -3.372 28.092 -6.518 1.00 19.13 C ATOM 0 H VAL A 108 -0.892 30.861 -5.035 1.00 21.06 H new ATOM 0 HA VAL A 108 -3.655 30.609 -5.447 1.00 20.23 H new ATOM 0 HB VAL A 108 -2.001 29.646 -6.973 1.00 19.12 H new ATOM 0 HG11 VAL A 108 -0.705 27.669 -6.319 1.00 18.33 H new ATOM 0 HG12 VAL A 108 -0.307 29.080 -5.309 1.00 18.33 H new ATOM 0 HG13 VAL A 108 -1.356 27.793 -4.667 1.00 18.33 H new ATOM 0 HG21 VAL A 108 -2.971 27.417 -7.274 1.00 19.13 H new ATOM 0 HG22 VAL A 108 -3.701 27.515 -5.654 1.00 19.13 H new ATOM 0 HG23 VAL A 108 -4.219 28.639 -6.933 1.00 19.13 H new ATOM 1659 N MET A 109 -2.407 28.815 -2.968 1.00 19.93 N ATOM 1660 CA MET A 109 -2.765 28.041 -1.784 1.00 19.90 C ATOM 1661 C MET A 109 -3.789 28.779 -0.929 1.00 20.93 C ATOM 1662 O MET A 109 -4.772 28.190 -0.480 1.00 20.91 O ATOM 1663 CB MET A 109 -1.519 27.727 -0.960 1.00 20.00 C ATOM 1664 CG MET A 109 -0.651 26.643 -1.572 1.00 18.99 C ATOM 1665 SD MET A 109 -1.439 25.023 -1.530 1.00 18.30 S ATOM 1666 CE MET A 109 -0.141 24.000 -2.216 1.00 17.64 C ATOM 0 H MET A 109 -1.407 28.990 -3.071 1.00 19.93 H new ATOM 0 HA MET A 109 -3.216 27.106 -2.118 1.00 19.90 H new ATOM 0 HB2 MET A 109 -0.928 28.636 -0.848 1.00 20.00 H new ATOM 0 HB3 MET A 109 -1.822 27.418 0.040 1.00 20.00 H new ATOM 0 HG2 MET A 109 -0.422 26.905 -2.605 1.00 18.99 H new ATOM 0 HG3 MET A 109 0.298 26.596 -1.037 1.00 18.99 H new ATOM 0 HE1 MET A 109 -0.477 22.964 -2.256 1.00 17.64 H new ATOM 0 HE2 MET A 109 0.099 24.343 -3.223 1.00 17.64 H new ATOM 0 HE3 MET A 109 0.747 24.069 -1.588 1.00 17.64 H new ATOM 1676 N ILE A 110 -3.554 30.068 -0.707 1.00 21.91 N ATOM 1677 CA ILE A 110 -4.464 30.880 0.092 1.00 22.98 C ATOM 1678 C ILE A 110 -5.860 30.889 -0.526 1.00 22.97 C ATOM 1679 O ILE A 110 -6.858 31.094 0.166 1.00 23.58 O ATOM 1680 CB ILE A 110 -3.950 32.328 0.231 1.00 24.01 C ATOM 1681 CG1 ILE A 110 -2.571 32.336 0.893 1.00 24.18 C ATOM 1682 CG2 ILE A 110 -4.932 33.170 1.035 1.00 25.13 C ATOM 1683 CD1 ILE A 110 -1.879 33.682 0.845 1.00 25.10 C ATOM 0 H ILE A 110 -2.744 30.571 -1.068 1.00 21.91 H new ATOM 0 HA ILE A 110 -4.513 30.434 1.085 1.00 22.98 H new ATOM 0 HB ILE A 110 -3.863 32.763 -0.765 1.00 24.01 H new ATOM 0 HG12 ILE A 110 -2.676 32.028 1.933 1.00 24.18 H new ATOM 0 HG13 ILE A 110 -1.939 31.595 0.404 1.00 24.18 H new ATOM 0 HG21 ILE A 110 -4.552 34.188 1.122 1.00 25.13 H new ATOM 0 HG22 ILE A 110 -5.897 33.185 0.529 1.00 25.13 H new ATOM 0 HG23 ILE A 110 -5.050 32.740 2.030 1.00 25.13 H new ATOM 0 HD11 ILE A 110 -0.907 33.609 1.334 1.00 25.10 H new ATOM 0 HD12 ILE A 110 -1.741 33.983 -0.193 1.00 25.10 H new ATOM 0 HD13 ILE A 110 -2.490 34.424 1.360 1.00 25.10 H new ATOM 1695 N ASN A 111 -5.919 30.658 -1.834 1.00 22.36 N ATOM 1696 CA ASN A 111 -7.190 30.630 -2.551 1.00 22.40 C ATOM 1697 C ASN A 111 -7.913 29.309 -2.307 1.00 21.78 C ATOM 1698 O ASN A 111 -9.133 29.276 -2.149 1.00 22.21 O ATOM 1699 CB ASN A 111 -6.964 30.829 -4.051 1.00 21.96 C ATOM 1700 CG ASN A 111 -6.311 32.160 -4.369 1.00 22.60 C ATOM 1701 OD1 ASN A 111 -6.493 33.143 -3.650 1.00 23.32 O ATOM 1702 ND2 ASN A 111 -5.546 32.199 -5.453 1.00 22.44 N ATOM 0 H ASN A 111 -5.101 30.487 -2.419 1.00 22.36 H new ATOM 0 HA ASN A 111 -7.809 31.445 -2.177 1.00 22.40 H new ATOM 0 HB2 ASN A 111 -6.339 30.021 -4.431 1.00 21.96 H new ATOM 0 HB3 ASN A 111 -7.920 30.764 -4.571 1.00 21.96 H new ATOM 0 HD21 ASN A 111 -5.082 33.067 -5.718 1.00 22.44 H new ATOM 0 HD22 ASN A 111 -5.423 31.360 -6.020 1.00 22.44 H new ATOM 1709 N LEU A 112 -7.146 28.223 -2.278 1.00 20.83 N ATOM 1710 CA LEU A 112 -7.704 26.896 -2.051 1.00 20.19 C ATOM 1711 C LEU A 112 -8.195 26.757 -0.613 1.00 20.95 C ATOM 1712 O LEU A 112 -9.124 25.999 -0.333 1.00 21.07 O ATOM 1713 CB LEU A 112 -6.655 25.820 -2.346 1.00 19.00 C ATOM 1714 CG LEU A 112 -5.767 26.090 -3.563 1.00 18.25 C ATOM 1715 CD1 LEU A 112 -4.721 24.997 -3.714 1.00 17.58 C ATOM 1716 CD2 LEU A 112 -6.604 26.204 -4.829 1.00 17.84 C ATOM 0 H LEU A 112 -6.135 28.237 -2.409 1.00 20.83 H new ATOM 0 HA LEU A 112 -8.550 26.763 -2.725 1.00 20.19 H new ATOM 0 HB2 LEU A 112 -6.017 25.707 -1.469 1.00 19.00 H new ATOM 0 HB3 LEU A 112 -7.166 24.868 -2.493 1.00 19.00 H new ATOM 0 HG LEU A 112 -5.255 27.039 -3.406 1.00 18.25 H new ATOM 0 HD11 LEU A 112 -4.099 25.206 -4.584 1.00 17.58 H new ATOM 0 HD12 LEU A 112 -4.097 24.965 -2.821 1.00 17.58 H new ATOM 0 HD13 LEU A 112 -5.216 24.035 -3.845 1.00 17.58 H new ATOM 0 HD21 LEU A 112 -5.951 26.396 -5.681 1.00 17.84 H new ATOM 0 HD22 LEU A 112 -7.148 25.273 -4.991 1.00 17.84 H new ATOM 0 HD23 LEU A 112 -7.313 27.025 -4.723 1.00 17.84 H new ATOM 1728 N GLY A 113 -7.563 27.498 0.292 1.00 21.57 