USER MOD reduce.3.24.130724 H: found=0, std=0, add=739, rem=0, adj=34 USER MOD reduce.3.24.130724 removed 740 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 213 THR OG1 : rot 9:sc= 0.306 USER MOD Set 1.2: A 286 CYS SG : rot 110:sc= -3.86! USER MOD Set 2.1: A 234 THR OG1 : rot 180:sc= 0.107 USER MOD Set 2.2: A 270 THR OG1 : rot -105:sc= 0.083 USER MOD Set 3.1: A 226 SER OG : rot -100:sc= 0.505 USER MOD Set 3.2: A 229 HIS :FLIP no HD1:sc= 0.419 F(o=-0.33,f=0.92) USER MOD Set 4.1: A 218 LYS NZ :NH3+ -174:sc= 1.21 (180deg=0.86) USER MOD Set 4.2: A 293 CYS SG : rot 18:sc= -5.89! USER MOD Single : A 210 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 211 LYS NZ :NH3+ -124:sc= -0.848! (180deg=-4.04!) USER MOD Single : A 212 SER OG : rot -1:sc= 1.04 USER MOD Single : A 216 GLN :FLIP amide:sc= -0.0279 F(o=-2!,f=-0.028) USER MOD Single : A 217 LYS NZ :NH3+ 178:sc= 0 (180deg=-0.0042) USER MOD Single : A 223 TYR OH : rot 180:sc= -1.17! USER MOD Single : A 224 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 227 LYS NZ :NH3+ 150:sc= 1.12 (180deg=-1.08) USER MOD Single : A 230 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 240 HIS :FLIP no HE2:sc= -0.234 F(o=-2.5,f=-0.23) USER MOD Single : A 245 LYS NZ :NH3+ 169:sc= 0 (180deg=-0.0962) USER MOD Single : A 248 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 249 ASN :FLIP amide:sc= -1.25 F(o=-2.9!,f=-1.2) USER MOD Single : A 251 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 254 GLN : amide:sc= -0.2 K(o=-0.2,f=-0.79) USER MOD Single : A 255 MET CE :methyl 165:sc= -0.445 (180deg=-1.35) USER MOD Single : A 256 SER OG : rot 180:sc= 0.407 USER MOD Single : A 258 SER OG : rot 180:sc= 0.138 USER MOD Single : A 259 LYS NZ :NH3+ 168:sc=-0.00635 (180deg=-0.123) USER MOD Single : A 260 TYR OH : rot 180:sc= 0 USER MOD Single : A 264 SER OG : rot 180:sc= 0.48 USER MOD Single : A 268 LYS NZ :NH3+ 163:sc= -0.0333 (180deg=-0.303) USER MOD Single : A 272 THR OG1 : rot 180:sc= 0 USER MOD Single : A 274 SER OG : rot 180:sc= -0.259 USER MOD Single : A 275 GLN :FLIP amide:sc=-0.000735 F(o=-1.6!,f=-0.00074) USER MOD Single : A 276 CYS SG : rot -72:sc= -0.665 USER MOD Single : A 277 SER OG : rot 180:sc= 0.0517 USER MOD Single : A 284 TYR OH : rot 141:sc= -0.834 USER MOD Single : A 285 GLN :FLIP amide:sc= -7.09! C(o=-13!,f=-7.1!) USER MOD Single : A 292 LYS NZ :NH3+ -159:sc= -0.155 (180deg=-0.67) USER MOD Single : A 294 SER OG : rot -160:sc= 0.825 USER MOD Single : A 295 THR OG1 : rot -152:sc= -1.97! USER MOD Single : A 300 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD ----------------------------------------------------------------- ATOM 1 N ASP A 208 2.267 -14.575 -1.769 1.00 3.09 N ATOM 2 CA ASP A 208 2.907 -14.858 -0.460 1.00 2.68 C ATOM 3 C ASP A 208 4.275 -14.206 -0.405 1.00 1.97 C ATOM 4 O ASP A 208 5.290 -14.878 -0.224 1.00 2.14 O ATOM 5 CB ASP A 208 3.045 -16.374 -0.280 1.00 3.41 C ATOM 6 CG ASP A 208 1.713 -17.098 -0.302 1.00 4.18 C ATOM 7 OD1 ASP A 208 0.983 -16.985 -1.308 1.00 4.71 O ATOM 8 OD2 ASP A 208 1.396 -17.808 0.678 1.00 4.43 O ATOM 0 HA ASP A 208 2.290 -14.453 0.342 1.00 2.68 H new ATOM 0 HB2 ASP A 208 3.681 -16.772 -1.071 1.00 3.41 H new ATOM 0 HB3 ASP A 208 3.547 -16.578 0.666 1.00 3.41 H new ATOM 13 N GLU A 209 4.310 -12.913 -0.680 1.00 1.38 N ATOM 14 CA GLU A 209 5.564 -12.188 -0.773 1.00 0.90 C ATOM 15 C GLU A 209 6.162 -11.920 0.605 1.00 0.92 C ATOM 16 O GLU A 209 5.494 -11.401 1.501 1.00 1.33 O ATOM 17 CB GLU A 209 5.352 -10.881 -1.528 1.00 1.00 C ATOM 18 CG GLU A 209 4.850 -11.066 -2.957 1.00 0.81 C ATOM 19 CD GLU A 209 5.814 -11.861 -3.815 1.00 1.10 C ATOM 20 OE1 GLU A 209 6.076 -13.036 -3.493 1.00 1.52 O ATOM 21 OE2 GLU A 209 6.328 -11.309 -4.807 1.00 1.51 O ATOM 0 H GLU A 209 3.480 -12.343 -0.843 1.00 1.38 H new ATOM 0 HA GLU A 209 6.274 -12.808 -1.321 1.00 0.90 H new ATOM 0 HB2 GLU A 209 4.637 -10.268 -0.979 1.00 1.00 H new ATOM 0 HB3 GLU A 209 6.292 -10.330 -1.552 1.00 1.00 H new ATOM 0 HG2 GLU A 209 3.885 -11.573 -2.936 1.00 0.81 H new ATOM 0 HG3 GLU A 209 4.687 -10.088 -3.410 1.00 0.81 H new ATOM 28 N LYS A 210 7.430 -12.262 0.744 1.00 1.02 N ATOM 29 CA LYS A 210 8.161 -12.081 1.985 1.00 1.23 C ATOM 30 C LYS A 210 8.613 -10.634 2.144 1.00 1.22 C ATOM 31 O LYS A 210 8.821 -9.921 1.159 1.00 1.70 O ATOM 32 CB LYS A 210 9.373 -13.015 2.008 1.00 1.64 C ATOM 33 CG LYS A 210 10.173 -12.966 3.299 1.00 2.30 C ATOM 34 CD LYS A 210 11.462 -13.765 3.188 1.00 2.91 C ATOM 35 CE LYS A 210 11.190 -15.233 2.904 1.00 3.69 C ATOM 36 NZ LYS A 210 12.451 -16.006 2.757 1.00 4.13 N ATOM 0 H LYS A 210 7.985 -12.676 -0.005 1.00 1.02 H new ATOM 0 HA LYS A 210 7.500 -12.323 2.817 1.00 1.23 H new ATOM 0 HB2 LYS A 210 9.033 -14.037 1.843 1.00 1.64 H new ATOM 0 HB3 LYS A 210 10.030 -12.760 1.177 1.00 1.64 H new ATOM 0 HG2 LYS A 210 10.406 -11.930 3.544 1.00 2.30 H new ATOM 0 HG3 LYS A 210 9.570 -13.359 4.117 1.00 2.30 H new ATOM 0 HD2 LYS A 210 12.081 -13.349 2.393 1.00 2.91 H new ATOM 0 HD3 LYS A 210 12.029 -13.672 4.115 1.00 2.91 H new ATOM 0 HE2 LYS A 210 10.596 -15.656 3.714 1.00 3.69 H new ATOM 0 HE3 LYS A 210 10.599 -15.324 1.993 1.00 3.69 H new ATOM 0 HZ1 LYS A 210 12.227 -17.003 2.564 1.00 4.13 H new ATOM 0 HZ2 LYS A 210 13.007 -15.617 1.968 1.00 4.13 H new ATOM 0 HZ3 LYS A 210 13.003 -15.939 3.636 1.00 4.13 H new ATOM 50 N LYS A 211 8.696 -10.190 3.387 1.00 0.88 N ATOM 51 CA LYS A 211 9.072 -8.822 3.686 1.00 0.88 C ATOM 52 C LYS A 211 10.497 -8.498 3.274 1.00 0.95 C ATOM 53 O LYS A 211 11.462 -9.057 3.796 1.00 1.30 O ATOM 54 CB LYS A 211 8.888 -8.518 5.164 1.00 1.13 C ATOM 55 CG LYS A 211 7.523 -7.951 5.471 1.00 1.10 C ATOM 56 CD LYS A 211 7.592 -6.838 6.515 1.00 0.94 C ATOM 57 CE LYS A 211 8.568 -5.726 6.117 1.00 0.58 C ATOM 58 NZ LYS A 211 9.950 -5.982 6.608 1.00 1.33 N ATOM 0 H LYS A 211 8.506 -10.763 4.209 1.00 0.88 H new ATOM 0 HA LYS A 211 8.407 -8.191 3.097 1.00 0.88 H new ATOM 0 HB2 LYS A 211 9.037 -9.431 5.741 1.00 1.13 H new ATOM 0 HB3 LYS A 211 9.653 -7.810 5.484 1.00 1.13 H new ATOM 0 HG2 LYS