N ATOM 1729 CA GLY A 113 -7.942 27.449 1.693 1.00 22.41 C ATOM 1730 C GLY A 113 -6.861 26.844 2.566 1.00 22.40 C ATOM 1731 O GLY A 113 -7.123 26.439 3.699 1.00 23.05 O ATOM 0 H GLY A 113 -6.793 28.133 0.080 1.00 21.57 H new ATOM 0 HA2 GLY A 113 -8.164 28.458 2.042 1.00 22.41 H new ATOM 0 HA3 GLY A 113 -8.858 26.867 1.798 1.00 22.41 H new ATOM 1735 N GLU A 114 -5.643 26.780 2.035 1.00 21.76 N ATOM 1736 CA GLU A 114 -4.515 26.219 2.770 1.00 21.80 C ATOM 1737 C GLU A 114 -3.473 27.291 3.079 1.00 22.59 C ATOM 1738 O GLU A 114 -2.772 27.765 2.185 1.00 22.48 O ATOM 1739 CB GLU A 114 -3.875 25.086 1.973 1.00 20.80 C ATOM 1740 CG GLU A 114 -4.853 23.994 1.573 1.00 20.26 C ATOM 1741 CD GLU A 114 -5.448 23.274 2.767 1.00 20.12 C ATOM 1742 OE1 GLU A 114 -4.844 22.281 3.224 1.00 19.96 O ATOM 1743 OE2 GLU A 114 -6.518 23.703 3.247 1.00 20.27 O ATOM 0 H GLU A 114 -5.413 27.110 1.098 1.00 21.76 H new ATOM 0 HA GLU A 114 -4.891 25.824 3.714 1.00 21.80 H new ATOM 0 HB2 GLU A 114 -3.417 25.499 1.074 1.00 20.80 H new ATOM 0 HB3 GLU A 114 -3.073 24.645 2.565 1.00 20.80 H new ATOM 0 HG2 GLU A 114 -5.657 24.431 0.980 1.00 20.26 H new ATOM 0 HG3 GLU A 114 -4.343 23.272 0.935 1.00 20.26 H new ATOM 1750 N LYS A 115 -3.378 27.667 4.351 1.00 23.45 N ATOM 1751 CA LYS A 115 -2.422 28.682 4.783 1.00 24.32 C ATOM 1752 C LYS A 115 -1.012 28.105 4.865 1.00 23.94 C ATOM 1753 O LYS A 115 -0.732 27.239 5.696 1.00 23.86 O ATOM 1754 CB LYS A 115 -2.836 29.249 6.145 1.00 25.48 C ATOM 1755 CG LYS A 115 -1.893 30.317 6.681 1.00 26.26 C ATOM 1756 CD LYS A 115 -1.930 31.582 5.836 1.00 26.75 C ATOM 1757 CE LYS A 115 -3.294 32.254 5.889 1.00 27.55 C ATOM 1758 NZ LYS A 115 -3.305 33.550 5.157 1.00 27.96 N ATOM 0 H LYS A 115 -3.952 27.283 5.102 1.00 23.45 H new ATOM 0 HA LYS A 115 -2.421 29.484 4.045 1.00 24.32 H new ATOM 0 HB2 LYS A 115 -3.838 29.671 6.063 1.00 25.48 H new ATOM 0 HB3 LYS A 115 -2.892 28.433 6.865 1.00 25.48 H new ATOM 0 HG2 LYS A 115 -2.165 30.559 7.709 1.00 26.26 H new ATOM 0 HG3 LYS A 115 -0.876 29.925 6.704 1.00 26.26 H new ATOM 0 HD2 LYS A 115 -1.168 32.277 6.188 1.00 26.75 H new ATOM 0 HD3 LYS A 115 -1.685 31.337 4.803 1.00 26.75 H new ATOM 0 HE2 LYS A 115 -4.043 31.589 5.460 1.00 27.55 H new ATOM 0 HE3 LYS A 115 -3.575 32.422 6.929 1.00 27.55 H new ATOM 0 HZ1 LYS A 115 -4.252 33.975 5.218 1.00 27.96 H new ATOM 0 HZ2 LYS A 115 -2.609 34.195 5.582 1.00 27.96 H new ATOM 0 HZ3 LYS A 115 -3.062 33.387 4.159 1.00 27.96 H new ATOM 1772 N VAL A 116 -0.127 28.590 3.999 1.00 23.78 N ATOM 1773 CA VAL A 116 1.256 28.125 3.970 1.00 23.53 C ATOM 1774 C VAL A 116 2.240 29.286 4.049 1.00 24.38 C ATOM 1775 O VAL A 116 1.920 30.416 3.677 1.00 24.75 O ATOM 1776 CB VAL A 116 1.556 27.320 2.691 1.00 22.24 C ATOM 1777 CG1 VAL A 116 1.111 25.875 2.846 1.00 21.40 C ATOM 1778 CG2 VAL A 116 0.887 27.966 1.487 1.00 21.91 C ATOM 0 H VAL A 116 -0.344 29.307 3.306 1.00 23.78 H new ATOM 0 HA VAL A 116 1.379 27.483 4.842 1.00 23.53 H new ATOM 0 HB VAL A 116 2.634 27.324 2.527 1.00 22.24 H new ATOM 0 HG11 VAL A 116 1.333 25.326 1.931 1.00 21.40 H new ATOM 0 HG12 VAL A 116 1.642 25.418 3.681 1.00 21.40 H new ATOM 0 HG13 VAL A 116 0.038 25.843 3.037 1.00 21.40 H new ATOM 0 HG21 VAL A 116 1.109 27.385 0.592 1.00 21.91 H new ATOM 0 HG22 VAL A 116 -0.191 27.995 1.642 1.00 21.91 H new ATOM 0 HG23 VAL A 116 1.263 28.981 1.363 1.00 21.91 H new ATOM 1788 N THR A 117 3.441 28.994 4.538 1.00 24.76 N ATOM 1789 CA THR A 117 4.488 29.999 4.658 1.00 25.62 C ATOM 1790 C THR A 117 5.463 29.887 3.490 1.00 25.03 C ATOM 1791 O THR A 117 5.752 28.787 3.019 1.00 24.12 O ATOM 1792 CB THR A 117 5.265 29.849 5.978 1.00 26.54 C ATOM 1793 OG1 THR A 117 5.859 28.547 6.053 1.00 25.98 O ATOM 1794 CG2 THR A 117 4.349 30.062 7.174 1.00 27.24 C ATOM 0 H THR A 117 3.713 28.065 4.859 1.00 24.76 H new ATOM 0 HA THR A 117 4.006 30.976 4.647 1.00 25.62 H new ATOM 0 HB THR A 117 6.048 30.607 6.000 1.00 26.54 H new ATOM 0 HG1 THR A 117 6.353 28.461 6.895 1.00 25.98 H new ATOM 0 HG21 THR A 117 4.921 29.951 8.095 1.00 27.24 H new ATOM 0 HG22 THR A 117 3.922 31.064 7.131 1.00 27.24 H new ATOM 0 HG23 THR A 117 3.547 29.324 7.154 1.00 27.24 H new ATOM 1802 N ASP A 118 5.965 31.029 3.031 1.00 25.62 N ATOM 1803 CA ASP A 118 6.901 31.064 1.910 1.00 25.26 C ATOM 1804 C ASP A 118 8.074 30.112 2.129 1.00 25.12 C ATOM 1805 O ASP A 118 8.739 29.706 1.175 1.00 24.60 O ATOM 1806 CB ASP A 118 7.421 32.488 1.699 1.00 26.22 C ATOM 1807 CG ASP A 118 6.311 33.467 1.372 1.00 26.44 C ATOM 1808 OD1 ASP A 118 5.954 33.583 0.181 1.00 26.63 O ATOM 1809 OD2 ASP A 118 5.801 34.120 2.306 1.00 26.51 O ATOM 0 H ASP A 118 5.739 31.945 3.418 1.00 25.62 H new ATOM 0 HA ASP A 118 6.363 30.738 1.020 1.00 25.26 H new ATOM 0 HB2 ASP A 118 7.940 32.819 2.598 1.00 26.22 H new ATOM 0 HB3 ASP A 118 8.152 32.489 0.890 1.00 26.22 H new ATOM 1814 N GLU A 119 8.319 29.751 3.386 1.00 25.66 N ATOM 1815 CA GLU A 119 9.418 28.852 3.723 1.00 25.70 C ATOM 1816 C GLU A 119 9.075 27.398 3.407 1.00 24.54 C ATOM 1817 O GLU A 119 9.803 26.728 2.674 1.00 24.02 O ATOM 1818 CB GLU A 119 9.778 28.990 5.203 1.00 26.79 C ATOM 1819 CG GLU A 119 10.350 30.350 5.569 1.00 27.99 C ATOM 1820 CD GLU A 119 11.663 30.639 4.866 1.00 28.61 C ATOM 1821 OE1 GLU A 119 11.625 31.162 3.732 1.00 29.14 O ATOM 1822 OE2 GLU A 119 12.727 30.340 5.448 1.00 28.61 O ATOM 0 H GLU A 119 7.772 30.067 4.187 1.00 25.66 H new ATOM 0 HA GLU A 119 10.275 29.136 3.112 1.00 25.70 H new ATOM 0 HB2 GLU A 119 8.887 28.807 5.803 1.00 26.79 H new ATOM 0 HB3 GLU A 119 10.502 28.219 5.465 1.00 26.79 H new ATOM 0 HG2 GLU A 119 9.627 31.125 5.314 1.00 27.99 H new ATOM 0 HG3 GLU A 119 10.501 30.398 6.647 1.00 27.99 H new ATOM 1829 N GLU A 120 7.966 26.914 3.961 1.00 24.19 N ATOM 1830 CA GLU A 120 7.547 25.532 3.744 1.00 23.13 C ATOM 1831 C GLU A 120 7.269 25.248 2.270 1.00 21.97 C ATOM 1832 O GLU A 120 7.639 24.189 1.755 1.00 21.17 O ATOM 1833 CB GLU A 120 6.310 25.207 4.585 1.00 23.10 C ATOM 1834 CG GLU A 120 5.071 25.999 4.202 1.00 22.97 C ATOM 1835 CD GLU A 120 3.855 25.599 5.015 1.00 23.00 C ATOM 1836 OE1 GLU A 120 3.297 24.513 4.754 1.00 22.54 O ATOM 1837 OE2 GLU A 120 3.460 26.374 5.911 1.00 23.55 O ATOM 0 H GLU A 120 7.344 27.456 4.561 1.00 24.19 H new ATOM 0 HA GLU A 120 8.371 24.890 4.057 1.00 23.13 H new ATOM 0 HB2 GLU A 120 6.091 24.143 4.492 1.00 23.10 H new ATOM 0 HB3 GLU A 120 6.538 25.395 5.634 1.00 23.10 H new ATOM 0 HG2 GLU A 120 5.265 27.062 4.343 1.00 22.97 H new ATOM 0 HG3 GLU A 120 4.861 25.851 3.143 1.00 22.97 H new ATOM 1844 N ILE A 121 6.630 26.192 1.587 1.00 21.93 N ATOM 1845 CA ILE A 121 6.307 26.012 0.178 1.00 20.94 C ATOM 1846 C ILE A 121 7.561 26.016 -0.690 1.00 20.97 C ATOM 1847 O ILE A 121 7.689 25.204 -1.606 1.00 20.10 O ATOM 1848 CB ILE A 121 5.331 27.088 -0.335 1.00 21.05 C ATOM 1849 CG1 ILE A 121 5.872 28.490 -0.063 1.00 22.23 C ATOM 1850 CG2 ILE A 121 3.965 26.907 0.307 1.00 20.98 C ATOM 1851 CD1 ILE A 121 5.460 29.504 -1.109 1.00 22.33 C ATOM 0 H ILE A 121 6.328 27.082 1.983 1.00 21.93 H new ATOM 0 HA ILE A 121 5.822 25.039 0.101 1.00 20.94 H new ATOM 0 HB ILE A 121 5.228 26.972 -1.414 1.00 21.05 H new ATOM 0 HG12 ILE A 121 5.522 28.824 0.914 1.00 22.23 H new ATOM 0 HG13 ILE A 121 6.960 28.449 -0.015 1.00 22.23 H new ATOM 0 HG21 ILE A 121 3.284 27.673 -0.064 1.00 20.98 H new ATOM 0 HG22 ILE A 121 3.573 25.921 0.056 1.00 20.98 H new ATOM 0 HG23 ILE A 121 4.057 26.996 1.389 1.00 20.98 H new ATOM 0 HD11 ILE A 121 5.878 30.478 -0.856 1.00 22.33 H new ATOM 0 HD12 ILE A 121 5.833 29.192 -2.085 1.00 22.33 H new ATOM 0 HD13 ILE A 121 4.373 29.573 -1.141 1.00 22.33 H new ATOM 1863 N ASP A 122 8.483 26.933 -0.406 1.00 22.05 N ATOM 1864 CA ASP A 122 9.720 27.021 -1.172 1.00 22.30 C ATOM 1865 C ASP A 122 10.504 25.715 -1.080 1.00 21.86 C ATOM 1866 O ASP A 122 11.183 25.319 -2.027 1.00 21.46 O ATOM 1867 CB ASP A 122 10.578 28.185 -0.673 1.00 23.63 C ATOM 1868 CG ASP A 122 11.862 28.337 -1.463 1.00 24.02 C ATOM 1869 OD1 ASP A 122 11.827 28.973 -2.537 1.00 24.14 O ATOM 1870 OD2 ASP A 122 12.905 27.820 -1.008 1.00 24.29 O ATOM 0 H ASP A 122 8.397 27.620 0.343 1.00 22.05 H new ATOM 0 HA ASP A 122 9.461 27.199 -2.216 1.00 22.30 H new ATOM 0 HB2 ASP A 122 10.004 29.109 -0.737 1.00 23.63 H new ATOM 0 HB3 ASP A 122 10.818 28.031 0.379 1.00 23.63 H new ATOM 1875 N GLU A 123 10.402 25.053 0.068 1.00 22.03 N ATOM 1876 CA GLU A 123 11.092 23.787 0.285 1.00 21.74 C ATOM 1877 C GLU A 123 10.529 22.710 -0.634 1.00 20.39 C ATOM 1878 O GLU A 123 11.278 21.999 -1.307 1.00 20.02 O ATOM 1879 CB GLU A 123 10.959 23.349 1.745 1.00 22.27 C ATOM 1880 CG GLU A 123 11.751 24.212 2.715 1.00 23.66 C ATOM 1881 CD GLU A 123 13.250 24.051 2.548 1.00 24.40 C ATOM 1882 OE1 GLU A 123 13.825 23.151 3.195 1.00 24.74 O ATOM 1883 OE2 GLU A 123 13.847 24.825 1.771 1.00 24.71 O ATOM 0 H GLU A 123 9.848 25.373 0.862 1.00 22.03 H new ATOM 0 HA GLU A 123 12.148 23.929 0.055 1.00 21.74 H new ATOM 0 HB2 GLU A 123 9.907 23.372 2.028 1.00 22.27 H new ATOM 0 HB3 GLU A 123 11.292 22.315 1.837 1.00 22.27 H new ATOM 0 HG2 GLU A 123 11.483 25.258 2.567 1.00 23.66 H new ATOM 0 HG3 GLU A 123 11.473 23.953 3.737 1.00 23.66 H new ATOM 1890 N MET A 124 9.205 22.593 -0.653 1.00 19.71 N ATOM 1891 CA MET A 124 8.532 21.613 -1.492 1.00 18.41 C ATOM 1892 C MET A 124 8.908 