A 211 7.076 -7.563 4.555 1.00 1.10 H new ATOM 0 HG3 LYS A 211 6.871 -8.747 5.831 1.00 1.10 H new ATOM 0 HD2 LYS A 211 6.598 -6.413 6.656 1.00 0.94 H new ATOM 0 HD3 LYS A 211 7.897 -7.260 7.473 1.00 0.94 H new ATOM 0 HE2 LYS A 211 8.583 -5.631 5.031 1.00 0.58 H new ATOM 0 HE3 LYS A 211 8.214 -4.775 6.516 1.00 0.58 H new ATOM 0 HZ1 LYS A 211 10.269 -5.176 7.183 1.00 1.33 H new ATOM 0 HZ2 LYS A 211 9.958 -6.845 7.188 1.00 1.33 H new ATOM 0 HZ3 LYS A 211 10.590 -6.104 5.797 1.00 1.33 H new ATOM 72 N SER A 212 10.587 -7.483 2.439 1.00 1.04 N ATOM 73 CA SER A 212 11.830 -6.887 1.982 1.00 1.39 C ATOM 74 C SER A 212 11.432 -5.629 1.227 1.00 1.11 C ATOM 75 O SER A 212 10.806 -4.747 1.812 1.00 1.73 O ATOM 76 CB SER A 212 12.624 -7.846 1.076 1.00 1.91 C ATOM 77 OG SER A 212 13.100 -8.973 1.792 1.00 2.46 O ATOM 0 H SER A 212 9.763 -7.031 2.043 1.00 1.04 H new ATOM 0 HA SER A 212 12.487 -6.663 2.822 1.00 1.39 H new ATOM 0 HB2 SER A 212 11.990 -8.179 0.254 1.00 1.91 H new ATOM 0 HB3 SER A 212 13.466 -7.314 0.633 1.00 1.91 H new ATOM 0 HG SER A 212 12.837 -8.898 2.733 1.00 2.46 H new ATOM 83 N THR A 213 11.491 -5.719 -0.100 1.00 0.75 N ATOM 84 CA THR A 213 10.813 -4.777 -1.001 1.00 0.42 C ATOM 85 C THR A 213 11.102 -3.313 -0.708 1.00 0.62 C ATOM 86 O THR A 213 10.410 -2.427 -1.193 1.00 1.59 O ATOM 87 CB THR A 213 9.284 -5.035 -0.968 1.00 0.48 C ATOM 88 OG1 THR A 213 8.736 -4.777 0.332 1.00 1.20 O ATOM 89 CG2 THR A 213 9.011 -6.480 -1.322 1.00 0.93 C ATOM 0 H THR A 213 12.011 -6.449 -0.587 1.00 0.75 H new ATOM 0 HA THR A 213 11.215 -4.964 -1.997 1.00 0.42 H new ATOM 0 HB THR A 213 8.817 -4.362 -1.687 1.00 0.48 H new ATOM 0 HG1 THR A 213 9.418 -4.359 0.898 1.00 1.20 H new ATOM 0 HG21 THR A 213 7.937 -6.663 -1.299 1.00 0.93 H new ATOM 0 HG22 THR A 213 9.394 -6.688 -2.321 1.00 0.93 H new ATOM 0 HG23 THR A 213 9.505 -7.131 -0.601 1.00 0.93 H new ATOM 97 N ALA A 214 12.162 -3.083 0.034 1.00 0.50 N ATOM 98 CA ALA A 214 12.569 -1.748 0.460 1.00 0.39 C ATOM 99 C ALA A 214 11.506 -1.085 1.333 1.00 0.25 C ATOM 100 O ALA A 214 11.589 0.110 1.621 1.00 0.27 O ATOM 101 CB ALA A 214 12.903 -0.862 -0.719 1.00 0.48 C ATOM 0 H ALA A 214 12.779 -3.824 0.367 1.00 0.50 H new ATOM 0 HA ALA A 214 13.471 -1.874 1.058 1.00 0.39 H new ATOM 0 HB1 ALA A 214 13.201 0.123 -0.361 1.00 0.48 H new ATOM 0 HB2 ALA A 214 13.721 -1.305 -1.287 1.00 0.48 H new ATOM 0 HB3 ALA A 214 12.027 -0.765 -1.361 1.00 0.48 H new ATOM 107 N PHE A 215 10.656 -1.899 1.931 1.00 0.25 N ATOM 108 CA PHE A 215 9.796 -1.433 2.987 1.00 0.18 C ATOM 109 C PHE A 215 10.313 -2.043 4.266 1.00 0.21 C ATOM 110 O PHE A 215 10.100 -3.227 4.530 1.00 0.28 O ATOM 111 CB PHE A 215 8.328 -1.835 2.762 1.00 0.20 C ATOM 112 CG PHE A 215 7.727 -1.305 1.482 1.00 0.23 C ATOM 113 CD1 PHE A 215 8.105 -1.816 0.256 1.00 0.41 C ATOM 114 CD2 PHE A 215 6.780 -0.304 1.508 1.00 0.26 C ATOM 115 CE1 PHE A 215 7.550 -1.343 -0.916 1.00 0.46 C ATOM 116 CE2 PHE A 215 6.220 0.175 0.341 1.00 0.31 C ATOM 117 CZ PHE A 215 6.637 -0.309 -0.875 1.00 0.35 C ATOM 0 H PHE A 215 10.547 -2.886 1.699 1.00 0.25 H new ATOM 0 HA PHE A 215 9.811 -0.344 3.022 1.00 0.18 H new ATOM 0 HB2 PHE A 215 8.258 -2.923 2.759 1.00 0.20 H new ATOM 0 HB3 PHE A 215 7.733 -1.479 3.603 1.00 0.20 H new ATOM 0 HD1 PHE A 215 8.848 -2.599 0.213 1.00 0.41 H new ATOM 0 HD2 PHE A 215 6.471 0.112 2.456 1.00 0.26 H new ATOM 0 HE1 PHE A 215 7.830 -1.781 -1.863 1.00 0.46 H new ATOM 0 HE2 PHE A 215 5.452 0.933 0.384 1.00 0.31 H new ATOM 0 HZ PHE A 215 6.254 0.116 -1.791 1.00 0.35 H new ATOM 127 N GLN A 216 11.036 -1.230 5.016 1.00 0.18 N ATOM 128 CA GLN A 216 11.638 -1.634 6.272 1.00 0.21 C ATOM 129 C GLN A 216 10.610 -2.355 7.114 1.00 0.24 C ATOM 130 O GLN A 216 10.800 -3.504 7.505 1.00 0.31 O ATOM 131 CB GLN A 216 12.125 -0.394 7.000 1.00 0.20 C ATOM 132 CG GLN A 216 13.534 -0.529 7.551 1.00 0.25 C ATOM 133 CD GLN A 216 14.005 0.692 8.319 1.00 0.30 C ATOM 134 OE1 GLN A 216 13.220 1.755 8.298 1.00 0.92 O flip ATOM 135 NE2 GLN A 216 15.081 0.682 8.915 1.00 0.79 N flip ATOM 0 H GLN A 216 11.223 -0.259 4.766 1.00 0.18 H new ATOM 0 HA GLN A 216 12.477 -2.304 6.087 1.00 0.21 H new ATOM 0 HB2 GLN A 216 12.090 0.455 6.318 1.00 0.20 H new ATOM 0 HB3 GLN A 216 11.442 -0.172 7.820 1.00 0.20 H new ATOM 0 HG2 GLN A 216 13.577 -1.399 8.206 1.00 0.25 H new ATOM 0 HG3 GLN A 216 14.221 -0.717 6.726 1.00 0.25 H new ATOM 0 HE21 GLN A 216 15.660 -0.158 8.909 1.00 0.79 H new ATOM 0 HE22 GLN A 216 15.394 1.514 9.416 1.00 0.79 H new ATOM 144 N LYS A 217 9.442 -1.749 7.184 1.00 0.20 N ATOM 145 CA LYS A 217 8.289 -2.399 7.739 1.00 0.22 C ATOM 146 C LYS A 217 7.080 -2.182 6.835 1.00 0.17 C ATOM 147 O LYS A 217 6.580 -1.068 6.723 1.00 0.17 O ATOM 148 CB LYS A 217 8.011 -1.848 9.140 1.00 0.28 C ATOM 149 CG LYS A 217 6.681 -2.288 9.715 1.00 0.36 C ATOM 150 CD LYS A 217 6.388 -1.594 11.033 1.00 0.59 C ATOM 151 CE LYS A 217 4.956 -1.840 11.493 1.00 1.26 C ATOM 152 NZ LYS A 217 4.690 -3.279 11.777 1.00 1.85 N ATOM 0 H LYS A 217 9.273 -0.797 6.858 1.00 0.20 H new ATOM 0 HA LYS A 217 8.481 -3.470 7.811 1.00 0.22 H new ATOM 0 HB2 LYS A 217 8.809 -2.166 9.811 1.00 0.28 H new ATOM 0 HB3 LYS A 217 8.039 -0.759 9.104 1.00 0.28 H new ATOM 0 HG2 LYS A 217 5.885 -2.070 9.003 1.00 0.36 H new ATOM 0 HG3 LYS A 217 6.687 -3.368 9.865 1.00 0.36 H new ATOM 0 HD2 LYS A 217 7.081 -1.951 11.794 1.00 0.59 H new ATOM 0 HD3 LYS A 217 6.557 -0.523 10.926 1.00 0.59 H new ATOM 0 HE2 LYS A 217 4.759 -1.253 12.390 1.00 1.26 H new ATOM 0 HE3 LYS A 217 4.266 -1.490 10.726 1.00 1.26 H new ATOM 0 HZ1 LYS A 217 3.714 -3.391 12.119 1.00 1.85 H new ATOM 0 HZ2 LYS A 217 4.818 -3.834 10.907 1.00 1.85 H new ATOM 0 HZ3 LYS A 217 5.352 -3.618 12.504 1.00 1.85 H new ATOM 166 N LYS A 218 6.480 -3.276 6.406 1.00 0.19 N ATOM 167 CA LYS A 218 5.169 -3.227 5.785 1.00 0.20 C ATOM 168 C LYS A 218 4.143 -3.428 6.890 1.00 0.18 C ATOM 169 O LYS A 218 4.390 -4.194 7.825 1.00 0.20 O ATOM 170 CB LYS A 218 5.023 -4.308 4.690 1.00 0.31 C ATOM 171 CG LYS A 218 3.599 -4.479 4.164 1.00 0.39 C ATOM 172 CD LYS A 218 3.324 -5.931 3.810 1.00 0.96 C ATOM 173 CE LYS A 218 3.406 -6.821 5.042 1.00 1.56 C ATOM 174 NZ LYS A 218 3.290 -8.262 4.702 1.00 2.42 N ATOM 0 H LYS A 218 6.880 -4.212 6.476 1.00 0.19 H new ATOM 0 HA LYS A 218 5.020 -2.267 5.290 1.00 0.20 H new ATOM 0 HB2 LYS A 218 5.678 -4.055 3.856 1.00 0.31 H new ATOM 0 HB3 LYS A 218 5.368 -5.262 5.089 1.00 0.31 H new ATOM 0 HG2 LYS A 218 2.886 -4.142 4.917 1.00 0.39 H new ATOM 0 HG3 LYS A 218 3.454 -3.852 3.284 1.00 0.39 H new ATOM 0 HD2 LYS A 218 2.335 -6.018 3.360 1.00 0.96 H new ATOM 0 HD3 LYS A 218 4.044 -6.269 3.065 1.00 0.96 H new ATOM 0 HE2 LYS A 218 4.353 -6.645 5.553 1.00 1.56 H new ATOM 0 HE3 LYS A 218 2.613 -6.549 5.738 1.00 1.56 H new ATOM 0 HZ1 LYS A 218 3.249 -8.823 5.577 1.00 2.42 H new ATOM 0 HZ2 LYS A 218 2.424 -8.419 4.149 1.00 2.42 H new ATOM 0 HZ3 LYS A 218 4.116 -8.554 4.142 1.00 2.42 H new ATOM 188 N LEU A 219 3.057 -2.677 6.843 1.00 0.16 N ATOM 189 CA LEU A 219 2.027 -2.752 7.870 1.00 0.16 C ATOM 190 C LEU A 219 1.437 -4.166 7.933 1.00 0.16 C ATOM 191 O LEU A 219 1.730 -5.000 7.071 1.00 0.17 O ATOM 192 CB LEU A 219 0.929 -1.727 7.596 1.00 0.20 C ATOM 193 CG LEU A 219 -0.065 -1.488 8.735 1.00 0.66 C ATOM 194 CD1 LEU A 219 0.648 -0.927 9.955 1.00 1.20 C ATOM 195 CD2 LEU A 219 -1.172 -0.551 8.279 1.00 1.62 C ATOM 0 H LEU A 219 2.863 -2.004 6.101 1.00 0.16 H new ATOM 0 HA LEU A 219 2.481 -2.524 8.835 1.00 0.16 H new ATOM 0 HB2 LEU A 219 1.401 -0.777 7.347 1.00 0.20 H new ATOM 0 HB3 LEU A 219 0.372 -2.047 6.715 1.00 0.20 H new ATOM 0 HG LEU A 219 -0.514 -2.442 9.013 1.00 0.66 H new ATOM 0 HD11 LEU A 219 -0.074 -0.763 10.755 1.00 1.20 H new ATOM 0 HD12 LEU A 219 1.407 -1.634 10.290 1.00 1.20 H new ATOM 0 HD13 LEU A 219 1.123 0.019 9.696 1.00 1.20 H new ATOM 0 HD21 LEU A 219 -1.872 -0.389 9.098 1.00 1.62 H new ATOM 0 HD22 LEU A 219 -0.740 0.403 7.977 1.00 1.62 H new ATOM 0 HD23 LEU A 219 -1.699 -0.994 7.434 1.00 1.62 H new ATOM 207 N GLU A 220 0.685 -4.447 8.995 1.00 0.17 N ATOM 208 CA GLU A 220 0.107 -5.773 9.219 1.00 0.20 C ATOM 209 C GLU A 220 -0.534 -6.310 7.936 1.00 0.19 C ATOM 210 O GLU A 220 -1.103 -5.547 7.156 1.00 0.19 O ATOM 211 CB GLU A 220 -0.945 -5.700 10.334 1.00 0.23 C ATOM 212 CG GLU A 220 -2.102 -4.760 10.022 1.00 0.24 C ATOM 213 CD GLU A 220 -3.105 -4.664 11.151 1.00 0.75 C ATOM 214 OE1 GLU A 220 -3.616 -5.715 11.589 1.00 1.43 O ATOM 215 OE2 GLU A 220 -3.383 -3.539 11.616 1.00 1.12 O ATOM 0 H GLU A 220 0.459 -3.767 9.721 1.00 0.17 H new ATOM 0 HA GLU A 220 0.906 -6.452 9.517 1.00 0.20 H new ATOM 0 HB2 GLU A 220 -1.339 -6.700 10.516 1.00 0.23 H new ATOM 0 HB3 GLU A 220 -0.463 -5.375 11.256 1.00 0.23 H new ATOM 0 HG2 GLU A 220 -1.708 -3.767 9.807 1.00 0.24 H new ATOM 0 HG3 GLU A 220 -2.609 -5.103 9.120 1.00 0.24 H new ATOM 222 N PRO A 221 -0.339 -7.613 7.649 1.00 0.22 N ATOM 223 CA PRO A 221 -0.775 -8.252 6.388 1.00 0.23 C ATOM 224 C PRO A 221 -2.287 -8.291 6.189 1.00 0.20 C ATOM 225 O PRO A 221 -2.777 -9.115 5.430 1.00 0.19 O ATOM 226 CB PRO A 221 -0.223 -9.678 6.498 1.00 0.29 C ATOM 227 CG PRO A 221 0.867 -9.595 7.506 1.00 0.57 C ATOM 228 CD PRO A 221 0.439 -8.543 8.483 1.00 0.26 C ATOM 0 HA PRO A 221 -0.412 -7.686 5.530 1.00 0.23 H new ATOM 0 HB2 PRO A 221 -0.998 -10.377 6.812 1.00 0.29 H new ATOM 0 HB3 PRO A 221 0.154 -10.030 5.538 1.00 0.29 H new ATOM 0 HG2 PRO A 221 1.014 -10.554 8.003 1.00 0.57 H new ATOM 0 HG3 PRO A 221 1.815 -9.331 7.037 1.00 0.57 H new ATOM 0 HD2 PRO A 221 -0.163 -8.962 9.289 1.00 0.26 H new ATOM 0 HD3 PRO A 221 1.294 -8.051 8.946 1.00 0.26 H new ATOM 236 N ALA A 222 -2.971 -7.266 6.663 1.00 0.20 N ATOM 237 CA ALA A 222 -4.377 -7.076 6.373 1.00 0.19 C ATOM 238 C ALA A 222 -4.761 -5.634 6.639 1.00 0.15 C ATOM 239 O ALA A 222 -5.131 -5.265 7.757 1.00 0.17 O ATOM 240 CB ALA A 222 -5.249 -8.018 7.186 1.00 0.24 C ATOM 0 H ALA A 222 -2.567 -6.544 7.259 1.00 0.20 H new ATOM 0 HA ALA A 222 -4.543 -7.307 5.321 1.00 0.19 H new ATOM 0 HB1 ALA A 222 -6.297 -7.846 6.941 1.00 0.24 H new ATOM 0 HB2 ALA A 222 -4.986 -9.050 6.952 1.00 0.24 H new ATOM 0 HB3 ALA A 222 -5.090 -7.835 8.249 1.00 0.24 H new ATOM 246 N TYR A 223 -4.682 -4.826 5.599 1.00 0.12 N ATOM 247 CA TYR A 223 -5.053 -3.428 5.682 1.00 0.11 C ATOM 248 C TYR A 223 -6.569 -3.317 5.637 1.00 0.13 C ATOM 249 O TYR A 223 -7.216 -3.913 4.771 1.00 0.17 O ATOM 250 CB TYR A 223 -4.445 -2.630 4.521 1.00 0.12 C ATOM 251 CG TYR A 223 -2.936 -2.451 4.562 1.00 0.12 C ATOM 252 CD1 TYR A 223 -2.150 -3.288 5.345 1.00 0.16 C ATOM 253 CD2 TYR A 223 -2.297 -1.442 3.853 1.00 0.18 C ATOM 254 CE1 TYR A 223 -0.777 -3.126 5.420 1.00 0.18 C ATOM 255 CE2 TYR A 223 -0.925 -1.274 3.932 1.00 0.20 C ATOM 256 CZ TYR A 223 -0.168 -2.126 4.561 1.00 0.16 C ATOM 257 OH TYR A 223 1.192 -1.949 4.801 1.00 0.21 O ATOM 0 H TYR A 223 -4.360 -5.119 4.677 1.00 0.12 H new ATOM 0 HA TYR A 223 -4.671 -3.016 6.616 1.00 0.11 H new ATOM 0 HB2 TYR A 223 -4.708 -3.126 3.587 1.00 0.12 H new ATOM 0 HB3 TYR A 223 -4.909 -1.644 4.500 1.00 0.12 H new ATOM 0 HD1 TYR A 223 -2.620 -4.082 5.907 1.00 0.16 H new ATOM 0 HD2 TYR A 223 -2.879 -0.778 3.231 1.00 0.18 H new ATOM 0 HE1 TYR A 223 -0.180 -3.722 6.094 1.00 0.18 H new ATOM 0 HE2 TYR A 223 -0.472 -0.415 3.460 1.00 0.20 H new ATOM 0 HH TYR A 223 1.545 -1.266 4.194 1.00 0.21 H new ATOM 267 N GLN A 224 -7.135 -2.623 6.608 1.00 0.15 N ATOM 268 CA GLN A 224 -8.577 -2.496 6.703 1.00 0.18 C ATOM 269 C GLN A 224 -9.022 -1.101 6.288 1.00 0.17 C ATOM 270 O GLN A 224 -8.965 -0.157 7.080 1.00 0.22 O ATOM 271 CB GLN A 224 -9.037 -2.801 8.128 1.00 0.26 C ATOM 272 CG GLN A 224 -8.709 -4.218 8.574 1.00 0.34 C ATOM 273 CD GLN A 224 -9.049 -4.464 10.028 1.00 0.61 C ATOM 274 OE1 GLN A 224 -8.461 -3.856 10.927 1.00 1.42 O ATOM 275 NE2 GLN A 224 -9.995 -5.355 10.272 1.00 0.99 N ATOM 0 H GLN A 224 -6.618 -2.139 7.342 1.00 0.15 H new ATOM 0 HA GLN A 224 -9.035 -3.215 6.024 1.00 0.18 H new ATOM 0 HB2 GLN A 224 -8.569 -2.094 8.813 1.00 0.26 H new ATOM 0 HB3 GLN A 224 -10.114 -2.646 8.196 1.00 0.26 H new ATOM 0 HG2 GLN A 224 -9.256 -4.926 7.952 1.00 0.34 H new ATOM 0 HG3 