21.797 -2.959 1.00 17.96 C ATOM 1893 O MET A 124 9.070 20.823 -3.694 1.00 17.13 O ATOM 1894 CB MET A 124 7.019 21.734 -1.313 1.00 17.97 C ATOM 1895 CG MET A 124 6.213 20.999 -2.367 1.00 16.63 C ATOM 1896 SD MET A 124 5.354 22.118 -3.489 1.00 16.29 S ATOM 1897 CE MET A 124 4.214 22.917 -2.361 1.00 17.07 C ATOM 0 H MET A 124 8.576 23.169 -0.093 1.00 19.71 H new ATOM 0 HA MET A 124 8.852 20.617 -1.186 1.00 18.41 H new ATOM 0 HB2 MET A 124 6.748 21.350 -0.330 1.00 17.97 H new ATOM 0 HB3 MET A 124 6.744 22.789 -1.330 1.00 17.97 H new ATOM 0 HG2 MET A 124 6.877 20.353 -2.942 1.00 16.63 H new ATOM 0 HG3 MET A 124 5.485 20.352 -1.877 1.00 16.63 H new ATOM 0 HE1 MET A 124 3.374 23.327 -2.922 1.00 17.07 H new ATOM 0 HE2 MET A 124 3.846 22.188 -1.639 1.00 17.07 H new ATOM 0 HE3 MET A 124 4.727 23.722 -1.835 1.00 17.07 H new ATOM 1907 N ILE A 125 9.045 23.051 -3.379 1.00 18.60 N ATOM 1908 CA ILE A 125 9.406 23.354 -4.757 1.00 18.41 C ATOM 1909 C ILE A 125 10.812 22.859 -5.061 1.00 18.72 C ATOM 1910 O ILE A 125 11.060 22.278 -6.115 1.00 18.18 O ATOM 1911 CB ILE A 125 9.327 24.867 -5.040 1.00 19.25 C ATOM 1912 CG1 ILE A 125 7.891 25.363 -4.848 1.00 19.04 C ATOM 1913 CG2 ILE A 125 9.823 25.173 -6.448 1.00 19.27 C ATOM 1914 CD1 ILE A 125 7.717 26.847 -5.101 1.00 19.95 C ATOM 0 H ILE A 125 8.912 23.870 -2.786 1.00 18.60 H new ATOM 0 HA ILE A 125 8.691 22.841 -5.401 1.00 18.41 H new ATOM 0 HB ILE A 125 9.971 25.392 -4.334 1.00 19.25 H new ATOM 0 HG12 ILE A 125 7.233 24.810 -5.518 1.00 19.04 H new ATOM 0 HG13 ILE A 125 7.572 25.138 -3.830 1.00 19.04 H new ATOM 0 HG21 ILE A 125 9.760 26.246 -6.631 1.00 19.27 H new ATOM 0 HG22 ILE A 125 10.859 24.848 -6.548 1.00 19.27 H new ATOM 0 HG23 ILE A 125 9.205 24.644 -7.174 1.00 19.27 H new ATOM 0 HD11 ILE A 125 6.674 27.123 -4.945 1.00 19.95 H new ATOM 0 HD12 ILE A 125 8.348 27.410 -4.413 1.00 19.95 H new ATOM 0 HD13 ILE A 125 8.004 27.077 -6.127 1.00 19.95 H new ATOM 1926 N ARG A 126 11.725 23.097 -4.127 1.00 19.67 N ATOM 1927 CA ARG A 126 13.110 22.675 -4.285 1.00 20.18 C ATOM 1928 C ARG A 126 13.200 21.169 -4.508 1.00 19.36 C ATOM 1929 O ARG A 126 14.054 20.693 -5.257 1.00 19.42 O ATOM 1930 CB ARG A 126 13.927 23.072 -3.054 1.00 21.37 C ATOM 1931 CG ARG A 126 15.387 22.660 -3.134 1.00 22.05 C ATOM 1932 CD ARG A 126 16.154 23.080 -1.891 1.00 22.88 C ATOM 1933 NE ARG A 126 16.100 24.524 -1.677 1.00 23.53 N ATOM 1934 CZ ARG A 126 16.999 25.200 -0.969 1.00 24.32 C ATOM 1935 NH1 ARG A 126 18.021 24.565 -0.408 1.00 24.55 N ATOM 1936 NH2 ARG A 126 16.879 26.513 -0.822 1.00 24.95 N ATOM 0 H ARG A 126 11.530 23.581 -3.251 1.00 19.67 H new ATOM 0 HA ARG A 126 13.519 23.176 -5.162 1.00 20.18 H new ATOM 0 HB2 ARG A 126 13.870 24.153 -2.923 1.00 21.37 H new ATOM 0 HB3 ARG A 126 13.479 22.620 -2.169 1.00 21.37 H new ATOM 0 HG2 ARG A 126 15.455 21.579 -3.256 1.00 22.05 H new ATOM 0 HG3 ARG A 126 15.845 23.110 -4.015 1.00 22.05 H new ATOM 0 HD2 ARG A 126 15.742 22.569 -1.021 1.00 22.88 H new ATOM 0 HD3 ARG A 126 17.194 22.766 -1.983 1.00 22.88 H new ATOM 0 HE ARG A 126 15.328 25.043 -2.095 1.00 23.53 H new ATOM 0 HH11 ARG A 126 18.118 23.556 -0.520 1.00 24.55 H new ATOM 0 HH12 ARG A 126 18.709 25.086 0.135 1.00 24.55 H new ATOM 0 HH21 ARG A 126 16.096 27.005 -1.253 1.00 24.95 H new ATOM 0 HH22 ARG A 126 17.570 27.031 -0.278 1.00 24.95 H new ATOM 1950 N GLU A 127 12.314 20.425 -3.852 1.00 18.69 N ATOM 1951 CA GLU A 127 12.294 18.972 -3.978 1.00 17.91 C ATOM 1952 C GLU A 127 11.828 18.551 -5.368 1.00 16.85 C ATOM 1953 O GLU A 127 12.403 17.650 -5.981 1.00 16.48 O ATOM 1954 CB GLU A 127 11.380 18.360 -2.916 1.00 17.50 C ATOM 1955 CG GLU A 127 11.866 18.582 -1.493 1.00 18.61 C ATOM 1956 CD GLU A 127 10.990 17.899 -0.462 1.00 18.51 C ATOM 1957 OE1 GLU A 127 11.261 16.725 -0.136 1.00 18.51 O ATOM 1958 OE2 GLU A 127 10.030 18.539 0.018 1.00 18.54 O ATOM 0 H GLU A 127 11.601 20.804 -3.229 1.00 18.69 H new ATOM 0 HA GLU A 127 13.310 18.607 -3.829 1.00 17.91 H new ATOM 0 HB2 GLU A 127 10.381 18.784 -3.020 1.00 17.50 H new ATOM 0 HB3 GLU A 127 11.292 17.289 -3.098 1.00 17.50 H new ATOM 0 HG2 GLU A 127 12.886 18.210 -1.400 1.00 18.61 H new ATOM 0 HG3 GLU A 127 11.896 19.652 -1.287 1.00 18.61 H new ATOM 1965 N ALA A 128 10.783 19.208 -5.861 1.00 16.47 N ATOM 1966 CA ALA A 128 10.237 18.902 -7.178 1.00 15.57 C ATOM 1967 C ALA A 128 11.057 19.558 -8.283 1.00 16.23 C ATOM 1968 O ALA A 128 10.895 19.240 -9.461 1.00 15.78 O ATOM 1969 CB ALA A 128 8.787 19.353 -7.262 1.00 14.84 C ATOM 0 H ALA A 128 10.297 19.957 -5.367 1.00 16.47 H new ATOM 0 HA ALA A 128 10.284 17.822 -7.320 1.00 15.57 H new ATOM 0 HB1 ALA A 128 8.390 19.119 -8.250 1.00 14.84 H new ATOM 0 HB2 ALA A 128 8.200 18.835 -6.503 1.00 14.84 H new ATOM 0 HB3 ALA A 128 8.730 20.428 -7.093 1.00 14.84 H new ATOM 1975 N ASP A 129 11.938 20.473 -7.894 1.00 17.37 N ATOM 1976 CA ASP A 129 12.781 21.174 -8.853 1.00 18.16 C ATOM 1977 C ASP A 129 14.188 20.587 -8.873 1.00 18.88 C ATOM 1978 O ASP A 129 14.975 20.796 -7.949 1.00 19.74 O ATOM 1979 CB ASP A 129 12.834 22.666 -8.516 1.00 19.04 C ATOM 1980 CG ASP A 129 13.751 23.440 -9.439 1.00 19.91 C ATOM 1981 OD1 ASP A 129 13.442 23.525 -10.646 1.00 20.17 O ATOM 1982 OD2 ASP A 129 14.782 23.957 -8.959 1.00 20.40 O ATOM 0 H ASP A 129 12.086 20.746 -6.922 1.00 17.37 H new ATOM 0 HA ASP A 129 12.347 21.050 -9.845 1.00 18.16 H new ATOM 0 HB2 ASP A 129 11.829 23.084 -8.575 1.00 19.04 H new ATOM 0 HB3 ASP A 129 13.171 22.790 -7.487 1.00 19.04 H new ATOM 1987 N PHE A 130 14.493 19.846 -9.933 1.00 18.61 N ATOM 1988 CA PHE A 130 15.802 19.220 -10.085 1.00 19.35 C ATOM 1989 C PHE A 130 16.707 20.055 -10.986 1.00 20.46 C ATOM 1990 O PHE A 130 17.921 20.104 -10.789 1.00 21.43 O ATOM 1991 CB PHE A 130 15.653 17.811 -10.663 1.00 18.69 C ATOM 1992 CG PHE A 130 14.920 16.861 -9.757 1.00 17.66 C ATOM 1993 CD1 PHE A 130 13.534 16.853 -9.711 1.00 17.35 C ATOM 1994 CD2 PHE A 130 15.618 15.974 -8.953 1.00 17.07 C ATOM 1995 CE1 PHE A 130 12.860 15.979 -8.879 1.00 16.46 C ATOM 1996 CE2 PHE A 130 14.949 15.098 -8.120 1.00 16.17 C ATOM 1997 CZ PHE A 130 13.568 15.101 -8.082 1.00 15.86 C ATOM 0 H PHE A 130 13.849 19.664 -10.703 1.00 18.61 H new ATOM 0 HA PHE A 130 16.261 19.157 -9.098 1.00 19.35 H new ATOM 0 HB2 PHE A 130 15.125 17.872 -11.615 1.00 18.69 H new ATOM 0 HB3 PHE A 130 16.643 17.407 -10.873 1.00 18.69 H new ATOM 0 HD1 PHE A 130 12.975 17.537 -10.332 1.00 17.35 H new ATOM 0 HD2 PHE A 130 16.698 15.967 -8.978 1.00 17.07 H new ATOM 0 HE1 PHE A 130 11.780 15.983 -8.852 1.00 16.46 H new ATOM 0 HE2 PHE A 130 15.505 14.411 -7.499 1.00 16.17 H new ATOM 0 HZ PHE A 130 13.043 14.418 -7.430 1.00 15.86 H new ATOM 2007 N ASP A 131 16.107 20.711 -11.976 1.00 20.37 N ATOM 2008 CA ASP A 131 16.859 21.546 -12.908 1.00 21.43 C ATOM 2009 C ASP A 131 17.478 22.739 -12.187 1.00 22.32 C ATOM 2010 O ASP A 131 18.384 23.390 -12.710 1.00 23.37 O ATOM 2011 CB ASP A 131 15.956 22.037 -14.043 1.00 21.16 C ATOM 2012 CG ASP A 131 14.532 21.528 -13.923 1.00 20.32 C ATOM 2013 OD1 ASP A 131 13.787 22.046 -13.063 1.00 20.09 O ATOM 2014 OD2 ASP A 131 14.162 20.613 -14.688 1.00 19.96 O ATOM 0 H ASP A 131 15.103 20.680 -12.153 1.00 20.37 H new ATOM 0 HA ASP A 131 17.659 20.938 -13.331 1.00 21.43 H new ATOM 0 HB2 ASP A 131 15.948 23.127 -14.049 1.00 21.16 H new ATOM 0 HB3 ASP A 131 16.373 21.716 -14.998 1.00 21.16 H new ATOM 2019 N GLY A 132 16.985 23.019 -10.985 1.00 21.94 N ATOM 2020 CA GLY A 132 17.500 24.132 -10.210 1.00 22.81 C ATOM 2021 C GLY A 132 17.311 25.464 -10.909 1.00 23.39 C ATOM 2022 O GLY A 132 18.229 25.965 -11.560 1.00 24.32 O ATOM 0 H GLY A 132 16.236 22.494 -10.533 1.00 21.94 H new ATOM 0 HA2 GLY A 132 16.999 24.159 -9.242 1.00 22.81 H new ATOM 0 HA3 GLY A 132 18.561 23.975 -10.016 1.00 22.81 H new ATOM 2026 N ASP A 133 16.118 26.038 -10.776 1.00 22.90 N ATOM 2027 CA ASP A 133 15.817 27.320 -11.404 1.00 23.47 C ATOM 2028 C ASP A 133 14.761 28.092 -10.616 1.00 23.33 C ATOM 2029 O ASP A 133 14.466 29.247 -10.926 1.00 23.88 O ATOM 2030 CB ASP A 133 15.347 27.104 -12.844 1.00 23.07 C ATOM 2031 CG ASP A 133 14.266 26.048 -12.949 1.00 21.88 C ATOM 2032 OD1 ASP A 133 14.606 24.846 -12.943 1.00 21.33 O ATOM 2033 OD2 ASP A 133 13.077 26.422 -13.039 1.00 21.56 O ATOM 0 H ASP A 133 15.347 25.637 -10.241 1.00 22.90 H new ATOM 0 HA ASP A 133 16.731 27.913 -11.410 1.00 23.47 H new ATOM 0 HB2 ASP A 133 14.971 28.045 -13.245 1.00 23.07 H new ATOM 0 HB3 ASP A 133 16.197 26.812 -13.460 1.00 23.07 H new ATOM 2038 N GLY A 134 14.193 27.449 -9.599 1.00 22.67 N ATOM 2039 CA GLY A 134 13.182 28.097 -8.781 1.00 22.60 C ATOM 2040 C GLY A 134 11.842 28.208 -9.481 1.00 21.81 C ATOM 2041 O GLY A 134 11.007 29.034 -9.108 1.00 21.94 O ATOM 0 H GLY A 134 14.415 26.491 -9.327 1.00 22.67 H new ATOM 0 HA2 GLY A 134 13.057 27.537 -7.854 1.00 22.60 H new ATOM 0 HA3 GLY A 134 13.527 29.094 -8.507 1.00 22.60 H new ATOM 2045 N MET A 135 11.633 27.378 -10.496 1.00 21.09 N ATOM 2046 CA MET A 135 10.383 27.385 -11.250 1.00 20.37 C ATOM 2047 C MET A 135 9.902 25.959 -11.494 1.00 19.18 C ATOM 2048 O MET A 135 10.697 25.019 -11.486 1.00 19.03 O ATOM 2049 CB MET A 135 10.561 28.117 -12.583 1.00 20.92 C ATOM 2050 CG MET A 135 11.256 29.463 -12.450 1.00 22.12 C ATOM 2051 SD MET A 135 11.211 30.425 -13.975 1.00 22.91 S ATOM 2052 