GLN A 224 -7.647 -4.408 8.416 1.00 0.34 H new ATOM 0 HE21 GLN A 224 -10.456 -5.835 9.499 1.00 0.99 H new ATOM 0 HE22 GLN A 224 -10.264 -5.563 11.234 1.00 0.99 H new ATOM 284 N VAL A 225 -9.445 -0.971 5.035 1.00 0.16 N ATOM 285 CA VAL A 225 -9.911 0.305 4.525 1.00 0.18 C ATOM 286 C VAL A 225 -11.257 0.652 5.113 1.00 0.24 C ATOM 287 O VAL A 225 -12.189 -0.142 5.065 1.00 0.30 O ATOM 288 CB VAL A 225 -9.987 0.338 2.972 1.00 0.28 C ATOM 289 CG1 VAL A 225 -10.474 -0.978 2.403 1.00 0.77 C ATOM 290 CG2 VAL A 225 -10.857 1.494 2.482 1.00 0.77 C ATOM 0 H VAL A 225 -9.473 -1.734 4.359 1.00 0.16 H new ATOM 0 HA VAL A 225 -9.176 1.050 4.830 1.00 0.18 H new ATOM 0 HB VAL A 225 -8.972 0.499 2.608 1.00 0.28 H new ATOM 0 HG11 VAL A 225 -10.513 -0.912 1.316 1.00 0.77 H new ATOM 0 HG12 VAL A 225 -9.791 -1.776 2.694 1.00 0.77 H new ATOM 0 HG13 VAL A 225 -11.470 -1.195 2.789 1.00 0.77 H new ATOM 0 HG21 VAL A 225 -10.889 1.489 1.392 1.00 0.77 H new ATOM 0 HG22 VAL A 225 -11.867 1.381 2.876 1.00 0.77 H new ATOM 0 HG23 VAL A 225 -10.436 2.438 2.828 1.00 0.77 H new ATOM 300 N SER A 226 -11.399 1.888 5.523 1.00 0.26 N ATOM 301 CA SER A 226 -12.693 2.376 5.907 1.00 0.33 C ATOM 302 C SER A 226 -13.341 2.946 4.660 1.00 0.32 C ATOM 303 O SER A 226 -12.779 3.846 4.036 1.00 0.32 O ATOM 304 CB SER A 226 -12.567 3.425 7.009 1.00 0.42 C ATOM 305 OG SER A 226 -13.731 3.453 7.819 1.00 1.20 O ATOM 0 H SER A 226 -10.641 2.566 5.598 1.00 0.26 H new ATOM 0 HA SER A 226 -13.310 1.575 6.315 1.00 0.33 H new ATOM 0 HB2 SER A 226 -11.695 3.207 7.626 1.00 0.42 H new ATOM 0 HB3 SER A 226 -12.405 4.407 6.565 1.00 0.42 H new ATOM 0 HG SER A 226 -14.301 4.202 7.547 1.00 1.20 H new ATOM 311 N LYS A 227 -14.316 2.212 4.142 1.00 0.34 N ATOM 312 CA LYS A 227 -14.867 2.481 2.817 1.00 0.37 C ATOM 313 C LYS A 227 -15.073 3.964 2.558 1.00 0.42 C ATOM 314 O LYS A 227 -15.773 4.659 3.299 1.00 0.48 O ATOM 315 CB LYS A 227 -16.190 1.732 2.589 1.00 0.44 C ATOM 316 CG LYS A 227 -17.230 2.546 1.814 1.00 0.95 C ATOM 317 CD LYS A 227 -18.529 1.788 1.576 1.00 0.93 C ATOM 318 CE LYS A 227 -19.284 1.528 2.869 1.00 0.96 C ATOM 319 NZ LYS A 227 -19.431 2.754 3.694 1.00 1.54 N ATOM 0 H LYS A 227 -14.745 1.420 4.621 1.00 0.34 H new ATOM 0 HA LYS A 227 -14.123 2.115 2.109 1.00 0.37 H new ATOM 0 HB2 LYS A 227 -15.986 0.809 2.047 1.00 0.44 H new ATOM 0 HB3 LYS A 227 -16.609 1.449 3.555 1.00 0.44 H new ATOM 0 HG2 LYS A 227 -17.447 3.463 2.363 1.00 0.95 H new ATOM 0 HG3 LYS A 227 -16.808 2.842 0.853 1.00 0.95 H new ATOM 0 HD2 LYS A 227 -19.162 2.358 0.896 1.00 0.93 H new ATOM 0 HD3 LYS A 227 -18.310 0.839 1.087 1.00 0.93 H new ATOM 0 HE2 LYS A 227 -20.271 1.129 2.636 1.00 0.96 H new ATOM 0 HE3 LYS A 227 -18.760 0.766 3.446 1.00 0.96 H new ATOM 0 HZ1 LYS A 227 -20.310 2.697 4.248 1.00 1.54 H new ATOM 0 HZ2 LYS A 227 -18.620 2.837 4.340 1.00 1.54 H new ATOM 0 HZ3 LYS A 227 -19.467 3.588 3.073 1.00 1.54 H new ATOM 333 N GLY A 228 -14.472 4.419 1.471 1.00 0.46 N ATOM 334 CA GLY A 228 -14.645 5.797 1.035 1.00 0.57 C ATOM 335 C GLY A 228 -13.898 6.789 1.899 1.00 0.57 C ATOM 336 O GLY A 228 -13.806 7.970 1.570 1.00 0.70 O ATOM 0 H GLY A 228 -13.862 3.858 0.876 1.00 0.46 H new ATOM 0 HA2 GLY A 228 -14.303 5.892 0.004 1.00 0.57 H new ATOM 0 HA3 GLY A 228 -15.707 6.044 1.043 1.00 0.57 H new ATOM 340 N HIS A 229 -13.304 6.295 2.967 1.00 0.47 N ATOM 341 CA HIS A 229 -12.508 7.128 3.856 1.00 0.53 C ATOM 342 C HIS A 229 -11.074 7.156 3.379 1.00 0.54 C ATOM 343 O HIS A 229 -10.217 7.798 3.988 1.00 1.02 O ATOM 344 CB HIS A 229 -12.586 6.610 5.290 1.00 0.55 C ATOM 345 CG HIS A 229 -13.921 6.838 5.929 1.00 1.32 C ATOM 346 ND1 HIS A 229 -14.839 5.965 6.404 1.00 1.94 N flip ATOM 347 CD2 HIS A 229 -14.453 8.092 6.126 1.00 2.31 C flip ATOM 348 CE1 HIS A 229 -15.897 6.698 6.874 1.00 2.66 C flip ATOM 349 NE2 HIS A 229 -15.638 7.981 6.696 1.00 2.89 N flip ATOM 0 H HIS A 229 -13.356 5.315 3.244 1.00 0.47 H new ATOM 0 HA HIS A 229 -12.906 8.143 3.841 1.00 0.53 H new ATOM 0 HB2 HIS A 229 -12.365 5.543 5.296 1.00 0.55 H new ATOM 0 HB3 HIS A 229 -11.816 7.098 5.888 1.00 0.55 H new ATOM 0 HD2 HIS A 229 -13.975 9.022 5.856 1.00 2.31 H new ATOM 0 HE1 HIS A 229 -16.795 6.293 7.317 1.00 2.66 H new ATOM 0 HE2 HIS A 229 -16.250 8.755 6.955 1.00 2.89 H new ATOM 358 N LYS A 230 -10.840 6.428 2.287 1.00 0.30 N ATOM 359 CA LYS A 230 -9.528 6.322 1.659 1.00 0.28 C ATOM 360 C LYS A 230 -8.566 5.560 2.553 1.00 0.24 C ATOM 361 O LYS A 230 -8.158 6.055 3.606 1.00 0.28 O ATOM 362 CB LYS A 230 -8.949 7.709 1.348 1.00 0.36 C ATOM 363 CG LYS A 230 -9.847 8.575 0.477 1.00 1.00 C ATOM 364 CD LYS A 230 -9.252 9.959 0.280 1.00 1.23 C ATOM 365 CE LYS A 230 -10.195 10.866 -0.494 1.00 1.65 C ATOM 366 NZ LYS A 230 -9.610 12.211 -0.718 1.00 2.24 N ATOM 0 H LYS A 230 -11.565 5.891 1.811 1.00 0.30 H new ATOM 0 HA LYS A 230 -9.655 5.778 0.723 1.00 0.28 H new ATOM 0 HB2 LYS A 230 -8.759 8.230 2.286 1.00 0.36 H new ATOM 0 HB3 LYS A 230 -7.987 7.586 0.850 1.00 0.36 H new ATOM 0 HG2 LYS A 230 -9.990 8.096 -0.492 1.00 1.00 H new ATOM 0 HG3 LYS A 230 -10.831 8.662 0.938 1.00 1.00 H new ATOM 0 HD2 LYS A 230 -9.033 10.404 1.251 1.00 1.23 H new ATOM 0 HD3 LYS A 230 -8.305 9.877 -0.254 1.00 1.23 H new ATOM 0 HE2 LYS A 230 -10.432 10.409 -1.455 1.00 1.65 H new ATOM 0 HE3 LYS A 230 -11.133 10.965 0.052 1.00 1.65 H new ATOM 0 HZ1 LYS A 230 -10.284 12.799 -1.249 1.00 2.24 H new ATOM 0 HZ2 LYS A 230 -9.408 12.659 0.199 1.00 2.24 H new ATOM 0 HZ3 LYS A 230 -8.728 12.120 -1.261 1.00 2.24 H new ATOM 380 N ILE A 231 -8.214 4.344 2.163 1.00 0.20 N ATOM 381 CA ILE A 231 -7.293 3.571 2.984 1.00 0.17 C ATOM 382 C ILE A 231 -5.848 3.869 2.603 1.00 0.16 C ATOM 383 O ILE A 231 -5.507 3.967 1.432 1.00 0.17 O ATOM 384 CB ILE A 231 -7.544 2.050 2.913 1.00 0.16 C ATOM 385 CG1 ILE A 231 -6.581 1.331 3.869 1.00 0.17 C ATOM 386 CG2 ILE A 231 -7.357 1.526 1.501 1.00 0.18 C ATOM 387 CD1 ILE A 231 -6.684 -0.173 3.849 1.00 0.19 C ATOM 0 H ILE A 231 -8.538 3.883 1.313 1.00 0.20 H new ATOM 0 HA ILE A 231 -7.476 3.881 4.013 1.00 0.17 H new ATOM 0 HB ILE A 