CE MET A 135 9.461 30.785 -14.090 1.00 22.22 C ATOM 0 H MET A 135 12.314 26.690 -10.817 1.00 21.09 H new ATOM 0 HA MET A 135 9.632 27.913 -10.662 1.00 20.37 H new ATOM 0 HB2 MET A 135 11.136 27.486 -13.261 1.00 20.92 H new ATOM 0 HB3 MET A 135 9.583 28.266 -13.040 1.00 20.92 H new ATOM 0 HG2 MET A 135 10.783 30.034 -11.651 1.00 22.12 H new ATOM 0 HG3 MET A 135 12.294 29.304 -12.156 1.00 22.12 H new ATOM 0 HE1 MET A 135 9.053 30.325 -14.990 1.00 22.22 H new ATOM 0 HE2 MET A 135 8.949 30.386 -13.215 1.00 22.22 H new ATOM 0 HE3 MET A 135 9.314 31.864 -14.135 1.00 22.22 H new ATOM 2062 N ILE A 136 8.599 25.797 -11.702 1.00 18.41 N ATOM 2063 CA ILE A 136 8.031 24.474 -11.933 1.00 17.25 C ATOM 2064 C ILE A 136 7.452 24.336 -13.335 1.00 16.93 C ATOM 2065 O ILE A 136 6.823 25.255 -13.861 1.00 17.36 O ATOM 2066 CB ILE A 136 6.921 24.143 -10.914 1.00 16.55 C ATOM 2067 CG1 ILE A 136 7.477 24.177 -9.484 1.00 16.94 C ATOM 2068 CG2 ILE A 136 6.304 22.780 -11.218 1.00 15.33 C ATOM 2069 CD1 ILE A 136 8.561 23.151 -9.222 1.00 16.79 C ATOM 0 H ILE A 136 7.921 26.559 -11.715 1.00 18.41 H new ATOM 0 HA ILE A 136 8.857 23.773 -11.815 1.00 17.25 H new ATOM 0 HB ILE A 136 6.140 24.899 -10.997 1.00 16.55 H new ATOM 0 HG12 ILE A 136 7.876 25.171 -9.283 1.00 16.94 H new ATOM 0 HG13 ILE A 136 6.659 24.014 -8.783 1.00 16.94 H new ATOM 0 HG21 ILE A 136 5.523 22.563 -10.489 1.00 15.33 H new ATOM 0 HG22 ILE A 136 5.873 22.791 -12.219 1.00 15.33 H new ATOM 0 HG23 ILE A 136 7.075 22.011 -11.163 1.00 15.33 H new ATOM 0 HD11 ILE A 136 8.903 23.238 -8.191 1.00 16.79 H new ATOM 0 HD12 ILE A 136 8.163 22.150 -9.389 1.00 16.79 H new ATOM 0 HD13 ILE A 136 9.398 23.326 -9.898 1.00 16.79 H new ATOM 2081 N ASN A 137 7.676 23.168 -13.919 1.00 16.28 N ATOM 2082 CA ASN A 137 7.175 22.842 -15.245 1.00 16.03 C ATOM 2083 C ASN A 137 6.169 21.705 -15.129 1.00 14.85 C ATOM 2084 O ASN A 137 6.181 20.984 -14.134 1.00 14.21 O ATOM 2085 CB ASN A 137 8.322 22.439 -16.177 1.00 16.50 C ATOM 2086 CG ASN A 137 9.367 23.529 -16.323 1.00 16.54 C ATOM 2087 OD1 ASN A 137 9.590 24.321 -15.409 1.00 16.44 O ATOM 2088 ND2 ASN A 137 10.019 23.570 -17.479 1.00 16.82 N ATOM 0 H ASN A 137 8.212 22.417 -13.484 1.00 16.28 H new ATOM 0 HA ASN A 137 6.691 23.721 -15.670 1.00 16.03 H new ATOM 0 HB2 ASN A 137 8.796 21.536 -15.794 1.00 16.50 H new ATOM 0 HB3 ASN A 137 7.918 22.195 -17.159 1.00 16.50 H new ATOM 0 HD21 ASN A 137 10.736 24.278 -17.635 1.00 16.82 H new ATOM 0 HD22 ASN A 137 9.802 22.893 -18.211 1.00 16.82 H new ATOM 2095 N TYR A 138 5.285 21.563 -16.112 1.00 14.65 N ATOM 2096 CA TYR A 138 4.281 20.495 -16.090 1.00 13.62 C ATOM 2097 C TYR A 138 4.869 19.177 -15.566 1.00 12.81 C ATOM 2098 O TYR A 138 4.145 18.327 -15.045 1.00 11.86 O ATOM 2099 CB TYR A 138 3.693 20.286 -17.491 1.00 13.81 C ATOM 2100 CG TYR A 138 2.923 18.993 -17.643 1.00 12.91 C ATOM 2101 CD1 TYR A 138 1.739 18.780 -16.947 1.00 12.92 C ATOM 2102 CD2 TYR A 138 3.384 17.983 -18.477 1.00 12.17 C ATOM 2103 CE1 TYR A 138 1.037 17.598 -17.078 1.00 12.20 C ATOM 2104 CE2 TYR A 138 2.687 16.798 -18.613 1.00 11.46 C ATOM 2105 CZ TYR A 138 1.516 16.611 -17.913 1.00 11.46 C ATOM 2106 OH TYR A 138 0.820 15.433 -18.047 1.00 10.87 O ATOM 0 H TYR A 138 5.240 22.169 -16.931 1.00 14.65 H new ATOM 0 HA TYR A 138 3.488 20.804 -15.409 1.00 13.62 H new ATOM 0 HB2 TYR A 138 3.033 21.121 -17.726 1.00 13.81 H new ATOM 0 HB3 TYR A 138 4.502 20.304 -18.221 1.00 13.81 H new ATOM 0 HD1 TYR A 138 1.362 19.552 -16.293 1.00 12.92 H new ATOM 0 HD2 TYR A 138 4.302 18.126 -19.028 1.00 12.17 H new ATOM 0 HE1 TYR A 138 0.119 17.448 -16.530 1.00 12.20 H new ATOM 0 HE2 TYR A 138 3.059 16.022 -19.265 1.00 11.46 H new ATOM 0 HH TYR A 138 -0.090 15.549 -17.702 1.00 10.87 H new ATOM 2116 N GLU A 139 6.187 19.025 -15.682 1.00 13.28 N ATOM 2117 CA GLU A 139 6.861 17.811 -15.228 1.00 12.75 C ATOM 2118 C GLU A 139 7.084 17.845 -13.719 1.00 12.57 C ATOM 2119 O GLU A 139 6.657 16.943 -12.994 1.00 11.70 O ATOM 2120 CB GLU A 139 8.203 17.651 -15.948 1.00 13.59 C ATOM 2121 CG GLU A 139 8.072 17.428 -17.445 1.00 13.94 C ATOM 2122 CD GLU A 139 7.273 16.184 -17.782 1.00 14.48 C ATOM 2123 OE1 GLU A 139 7.871 15.089 -17.833 1.00 14.68 O ATOM 2124 OE2 GLU A 139 6.048 16.306 -17.998 1.00 14.82 O ATOM 0 H GLU A 139 6.808 19.726 -16.086 1.00 13.28 H new ATOM 0 HA GLU A 139 6.223 16.960 -15.465 1.00 12.75 H new ATOM 0 HB2 GLU A 139 8.807 18.542 -15.774 1.00 13.59 H new ATOM 0 HB3 GLU A 139 8.742 16.810 -15.510 1.00 13.59 H new ATOM 0 HG2 GLU A 139 7.593 18.296 -17.897 1.00 13.94 H new ATOM 0 HG3 GLU A 139 9.066 17.347 -17.885 1.00 13.94 H new ATOM 2131 N GLU A 140 7.751 18.896 -13.253 1.00 13.49 N ATOM 2132 CA GLU A 140 8.034 19.061 -11.832 1.00 13.65 C ATOM 2133 C GLU A 140 6.738 19.152 -11.031 1.00 13.01 C ATOM 2134 O GLU A 140 6.666 18.696 -9.889 1.00 12.80 O ATOM 2135 CB GLU A 140 8.878 20.317 -11.611 1.00 14.90 C ATOM 2136 CG GLU A 140 10.155 20.344 -12.434 1.00 15.69 C ATOM 2137 CD GLU A 140 10.788 21.721 -12.479 1.00 16.90 C ATOM 2138 OE1 GLU A 140 11.324 22.161 -11.442 1.00 17.46 O ATOM 2139 OE2 GLU A 140 10.745 22.359 -13.552 1.00 17.35 O ATOM 0 H GLU A 140 8.107 19.649 -13.842 1.00 13.49 H new ATOM 0 HA GLU A 140 8.591 18.190 -11.486 1.00 13.65 H new ATOM 0 HB2 GLU A 140 8.279 21.195 -11.855 1.00 14.90 H new ATOM 0 HB3 GLU A 140 9.135 20.391 -10.554 1.00 14.90 H new ATOM 0 HG2 GLU A 140 10.868 19.633 -12.016 1.00 15.69 H new ATOM 0 HG3 GLU A 140 9.936 20.015 -13.450 1.00 15.69 H new ATOM 2146 N PHE A 141 5.716 19.743 -11.644 1.00 12.87 N ATOM 2147 CA PHE A 141 4.419 19.894 -10.998 1.00 12.46 C ATOM 2148 C PHE A 141 3.771 18.532 -10.796 1.00 11.27 C ATOM 2149 O PHE A 141 3.427 18.157 -9.677 1.00 11.00 O ATOM 2150 CB PHE A 141 3.506 20.788 -11.848 1.00 12.80 C ATOM 2151 CG PHE A 141 2.113 20.926 -11.301 1.00 12.57 C ATOM 2152 CD1 PHE A 141 1.822 21.886 -10.348 1.00 12.93 C ATOM 2153 CD2 PHE A 141 1.097 20.091 -11.736 1.00 12.17 C ATOM 2154 CE1 PHE A 141 0.547 22.011 -9.836 1.00 12.93 C ATOM 2155 CE2 PHE A 141 -0.181 20.212 -11.230 1.00 12.17 C ATOM 2156 CZ PHE A 141 -0.457 21.173 -10.277 1.00 12.56 C ATOM 0 H PHE A 141 5.763 20.125 -12.589 1.00 12.87 H new ATOM 0 HA PHE A 141 4.566 20.362 -10.025 1.00 12.46 H new ATOM 0 HB2 PHE A 141 3.955 21.778 -11.928 1.00 12.80 H new ATOM 0 HB3 PHE A 141 3.451 20.380 -12.857 1.00 12.80 H new ATOM 0 HD1 PHE A 141 2.603 22.546 -10.000 1.00 12.93 H new ATOM 0 HD2 PHE A 141 1.308 19.337 -12.480 1.00 12.17 H new ATOM 0 HE1 PHE A 141 0.335 22.764 -9.091 1.00 12.93 H new ATOM 0 HE2 PHE A 141 -0.965 19.556 -11.579 1.00 12.17 H new ATOM 0 HZ PHE A 141 -1.456 21.268 -9.878 1.00 12.56 H new ATOM 2166 N VAL A 142 3.622 17.800 -11.894 1.00 10.70 N ATOM 2167 CA VAL A 142 3.023 16.471 -11.874 1.00 9.58 C ATOM 2168 C VAL A 142 3.575 15.607 -10.739 1.00 9.23 C ATOM 2169 O VAL A 142 2.816 14.938 -10.038 1.00 8.50 O ATOM 2170 CB VAL A 142 3.247 15.751 -13.222 1.00 9.36 C ATOM 2171 CG1 VAL A 142 3.257 14.238 -13.050 1.00 8.32 C ATOM 2172 CG2 VAL A 142 2.185 16.167 -14.225 1.00 9.69 C ATOM 0 H VAL A 142 3.912 18.110 -12.821 1.00 10.70 H new ATOM 0 HA VAL A 142 1.955 16.610 -11.706 1.00 9.58 H new ATOM 0 HB VAL A 142 4.225 16.047 -13.602 1.00 9.36 H new ATOM 0 HG11 VAL A 142 3.417 13.763 -14.018 1.00 8.32 H new ATOM 0 HG12 VAL A 142 4.060 13.954 -12.370 1.00 8.32 H new ATOM 0 HG13 VAL A 142 2.301 13.912 -12.639 1.00 8.32 H new ATOM 0 HG21 VAL A 142 2.356 15.652 -15.170 1.00 9.69 H new ATOM 0 HG22 VAL A 142 1.199 15.904 -13.841 1.00 9.69 H new ATOM 0 HG23 VAL A 142 2.237 17.244 -14.384 1.00 9.69 H new ATOM 2182 N TRP A 143 4.892 15.624 -10.561 1.00 9.94 N ATOM 2183 CA TRP A 143 5.522 14.813 -9.524 1.00 9.97 C ATOM 2184 C TRP A 143 5.116 15.248 -8.116 1.00 10.29 C ATOM 2185 O TRP A 143 4.622 14.438 -7.332 1.00 9.82 O ATOM 2186 CB TRP A 143 7.047 14.856 -9.644 1.00 10.95 C ATOM 2187 CG TRP A 143 7.727 13.930 -8.684 1.00 11.20 C ATOM 2188 CD1 TRP A 143 8.129 12.645 -8.908 1.00 10.93 C ATOM 2189 CD2 TRP A 143 8.063 14.226 -7.333 1.00 11.97 C ATOM 2190 NE1 TRP A 143 8.696 12.126 -7.766 1.00 11.51 N ATOM 2191 CE2 TRP A 143 8.666 13.082 -6.784 1.00 12.15 C ATOM 2192 CE3 TRP A 143 7.910 15.356 -6.541 1.00 12.67 C ATOM 2193 CZ2 TRP A 143 9.113 13.040 -5.466 1.00 13.01 C ATOM 2194 CZ3 TRP A 143 8.348 15.320 -5.234 1.00 13.49 C ATOM 2195 CH2 TRP A 143 8.946 14.167 -4.706 1.00 13.66 C ATOM 0 H TRP A 143 5.539 16.185 -11.115 1.00 9.94 H new ATOM 0 HA TRP A 143 5.170 13.793 -9.679 1.00 9.97 H new ATOM 0 HB2 TRP A 143 7.335 14.593 -10.662 1.00 10.95 H new ATOM 0 HB3 TRP A 143 7.393 15.874 -9.467 1.00 10.95 H new ATOM 0 HD1 TRP A 143 8.019 12.114 -9.842 1.00 10.93 H new ATOM 0 HE1 TRP A 143 9.076 11.185 -7.667 1.00 11.51 H new ATOM 0 HE3 TRP A 143 7.455 16.249 -6.942 1.00 12.67 H new ATOM 0 HZ2 TRP A 143 9.574 12.152 -5.058 1.00 13.01 H new ATOM 0 HZ3 TRP A 143 8.229 16.192 -4.608 1.00 13.49 H new ATOM 0 HH2 TRP A 143 9.282 14.168 -3.679 1.00 13.66 H new ATOM 2206 N MET A 144 5.325 16.523 -7.794 1.00 11.22 N ATOM 2207 CA MET A 144 5.007 17.027 -6.459 1.00 11.83 C ATOM 2208 C MET A 144 3.528 16.868 -6.123 1.00 11.29 C ATOM 2209 O MET A 144 3.179 16.582 -4.978 1.00 11.65 O ATOM 2210 CB MET A 144 5.443 18.486 -6.304 1.00 13.01 C ATOM 2211 CG MET A 144 4.658 19.468 -7.151 1.00 13.05 C ATOM 