231 -8.575 1.856 3.209 1.00 0.16 H new ATOM 0 HG12 ILE A 231 -5.559 1.616 3.617 1.00 0.17 H new ATOM 0 HG13 ILE A 231 -6.768 1.682 4.884 1.00 0.17 H new ATOM 0 HG21 ILE A 231 -7.541 0.452 1.484 1.00 0.18 H new ATOM 0 HG22 ILE A 231 -8.058 2.025 0.832 1.00 0.18 H new ATOM 0 HG23 ILE A 231 -6.337 1.725 1.171 1.00 0.18 H new ATOM 0 HD11 ILE A 231 -5.968 -0.596 4.554 1.00 0.19 H new ATOM 0 HD12 ILE A 231 -7.693 -0.472 4.133 1.00 0.19 H new ATOM 0 HD13 ILE A 231 -6.465 -0.539 2.846 1.00 0.19 H new ATOM 399 N ARG A 232 -5.022 4.094 3.605 1.00 0.17 N ATOM 400 CA ARG A 232 -3.630 4.439 3.383 1.00 0.17 C ATOM 401 C ARG A 232 -2.736 3.241 3.673 1.00 0.15 C ATOM 402 O ARG A 232 -2.949 2.539 4.663 1.00 0.19 O ATOM 403 CB ARG A 232 -3.238 5.620 4.268 1.00 0.22 C ATOM 404 CG ARG A 232 -3.961 6.918 3.939 1.00 0.34 C ATOM 405 CD ARG A 232 -5.339 6.980 4.577 1.00 0.77 C ATOM 406 NE ARG A 232 -5.271 6.881 6.032 1.00 1.44 N ATOM 407 CZ ARG A 232 -6.336 6.830 6.829 1.00 2.13 C ATOM 408 NH1 ARG A 232 -7.562 6.811 6.315 1.00 2.48 N ATOM 409 NH2 ARG A 232 -6.163 6.774 8.142 1.00 3.14 N ATOM 0 H ARG A 232 -5.292 4.044 4.587 1.00 0.17 H new ATOM 0 HA ARG A 232 -3.499 4.723 2.339 1.00 0.17 H new ATOM 0 HB2 ARG A 232 -3.437 5.361 5.308 1.00 0.22 H new ATOM 0 HB3 ARG A 232 -2.164 5.784 4.180 1.00 0.22 H new ATOM 0 HG2 ARG A 232 -3.364 7.763 4.283 1.00 0.34 H new ATOM 0 HG3 ARG A 232 -4.058 7.015 2.858 1.00 0.34 H new ATOM 0 HD2 ARG A 232 -5.826 7.915 4.299 1.00 0.77 H new ATOM 0 HD3 ARG A 232 -5.956 6.171 4.187 1.00 0.77 H new ATOM 0 HE ARG A 232 -4.348 6.849 6.466 1.00 1.44 H new ATOM 0 HH11 ARG A 232 -7.691 6.836 5.304 1.00 2.48 H new ATOM 0 HH12 ARG A 232 -8.373 6.772 6.932 1.00 2.48 H new ATOM 0 HH21 ARG A 232 -5.221 6.770 8.533 1.00 3.14 H new ATOM 0 HH22 ARG A 232 -6.972 6.735 8.762 1.00 3.14 H new ATOM 423 N LEU A 233 -1.748 2.986 2.814 1.00 0.13 N ATOM 424 CA LEU A 233 -0.877 1.858 3.013 1.00 0.14 C ATOM 425 C LEU A 233 0.395 2.339 3.674 1.00 0.13 C ATOM 426 O LEU A 233 1.284 2.866 3.011 1.00 0.13 O ATOM 427 CB LEU A 233 -0.590 1.169 1.669 1.00 0.15 C ATOM 428 CG LEU A 233 -1.727 0.279 1.117 1.00 0.17 C ATOM 429 CD1 LEU A 233 -2.988 1.083 0.828 1.00 0.18 C ATOM 430 CD2 LEU A 233 -1.288 -0.453 -0.139 1.00 0.23 C ATOM 0 H LEU A 233 -1.543 3.546 1.987 1.00 0.13 H new ATOM 0 HA LEU A 233 -1.353 1.122 3.661 1.00 0.14 H new ATOM 0 HB2 LEU A 233 -0.362 1.937 0.929 1.00 0.15 H new ATOM 0 HB3 LEU A 233 0.305 0.557 1.779 1.00 0.15 H new ATOM 0 HG LEU A 233 -1.958 -0.451 1.892 1.00 0.17 H new ATOM 0 HD11 LEU A 233 -3.762 0.420 0.442 1.00 0.18 H new ATOM 0 HD12 LEU A 233 -3.338 1.553 1.747 1.00 0.18 H new ATOM 0 HD13 LEU A 233 -2.767 1.852 0.088 1.00 0.18 H new ATOM 0 HD21 LEU A 233 -2.108 -1.071 -0.505 1.00 0.23 H new ATOM 0 HD22 LEU A 233 -1.010 0.272 -0.904 1.00 0.23 H new ATOM 0 HD23 LEU A 233 -0.430 -1.086 0.090 1.00 0.23 H new ATOM 442 N THR A 234 0.398 2.296 4.996 1.00 0.14 N ATOM 443 CA THR A 234 1.493 2.843 5.773 1.00 0.16 C ATOM 444 C THR A 234 2.584 1.810 5.983 1.00 0.16 C ATOM 445 O THR A 234 2.312 0.668 6.345 1.00 0.22 O ATOM 446 CB THR A 234 1.006 3.352 7.139 1.00 0.22 C ATOM 447 OG1 THR A 234 -0.061 4.288 6.954 1.00 0.33 O ATOM 448 CG2 THR A 234 2.144 4.012 7.906 1.00 0.24 C ATOM 0 H THR A 234 -0.351 1.885 5.554 1.00 0.14 H new ATOM 0 HA THR A 234 1.900 3.681 5.207 1.00 0.16 H new ATOM 0 HB THR A 234 0.647 2.501 7.718 1.00 0.22 H new ATOM 0 HG1 THR A 234 -0.370 4.609 7.827 1.00 0.33 H new ATOM 0 HG21 THR A 234 1.777 4.365 8.870 1.00 0.24 H new ATOM 0 HG22 THR A 234 2.943 3.288 8.065 1.00 0.24 H new ATOM 0 HG23 THR A 234 2.528 4.856 7.333 1.00 0.24 H new ATOM 456 N VAL A 235 3.809 2.220 5.725 1.00 0.14 N ATOM 457 CA VAL A 235 4.968 1.363 5.856 1.00 0.14 C ATOM 458 C VAL A 235 6.135 2.187 6.373 1.00 0.14 C ATOM 459 O VAL A 235 6.258 3.359 6.037 1.00 0.16 O ATOM 460 CB VAL A 235 5.364 0.747 4.494 1.00 0.14 C ATOM 461 CG1 VAL A 235 4.224 -0.067 3.919 1.00 0.15 C ATOM 462 CG2 VAL A 235 5.738 1.846 3.529 1.00 0.14 C ATOM 0 H VAL A 235 4.029 3.167 5.416 1.00 0.14 H new ATOM 0 HA VAL A 235 4.723 0.557 6.547 1.00 0.14 H new ATOM 0 HB VAL A 235 6.217 0.087 4.649 1.00 0.14 H new ATOM 0 HG11 VAL A 235 4.526 -0.490 2.961 1.00 0.15 H new ATOM 0 HG12 VAL A 235 3.969 -0.873 4.607 1.00 0.15 H new ATOM 0 HG13 VAL A 235 3.355 0.575 3.774 1.00 0.15 H new ATOM 0 HG21 VAL A 235 6.017 1.409 2.570 1.00 0.14 H new ATOM 0 HG22 VAL A 235 4.887 2.513 3.390 1.00 0.14 H new ATOM 0 HG23 VAL A 235 6.580 2.410 3.929 1.00 0.14 H new ATOM 472 N GLU A 236 7.077 1.548 7.027 1.00 0.13 N ATOM 473 CA GLU A 236 8.314 2.218 7.336 1.00 0.13 C ATOM 474 C GLU A 236 9.270 1.903 6.209 1.00 0.13 C ATOM 475 O GLU A 236 9.551 0.743 5.955 1.00 0.17 O ATOM 476 CB GLU A 236 8.881 1.745 8.674 1.00 0.18 C ATOM 477 CG GLU A 236 10.020 2.610 9.194 1.00 0.29 C ATOM 478 CD GLU A 236 10.504 2.174 10.562 1.00 0.54 C ATOM 479 OE1 GLU A 236 9.972 1.180 11.098 1.00 1.18 O ATOM 480 OE2 GLU A 236 11.421 2.816 11.105 1.00 1.05 O ATOM 0 H GLU A 236 7.012 0.583 7.350 1.00 0.13 H new ATOM 0 HA GLU A 236 8.156 3.292 7.429 1.00 0.13 H new ATOM 0 HB2 GLU A 236 8.080 1.731 9.413 1.00 0.18 H new ATOM 0 HB3 GLU A 236 9.235 0.720 8.567 1.00 0.18 H new ATOM 0 HG2 GLU A 236 10.851 2.572 8.490 1.00 0.29 H new ATOM 0 HG3 GLU A 236 9.690 3.648 9.243 1.00 0.29 H new ATOM 487 N LEU A 237 9.555 2.892 5.387 1.00 0.13 N ATOM 488 CA LEU A 237 10.308 2.648 4.171 1.00 0.15 C ATOM 489 C LEU A 237 11.758 2.356 4.511 1.00 0.17 C ATOM 490 O LEU A 237 12.290 2.892 5.476 1.00 0.19 O ATOM 491 CB LEU A 237 10.228 3.854 3.234 1.00 0.17 C ATOM 492 CG LEU A 237 10.163 3.539 1.738 1.00 0.23 C ATOM 493 CD1 LEU A 237 9.233 2.375 1.467 1.00 0.44 C ATOM 494 CD2 LEU A 237 9.712 4.764 0.960 1.00 0.55 C ATOM 0 H LEU A 237 9.281 3.863 5.535 1.00 0.13 H new ATOM 0 HA LEU A 237 9.875 1.786 3.664 1.00 0.15 H new ATOM 0 HB2 LEU A 237 9.347 4.438 3.501 1.00 0.17 H new ATOM 0 HB3 LEU A 237 11.097 4.487 3.414 1.00 0.17 H new ATOM 0 HG LEU A 237 11.163 3.259 1.408 1.00 0.23 H new ATOM 0 HD11 LEU A 237 9.206 2.173 0.396 1.00 0.44 H new ATOM 0 HD12 LEU A 237 9.593 1.491 1.994 1.00 0.44 H new ATOM 0 HD13 LEU A 237 8.230 2.622 1.815 1.00 0.44 H new ATOM 0 HD21 LEU A 237 9.670 4.525 -0.103 1.00 0.55 H new ATOM 0 HD22 LEU A 237 8.723 5.069 1.302 1.00 0.55 H new ATOM 0 HD23 LEU A 237 10.419 5.578 1.121 1.00 0.55 H new ATOM 506 N ALA A 238 12.400 1.546 3.695 1.00 0.19 N ATOM 507 CA ALA A 238 13.828 1.316 3.825 1.00 0.21 C ATOM 508 C ALA A 238 14.558 2.334 2.966 1.00 0.23 C ATOM 509 O ALA A 238 15.711 2.682 3.212 1.00 0.28 O ATOM 510 CB ALA A 238 14.186 -0.100 3.405 1.00 0.25 C ATOM 0 H ALA A 238 11.957 1.034 2.932 1.00 0.19 H new ATOM 0 HA ALA A 238 14.127 1.431 4.867 1.00 0.21 H new ATOM 0 HB1 ALA A 238 15.260 -0.250 3.510 1.00 0.25 H new ATOM 0 HB2 ALA A 238 13.656 -0.812 4.038 1.00 0.25 H new ATOM 0 HB3 ALA A 238 13.898 -0.255 2.365 1.00 0.25 H new ATOM 516 N ASP A 239 13.838 2.832 1.972 1.00 0.22 N ATOM 517 CA ASP A 239 14.369 3.813 1.035 1.00 0.25 C ATOM 518 C ASP A 239 14.149 5.226 1.538 1.00 0.25 C ATOM 519 O ASP A 239 15.017 6.086 1.403 1.00 0.34 O ATOM 520 CB ASP A 239 13.711 3.653 -0.327 1.00 0.31 C ATOM 521 CG ASP A 239 14.516 2.769 -1.258 1.00 0.63 C ATOM 522 OD1 ASP A 239 14.810 1.617 -0.888 1.00 1.28 O ATOM 523 OD2 ASP A 239 14.868 3.232 -2.364 1.00 1.19 O ATOM 0 H ASP A 239 12.869 2.568 1.791 1.00 0.22 H new ATOM 0 HA ASP A 239 15.441 3.638 0.944 1.00 0.25 H new ATOM 0 HB2 ASP A 239 12.715 3.229 -0.199 1.00 0.31 H new ATOM 0 HB3 ASP A 239 13.583 4.635 -0.783 1.00 0.31 H new ATOM 528 N HIS A 240 12.973 5.439 2.125 1.00 0.27 N ATOM 529 CA HIS A 240 12.576 6.727 2.705 1.00 0.39 C ATOM 530 C HIS A 240 12.198 7.731 1.614 1.00 0.47 C ATOM 531 O HIS A 240 11.091 8.264 1.608 1.00 0.70 O ATOM 532 CB HIS A 240 13.689 7.321 3.591 1.00 0.46 C ATOM 533 CG HIS A 240 14.221 6.386 4.643 1.00 0.46 C ATOM 534 ND1 HIS A 240 13.913 5.096 4.932 1.00 0.56 N flip ATOM 535 CD2 HIS A 240 15.210 6.744 5.530 1.00 0.40 C flip ATOM 536 CE1 HIS A 240 14.717 4.707 5.977 1.00 0.57 C flip ATOM 537 NE2 HIS A 240 15.486 5.722 6.316 1.00 0.48 N flip ATOM 0 H HIS A 240 12.259 4.716 2.214 1.00 0.27 H new ATOM 0 HA HIS A 240 11.703 6.535 3.330 1.00 0.39 H new ATOM 0 HB2 HIS A 240 14.515 7.635 2.952 1.00 0.46 H new ATOM 0 HB3 HIS A 240 13.306 8.217 4.080 1.00 0.46 H new ATOM 0 HD1 HIS A 240 13.214 4.521 4.461 1.00 0.56 H new ATOM 0 HD2 HIS A 240 15.686 7.712 5.575 1.00 0.40 H new ATOM 0 HE1 HIS A 240 14.718 3.732 6.442 1.00 0.57 H new ATOM 546 N ASP A 241 13.121 7.982 0.698 1.00 0.41 N ATOM 547 CA ASP A 241 12.899 8.954 -0.369 1.00 0.51 C ATOM 548 C ASP A 241 12.726 8.281 -1.715 1.00 0.44 C ATOM 549 O ASP A 241 13.216 8.762 -2.737 1.00 0.78 O ATOM 550 CB ASP A 241 14.056 9.955 -0.428 1.00 0.80 C ATOM 551 CG ASP A 241 15.421 9.287 -0.467 1.00 1.53 C ATOM 552 OD1 ASP A 241 15.702 8.581 -1.457 1.00 2.22 O ATOM 553 OD2 ASP A 241 16.218 9.462 0.481 1.00 2.08 O ATOM 0 H ASP A 241 14.033 7.527 0.670 1.00 0.41 H new ATOM 0 HA ASP A 241 11.975 9.485 -0.140 1.00 0.51 H new ATOM 0 HB2 ASP A 241 13.940 10.583 -1.311 1.00 0.80 H new ATOM 0 HB3 ASP A 241 14.004 10.612 0.440 1.00 0.80 H new ATOM 558 N ALA A 242 11.983 7.200 -1.725 1.00 0.33 N ATOM 559 CA ALA A 242 11.737 6.472 -2.946 1.00 0.30 C ATOM 560 C ALA A 242 10.283 6.526 -3.342 1.00 0.24 C ATOM 561 O ALA A 242 9.399 6.367 -2.497 1.00 0.28 O ATOM 562 CB ALA A 242 12.160 5.036 -2.776 1.00 0.38 C ATOM 0 H ALA A 242 11.537 6.804 -0.898 1.00 0.33 H new ATOM 0 HA ALA A 242 12.320 6.941 -3.738 1.00 0.30 H new ATOM 0 HB1 ALA A 242 11.973 4.490 -3.700 1.00 0.38 H new ATOM 0 HB2 ALA A 242 13.223 4.995 -2.540 1.00 0.38 H new ATOM 0 HB3 ALA A 242 11.591 4.583 -1.965 1.00 0.38 H new ATOM 568 N GLU A 243 10.042 6.581 -4.639 1.00 0.26 N ATOM 569 CA GLU A 243 8.698 6.432 -5.146 1.00 0.30 C ATOM 570 C GLU A 243 8.267 4.990 -4.950 1.00 0.25 C ATOM 571 O GLU A 243 8.909 4.070 -5.457 1.00 0.25 O ATOM 572 CB GLU A 243 8.640 6.797 -6.626 1.00 0.39 C ATOM 573 CG GLU A 243 9.033 8.234 -6.916 1.00 0.67 C ATOM 574 CD GLU A 243 8.927 8.574 -8.387 1.00 1.10 C ATOM 575 OE1 GLU A 243 8.661 7.662 -9.197 1.00 1.64 O ATOM 576 OE2 GLU A 243 9.091 9.759 -8.743 1.00 1.56 O ATOM 0 H GLU A 243 10.756 6.727 -5.353 1.00 0.26 H new ATOM 0 HA GLU A 243 8.028 7.101 -4.606 1.00 0.30 H new ATOM 0 HB2 GLU A 243 9.299 6.130 -7.182 1.00 0.39 H new ATOM 0 HB3 GLU A 243 7.629 6.625 -6.994 1.00 0.39 H new ATOM 0 HG2 GLU A 243 8.393 8.906 -6.343 1.00 0.67 H new ATOM 0 HG3 GLU A 243 10.056 8.403 -6.579 1.00 0.67 H new ATOM 583 N VAL A 244 7.230 4.789 -4.165 1.00 0.24 N ATOM 584 CA VAL A 244 6.777 3.448 -3.873 1.00 0.21 C ATOM 585 C VAL A 244 5.668 3.041 -4.813 1.00 0.20 C ATOM 586 O VAL A 244 4.665 3.741 -4.965 1.00 0.23 O ATOM 587 CB VAL A 244 6.307 3.292 -2.412 1.00 0.22 C ATOM 588 CG1 VAL A 244 7.491 3.411 -1.468 1.00 0.24 C ATOM 589 CG2 VAL A 244 5.230 4.317 -2.072 1.00 0.27 C ATOM 0 H VAL A 244 6.689 5.531 -3.721 1.00 0.24 H new ATOM 0 HA VAL A 244 7.634 2.790 -4.018 1.00 0.21 H new ATOM 0 HB VAL A 244 5.867 2.302 -2.293 1.00 0.22 H new ATOM 0 HG11 VAL A 244 7.149 3.299 -0.439 1.00 0.24 H new ATOM 0 HG12 VAL A 244 8.217 2.631 -1.695 1.00 0.24 H new ATOM 0 HG13 VAL A 244 7.958 4.388 -1.591 1.00 0.24 H new ATOM 0 HG21 VAL A 244 4.916 4.185 -1.036 1.00 0.27 H new ATOM 0 HG22 VAL A 244 5.630 5.322 -2.205 1.00 0.27 H new ATOM 0 HG23 VAL A 244 4.373 4.177 -2.731 1.00 0.27 H new ATOM 599 N LYS A 245 5.817 1.872 -5.376 1.00 0.18 N ATOM 600 CA LYS A 245 4.782 1.301 -6.193 1.00 0.19 C ATOM 601 C LYS A 245 4.123 0.194 -5.406 1.00 0.15 C ATOM 602 O LYS A 245 4.683 -0.302 -4.434 1.00 0.16 O ATOM 603 CB LYS A 245 5.364 0.790 -7.503 1.00 0.30 C ATOM 604 CG LYS A 245 5.020 1.658 -8.706 1.00 0.89 C ATOM 605 CD LYS A 245 5.487 3.096 -8.518 1.00 1.51 C ATOM 606 CE LYS A 245 7.005 3.200 -8.478 1.00 2.00 C ATOM 607 NZ LYS A 245 7.619 2.889 -9.795 1.00 2.79 N ATOM 0 H LYS A 245 6.652 1.293 -5.282 1.00 0.18 H new ATOM 0 HA LYS A 245 4.036 2.053 -6.450 1.00 0.19 H new ATOM 0 HB2 LYS A 245 6.448 0.728 -7.409 1.00 0.30 H new ATOM 0 HB3 LYS A 245 