2212 SD MET A 144 4.964 21.182 -6.674 1.00 14.50 S ATOM 2213 CE MET A 144 4.158 22.073 -8.004 1.00 14.50 C ATOM 0 H MET A 144 5.709 17.220 -8.432 1.00 11.22 H new ATOM 0 HA MET A 144 5.569 16.421 -5.748 1.00 11.83 H new ATOM 0 HB2 MET A 144 5.348 18.771 -5.256 1.00 13.01 H new ATOM 0 HB3 MET A 144 6.499 18.566 -6.561 1.00 13.01 H new ATOM 0 HG2 MET A 144 4.923 19.332 -8.200 1.00 13.05 H new ATOM 0 HG3 MET A 144 3.593 19.253 -7.060 1.00 13.05 H new ATOM 0 HE1 MET A 144 4.907 22.595 -8.599 1.00 14.50 H new ATOM 0 HE2 MET A 144 3.618 21.370 -8.638 1.00 14.50 H new ATOM 0 HE3 MET A 144 3.458 22.796 -7.586 1.00 14.50 H new ATOM 2223 N ILE A 145 2.659 17.051 -7.111 1.00 10.61 N ATOM 2224 CA ILE A 145 1.228 16.915 -6.880 1.00 10.28 C ATOM 2225 C ILE A 145 0.801 15.452 -6.893 1.00 9.33 C ATOM 2226 O ILE A 145 -0.295 15.113 -6.446 1.00 9.45 O ATOM 2227 CB ILE A 145 0.395 17.696 -7.907 1.00 10.17 C ATOM 2228 CG1 ILE A 145 0.623 17.148 -9.315 1.00 9.32 C ATOM 2229 CG2 ILE A 145 0.740 19.173 -7.841 1.00 11.25 C ATOM 2230 CD1 ILE A 145 -0.638 17.092 -10.143 1.00 9.30 C ATOM 0 H ILE A 145 2.917 17.291 -8.068 1.00 10.61 H new ATOM 0 HA ILE A 145 1.039 17.338 -5.893 1.00 10.28 H new ATOM 0 HB ILE A 145 -0.661 17.575 -7.666 1.00 10.17 H new ATOM 0 HG12 ILE A 145 1.358 17.771 -9.826 1.00 9.32 H new ATOM 0 HG13 ILE A 145 1.048 16.147 -9.244 1.00 9.32 H new ATOM 0 HG21 ILE A 145 0.144 19.719 -8.573 1.00 11.25 H new ATOM 0 HG22 ILE A 145 0.525 19.553 -6.842 1.00 11.25 H new ATOM 0 HG23 ILE A 145 1.799 19.309 -8.061 1.00 11.25 H new ATOM 0 HD11 ILE A 145 -0.407 16.694 -11.131 1.00 9.30 H new ATOM 0 HD12 ILE A 145 -1.367 16.446 -9.653 1.00 9.30 H new ATOM 0 HD13 ILE A 145 -1.052 18.095 -10.244 1.00 9.30 H new ATOM 2242 N SER A 146 1.670 14.587 -7.409 1.00 8.54 N ATOM 2243 CA SER A 146 1.374 13.163 -7.466 1.00 7.66 C ATOM 2244 C SER A 146 1.380 12.590 -6.059 1.00 8.22 C ATOM 2245 O SER A 146 0.561 11.739 -5.712 1.00 7.89 O ATOM 2246 CB SER A 146 2.397 12.433 -8.339 1.00 6.98 C ATOM 2247 OG SER A 146 2.137 11.041 -8.376 1.00 6.80 O ATOM 0 H SER A 146 2.579 14.847 -7.791 1.00 8.54 H new ATOM 0 HA SER A 146 0.388 13.023 -7.910 1.00 7.66 H new ATOM 0 HB2 SER A 146 2.371 12.838 -9.351 1.00 6.98 H new ATOM 0 HB3 SER A 146 3.401 12.608 -7.952 1.00 6.98 H new ATOM 0 HG SER A 146 2.804 10.599 -8.941 1.00 6.80 H new ATOM 2253 N GLN A 147 2.320 13.070 -5.255 1.00 9.26 N ATOM 2254 CA GLN A 147 2.445 12.643 -3.875 1.00 10.11 C ATOM 2255 C GLN A 147 1.549 13.495 -2.984 1.00 11.05 C ATOM 2256 O GLN A 147 1.190 13.098 -1.875 1.00 11.87 O ATOM 2257 CB GLN A 147 3.899 12.768 -3.437 1.00 10.77 C ATOM 2258 CG GLN A 147 4.886 12.327 -4.505 1.00 10.15 C ATOM 2259 CD GLN A 147 4.704 10.875 -4.913 1.00 9.47 C ATOM 2260 OE1 GLN A 147 5.315 9.978 -4.332 1.00 10.00 O ATOM 2261 NE2 GLN A 147 3.862 10.631 -5.916 1.00 8.44 N ATOM 0 H GLN A 147 3.012 13.762 -5.543 1.00 9.26 H new ATOM 0 HA GLN A 147 2.133 11.602 -3.786 1.00 10.11 H new ATOM 0 HB2 GLN A 147 4.103 13.805 -3.169 1.00 10.77 H new ATOM 0 HB3 GLN A 147 4.054 12.170 -2.539 1.00 10.77 H new ATOM 0 HG2 GLN A 147 4.772 12.963 -5.383 1.00 10.15 H new ATOM 0 HG3 GLN A 147 5.902 12.471 -4.136 1.00 10.15 H new ATOM 0 HE21 GLN A 147 3.375 11.402 -6.372 1.00 8.44 H new ATOM 0 HE22 GLN A 147 3.705 9.673 -6.228 1.00 8.44 H new ATOM 2270 N LYS A 148 1.195 14.674 -3.491 1.00 11.08 N ATOM 2271 CA LYS A 148 0.336 15.611 -2.775 1.00 12.08 C ATOM 2272 C LYS A 148 -0.978 14.950 -2.366 1.00 12.24 C ATOM 2273 O LYS A 148 -1.074 14.492 -1.209 1.00 12.44 O ATOM 2274 CB LYS A 148 0.061 16.832 -3.659 1.00 12.12 C ATOM 2275 CG LYS A 148 -0.853 17.872 -3.028 1.00 12.94 C ATOM 2276 CD LYS A 148 -1.200 18.978 -4.018 1.00 13.10 C ATOM 2277 CE LYS A 148 -2.102 18.472 -5.133 1.00 13.06 C ATOM 2278 NZ LYS A 148 -3.395 17.951 -4.609 1.00 13.68 N ATOM 2279 OXT LYS A 148 -1.898 14.893 -3.209 1.00 12.34 O ATOM 0 H LYS A 148 1.495 15.005 -4.408 1.00 11.08 H new ATOM 0 HA LYS A 148 0.849 15.927 -1.867 1.00 12.08 H new ATOM 0 HB2 LYS A 148 1.010 17.305 -3.910 1.00 12.12 H new ATOM 0 HB3 LYS A 148 -0.384 16.495 -4.595 1.00 12.12 H new ATOM 0 HG2 LYS A 148 -1.768 17.392 -2.680 1.00 12.94 H new ATOM 0 HG3 LYS A 148 -0.367 18.304 -2.153 1.00 12.94 H new ATOM 0 HD2 LYS A 148 -1.694 19.795 -3.492 1.00 13.10 H new ATOM 0 HD3 LYS A 148 -0.284 19.383 -4.447 1.00 13.10 H new ATOM 0 HE2 LYS A 148 -2.296 19.280 -5.838 1.00 13.06 H new ATOM 0 HE3 LYS A 148 -1.590 17.684 -5.685 1.00 13.06 H new ATOM 0 HZ1 LYS A 148 -4.179 18.337 -5.173 1.00 13.68 H new ATOM 0 HZ2 LYS A 148 -3.402 16.913 -4.672 1.00 13.68 H new ATOM 0 HZ3 LYS A 148 -3.508 18.239 -3.616 1.00 13.68 H new