5.001 -0.222 -7.681 1.00 0.30 H new ATOM 0 HG2 LYS A 245 5.482 1.240 -9.600 1.00 0.89 H new ATOM 0 HG3 LYS A 245 3.942 1.644 -8.868 1.00 0.89 H new ATOM 0 HD2 LYS A 245 5.102 3.712 -9.331 1.00 1.51 H new ATOM 0 HD3 LYS A 245 5.071 3.494 -7.592 1.00 1.51 H new ATOM 0 HE2 LYS A 245 7.292 4.206 -8.173 1.00 2.00 H new ATOM 0 HE3 LYS A 245 7.396 2.515 -7.725 1.00 2.00 H new ATOM 0 HZ1 LYS A 245 8.626 3.149 -9.779 1.00 2.79 H new ATOM 0 HZ2 LYS A 245 7.527 1.871 -9.989 1.00 2.79 H new ATOM 0 HZ3 LYS A 245 7.134 3.429 -10.540 1.00 2.79 H new ATOM 621 N TRP A 246 2.878 -0.060 -5.661 1.00 0.14 N ATOM 622 CA TRP A 246 2.178 -1.022 -4.846 1.00 0.13 C ATOM 623 C TRP A 246 1.508 -2.015 -5.761 1.00 0.14 C ATOM 624 O TRP A 246 1.709 -1.955 -6.964 1.00 0.14 O ATOM 625 CB TRP A 246 1.218 -0.341 -3.852 1.00 0.14 C ATOM 626 CG TRP A 246 1.925 0.648 -2.946 1.00 0.12 C ATOM 627 CD1 TRP A 246 2.481 1.837 -3.325 1.00 0.14 C ATOM 628 CD2 TRP A 246 2.182 0.536 -1.528 1.00 0.11 C ATOM 629 NE1 TRP A 246 3.051 2.460 -2.249 1.00 0.15 N ATOM 630 CE2 TRP A 246 2.886 1.695 -1.144 1.00 0.12 C ATOM 631 CE3 TRP A 246 1.895 -0.411 -0.541 1.00 0.13 C ATOM 632 CZ2 TRP A 246 3.297 1.933 0.161 1.00 0.14 C ATOM 633 CZ3 TRP A 246 2.311 -0.163 0.762 1.00 0.15 C ATOM 634 CH2 TRP A 246 3.003 1.002 1.091 1.00 0.15 C ATOM 0 H TRP A 246 2.330 0.369 -6.406 1.00 0.14 H new ATOM 0 HA TRP A 246 2.879 -1.564 -4.212 1.00 0.13 H new ATOM 0 HB2 TRP A 246 0.433 0.175 -4.405 1.00 0.14 H new ATOM 0 HB3 TRP A 246 0.731 -1.102 -3.243 1.00 0.14 H new ATOM 0 HD1 TRP A 246 2.472 2.229 -4.331 1.00 0.14 H new ATOM 0 HE1 TRP A 246 3.527 3.362 -2.275 1.00 0.15 H new ATOM 0 HE3 TRP A 246 1.361 -1.317 -0.786 1.00 0.13 H new ATOM 0 HZ2 TRP A 246 3.834 2.833 0.422 1.00 0.14 H new ATOM 0 HZ3 TRP A 246 2.094 -0.886 1.534 1.00 0.15 H new ATOM 0 HH2 TRP A 246 3.310 1.162 2.114 1.00 0.15 H new ATOM 645 N LEU A 247 1.029 -3.089 -5.215 1.00 0.15 N ATOM 646 CA LEU A 247 0.563 -4.184 -6.030 1.00 0.14 C ATOM 647 C LEU A 247 -0.875 -4.520 -5.644 1.00 0.15 C ATOM 648 O LEU A 247 -1.150 -4.787 -4.491 1.00 0.16 O ATOM 649 CB LEU A 247 1.485 -5.387 -5.794 1.00 0.15 C ATOM 650 CG LEU A 247 2.357 -5.881 -6.953 1.00 0.16 C ATOM 651 CD1 LEU A 247 1.637 -6.959 -7.745 1.00 0.21 C ATOM 652 CD2 LEU A 247 2.777 -4.737 -7.853 1.00 0.17 C ATOM 0 H LEU A 247 0.947 -3.238 -4.209 1.00 0.15 H new ATOM 0 HA LEU A 247 0.583 -3.917 -7.087 1.00 0.14 H new ATOM 0 HB2 LEU A 247 2.147 -5.139 -4.964 1.00 0.15 H new ATOM 0 HB3 LEU A 247 0.864 -6.221 -5.468 1.00 0.15 H new ATOM 0 HG LEU A 247 3.262 -6.316 -6.529 1.00 0.16 H new ATOM 0 HD11 LEU A 247 2.274 -7.296 -8.563 1.00 0.21 H new ATOM 0 HD12 LEU A 247 1.411 -7.801 -7.091 1.00 0.21 H new ATOM 0 HD13 LEU A 247 0.709 -6.555 -8.150 1.00 0.21 H new ATOM 0 HD21 LEU A 247 3.394 -5.121 -8.665 1.00 0.17 H new ATOM 0 HD22 LEU A 247 1.891 -4.256 -8.267 1.00 0.17 H new ATOM 0 HD23 LEU A 247 3.348 -4.010 -7.275 1.00 0.17 H new ATOM 664 N LYS A 248 -1.755 -4.642 -6.614 1.00 0.19 N ATOM 665 CA LYS A 248 -3.089 -5.162 -6.341 1.00 0.25 C ATOM 666 C LYS A 248 -3.032 -6.657 -6.502 1.00 0.25 C ATOM 667 O LYS A 248 -2.084 -7.152 -7.103 1.00 0.21 O ATOM 668 CB LYS A 248 -4.158 -4.552 -7.262 1.00 0.34 C ATOM 669 CG LYS A 248 -3.815 -4.582 -8.742 1.00 0.77 C ATOM 670 CD LYS A 248 -4.904 -3.918 -9.567 1.00 0.95 C ATOM 671 CE LYS A 248 -4.571 -3.916 -11.052 1.00 1.57 C ATOM 672 NZ LYS A 248 -5.660 -3.311 -11.864 1.00 2.06 N ATOM 0 H LYS A 248 -1.581 -4.394 -7.588 1.00 0.19 H new ATOM 0 HA LYS A 248 -3.382 -4.890 -5.327 1.00 0.25 H new ATOM 0 HB2 LYS A 248 -5.096 -5.086 -7.110 1.00 0.34 H new ATOM 0 HB3 LYS A 248 -4.328 -3.517 -6.963 1.00 0.34 H new ATOM 0 HG2 LYS A 248 -2.866 -4.073 -8.909 1.00 0.77 H new ATOM 0 HG3 LYS A 248 -3.685 -5.614 -9.068 1.00 0.77 H new ATOM 0 HD2 LYS A 248 -5.848 -4.439 -9.408 1.00 0.95 H new ATOM 0 HD3 LYS A 248 -5.044 -2.892 -9.225 1.00 0.95 H new ATOM 0 HE2 LYS A 248 -3.646 -3.363 -11.216 1.00 1.57 H new ATOM 0 HE3 LYS A 248 -4.395 -4.939 -11.386 1.00 1.57 H new ATOM 0 HZ1 LYS A 248 -5.394 -3.329 -12.869 1.00 2.06 H new ATOM 0 HZ2 LYS A 248 -6.537 -3.853 -11.728 1.00 2.06 H new ATOM 0 HZ3 LYS A 248 -5.812 -2.327 -11.563 1.00 2.06 H new ATOM 686 N ASN A 249 -3.872 -7.363 -5.766 1.00 0.34 N ATOM 687 CA ASN A 249 -3.799 -8.819 -5.698 1.00 0.40 C ATOM 688 C ASN A 249 -3.434 -9.413 -7.053 1.00 0.35 C ATOM 689 O ASN A 249 -4.249 -9.425 -7.972 1.00 0.35 O ATOM 690 CB ASN A 249 -5.150 -9.363 -5.240 1.00 0.61 C ATOM 691 CG ASN A 249 -5.070 -10.783 -4.734 1.00 0.75 C ATOM 692 OD1 ASN A 249 -5.241 -10.934 -3.435 1.00 1.38 O flip ATOM 693 ND2 ASN A 249 -4.836 -11.724 -5.490 1.00 1.19 N flip ATOM 0 H ASN A 249 -4.617 -6.953 -5.203 1.00 0.34 H new ATOM 0 HA ASN A 249 -3.022 -9.100 -4.987 1.00 0.40 H new ATOM 0 HB2 ASN A 249 -5.545 -8.723 -4.451 1.00 0.61 H new ATOM 0 HB3 ASN A 249 -5.855 -9.318 -6.070 1.00 0.61 H new ATOM 0 HD21 ASN A 249 -4.711 -11.557 -6.488 1.00 1.19 H new ATOM 0 HD22 ASN A 249 -4.767 -12.671 -5.119 1.00 1.19 H new ATOM 700 N GLY A 250 -2.174 -9.812 -7.185 1.00 0.35 N ATOM 701 CA GLY A 250 -1.670 -10.341 -8.437 1.00 0.35 C ATOM 702 C GLY A 250 -1.133 -9.289 -9.406 1.00 0.33 C ATOM 703 O GLY A 250 -0.109 -9.525 -10.053 1.00 0.39 O ATOM 0 H GLY A 250 -1.484 -9.777 -6.434 1.00 0.35 H new ATOM 0 HA2 GLY A 250 -0.875 -11.055 -8.220 1.00 0.35 H new ATOM 0 HA3 GLY A 250 -2.469 -10.894 -8.930 1.00 0.35 H new ATOM 707 N GLN A 251 -1.834 -8.171 -9.587 1.00 0.30 N ATOM 708 CA GLN A 251 -1.418 -7.189 -10.596 1.00 0.36 C ATOM 709 C GLN A 251 -0.752 -5.966 -9.991 1.00 0.25 C ATOM 710 O GLN A 251 -0.865 -5.694 -8.807 1.00 0.28 O ATOM 711 CB GLN A 251 -2.574 -6.730 -11.464 1.00 0.52 C ATOM 712 CG GLN A 251 -3.255 -7.843 -12.242 1.00 1.28 C ATOM 713 CD GLN A 251 -4.413 -7.337 -13.080 1.00 2.00 C ATOM 714 OE1 GLN A 251 -4.240 -6.476 -13.943 1.00 2.77 O ATOM 715 NE2 GLN A 251 -5.602 -7.856 -12.823 1.00 2.59 N ATOM 0 H GLN A 251 -2.674 -7.923 -9.064 1.00 0.30 H new ATOM 0 HA GLN A 251 -0.690 -7.716 -11.212 1.00 0.36 H new ATOM 0 HB2 GLN A 251 -3.314 -6.239 -10.832 1.00 0.52 H new ATOM 0 HB3 GLN A 251 -2.209 -5.982 -12.168 1.00 0.52 H new ATOM 0 HG2 GLN A 251 -2.526 -8.328 -12.890 1.00 1.28 H new ATOM 0 HG3 GLN A 251 -3.617 -8.600 -11.546 1.00 1.28 H new ATOM 0 HE21 GLN A 251 -5.702 -8.568 -12.099 1.00 2.59 H new ATOM 0 HE22 GLN A 251 -6.419 -7.545 -13.349 1.00 2.59 H new ATOM 724 N GLU A 252 0.004 -5.273 -10.808 1.00 0.26 N ATOM 725 CA GLU A 252 0.812 -4.171 -10.332 1.00 0.25 C ATOM 726 C GLU A 252 0.039 -2.864 -10.217 1.00 0.27 C ATOM 727 O GLU A 252 -0.827 -2.551 -11.035 1.00 0.32 O ATOM 728 CB GLU A 252 2.027 -4.026 -11.219 1.00 0.32 C ATOM 729 CG GLU A 252 2.800 -5.324 -11.290 1.00 0.60 C ATOM 730 CD GLU A 252 2.511 -6.110 -12.545 1.00 1.05 C ATOM 731 OE1 GLU A 252 2.817 -5.605 -13.647 1.00 1.49 O ATOM 732 OE2 GLU A 252 1.955 -7.223 -12.444 1.00 1.60 O ATOM 0 H GLU A 252 0.078 -5.452 -11.809 1.00 0.26 H new ATOM 0 HA GLU A 252 1.129 -4.404 -9.315 1.00 0.25 H new ATOM 0 HB2 GLU A 252 1.718 -3.727 -12.220 1.00 0.32 H new ATOM 0 HB3 GLU A 252 2.671 -3.235 -10.835 1.00 0.32 H new ATOM 0 HG2 GLU A 252 3.867 -5.109 -11.239 1.00 0.60 H new ATOM 0 HG3 GLU A 252 2.556 -5.934 -10.420 1.00 0.60 H new ATOM 739 N ILE A 253 0.339 -2.144 -9.148 1.00 0.23 N ATOM 740 CA ILE A 253 -0.308 -0.888 -8.821 1.00 0.27 C ATOM 741 C ILE A 253 0.681 0.281 -8.939 1.00 0.28 C ATOM 742 O ILE A 253 1.643 0.413 -8.155 1.00 0.28 O ATOM 743 CB ILE A 253 -0.912 -0.986 -7.396 1.00 0.26 C ATOM 744 CG1 ILE A 253 -2.362 -1.436 -7.443 1.00 0.31 C ATOM 745 CG2 ILE A 253 -0.787 0.297 -6.601 1.00 0.28 C ATOM 746 CD1 ILE A 253 -2.946 -1.640 -6.064 1.00 0.33 C ATOM 0 H ILE A 253 1.051 -2.423 -8.473 1.00 0.23 H new ATOM 0 HA ILE A 253 -1.113 -0.695 -9.530 1.00 0.27 H new ATOM 0 HB ILE A 253 -0.320 -1.739 -6.875 1.00 0.26 H new ATOM 0 HG12 ILE A 253 -2.953 -0.693 -7.979 1.00 0.31 H new ATOM 0 HG13 ILE A 253 -2.433 -2.367 -8.006 1.00 0.31 H new ATOM 0 HG21 ILE A 253 -1.230 0.158 -5.615 1.00 0.28 H new ATOM 0 HG22 ILE A 253 0.266 0.557 -6.493 1.00 0.28 H new ATOM 0 HG23 ILE A 253 -1.307 1.100 -7.122 1.00 0.28 H new ATOM 0 HD11 ILE A 253 -3.984 -1.961 -6.152 1.00 0.33 H new ATOM 0 HD12 ILE A 253 -2.374 -2.403 -5.536 1.00 0.33 H new ATOM 0 HD13 ILE A 253 -2.902 -0.703 -5.508 1.00 0.33 H new ATOM 758 N GLN A 254 0.470 1.088 -9.969 1.00 0.36 N ATOM 759 CA GLN A 254 1.330 2.223 -10.252 1.00 0.43 C ATOM 760 C GLN A 254 0.898 3.435 -9.440 1.00 0.61 C ATOM 761 O GLN A 254 -0.293 3.730 -9.328 1.00 1.42 O ATOM 762 CB GLN A 254 1.315 2.564 -11.746 1.00 0.70 C ATOM 763 CG GLN A 254 2.238 1.709 -12.610 1.00 1.00 C ATOM 764 CD GLN A 254 1.824 0.251 -12.691 1.00 1.75 C ATOM 765 OE1 GLN A 254 2.018 -0.521 -11.753 1.00 2.63 O ATOM 766 NE2 GLN A 254 1.253 -0.135 -13.819 1.00 2.21 N ATOM 0 H GLN A 254 -0.300 0.973 -10.628 1.00 0.36 H new ATOM 0 HA GLN A 254 2.347 1.951 -9.969 1.00 0.43 H new ATOM 0 HB2 GLN A 254 0.295 2.461 -12.117 1.00 0.70 H new ATOM 0 HB3 GLN A 254 1.594 3.611 -11.868 1.00 0.70 H new ATOM 0 HG2 GLN A 254 2.267 2.125 -13.617 1.00 1.00 H new ATOM 0 HG3 GLN A 254 3.251 1.768 -12.212 1.00 1.00 H new ATOM 0 HE21 GLN A 254 1.110 0.536 -14.574 1.00 2.21 H new ATOM 0 HE22 GLN A 254 0.956 -1.104 -13.935 1.00 2.21 H new ATOM 775 N MET A 255 1.877 4.113 -8.866 1.00 0.59 N ATOM 776 CA MET A 255 1.643 5.290 -8.040 1.00 0.61 C ATOM 777 C MET A 255 1.017 6.415 -8.869 1.00 0.65 C ATOM 778 O MET A 255 1.409 6.637 -10.018 1.00 0.95 O ATOM 779 CB MET A 255 2.973 5.741 -7.440 1.00 0.95 C ATOM 780 CG MET A 255 2.849 6.742 -6.309 1.00 1.58 C ATOM 781 SD MET A 255 4.452 7.149 -5.587 1.00 2.30 S ATOM 782 CE MET A 255 5.263 7.928 -6.981 1.00 2.61 C ATOM 0 H MET A 255 2.862 3.863 -8.959 1.00 0.59 H new ATOM 0 HA MET A 255 0.946 5.042 -7.239 1.00 0.61 H new ATOM 0 HB2 MET A 255 3.507 4.864 -7.074 1.00 0.95 H new ATOM 0 HB3 MET A 255 3.583 6.179 -8.230 1.00 0.95 H new ATOM 0 HG2 MET A 255 2.377 7.652 -6.680 1.00 1.58 H new ATOM 0 HG3 MET A 255 2.196 6.337 -5.536 1.00 1.58 H new ATOM 0 HE1 MET A 255 6.144 8.467 -6.634 1.00 2.61 H new ATOM 0 HE2 MET A 255 5.564 7.166 -7.700 1.00 2.61 H new ATOM 0 HE3 MET A 255 4.575 8.626 -7.459 1.00 2.61 H new ATOM 792 N SER A 256 0.021 7.087 -8.304 1.00 0.57 N ATOM 793 CA SER A 256 -0.690 8.146 -9.010 1.00 0.69 C ATOM 794 C SER A 256 -1.186 9.208 -8.015 1.00 1.00 C ATOM 795 O SER A 256 -0.554 9.433 -6.979 1.00 1.47 O ATOM 796 CB SER A 256 -1.862 7.541 -9.804 1.00 0.76 C ATOM 797 OG SER A 256 -2.462 8.498 -10.665 1.00 1.64 O ATOM 0 H SER A 256 -0.313 6.916 -7.356 1.00 0.57 H new ATOM 0 HA SER A 256 -0.012 8.634 -9.710 1.00 0.69 H new ATOM 0 HB2 SER A 256 -1.505 6.695 -10.392 1.00 0.76 H new ATOM 0 HB3 SER A 256 -2.610 7.155 -9.112 1.00 0.76 H new ATOM 0 HG SER A 256 -3.201 8.080 -11.155 1.00 1.64 H new ATOM 803 N GLY A 257 -2.279 9.892 -8.351 1.00 1.01 N ATOM 804 CA GLY A 257 -2.780 10.964 -7.507 1.00 1.41 C ATOM 805 C GLY A 257 -4.290 10.951 -7.373 1.00 1.28 C ATOM 806 O GLY A 257 -4.908 11.980 -7.088 1.00 1.69 O ATOM 0 H GLY A 257 -2.827 9.722 -9.194 1.00 1.01 H new ATOM 0 HA2 GLY A 257 -2.331 10.880 -6.517 1.00 1.41 H new ATOM 0 HA3 GLY A 257 -2.465 11.922 -7.920 1.00 1.41 H new ATOM 810 N SER A 258 -4.855 9.760 -7.427 1.00 1.07 N ATOM 811 CA SER A 258 -6.277 9.559 -7.190 1.00 0.96 C ATOM 812 C SER A 258 -6.464 8.177 -6.588 1.00 0.74 C ATOM 813 O SER A 258 -6.727 8.036 -5.397 1.00 1.14 O ATOM 814 CB SER A 258 -7.060 9.697 -8.500 1.00 1.08 C ATOM 815 OG SER A 258 -6.507 8.872 -9.516 1.00 1.77 O ATOM 0 H SER A 258 -4.344 8.903 -7.636 1.00 1.07 H new ATOM 0 HA SER A 258 -6.657 10.314 -6.502 1.00 0.96 H new ATOM 0 HB2 SER A 258 -8.103 9.426 -8.334 1.00 1.08 H new ATOM 0 HB3 SER A 258 -7.049 10.737 -8.826 1.00 1.08 H new ATOM 0 HG SER A 258 -7.026 8.977 -10.341 1.00 1.77 H new ATOM 821 N LYS A 259 -5.998 7.195 -7.331 1.00 0.51 N ATOM 822 CA LYS A 259 -5.783 5.877 -6.785 1.00 0.37 C ATOM 823 C LYS A 259 -4.308 5.753 -6.468 1.00 0.33 C ATOM 824 O LYS A 259 -3.490 6.299 -7.209 1.00 0.45 O ATOM 825 CB LYS A 259 -6.177 4.793 -7.797 1.00 0.48 C ATOM 826 CG LYS A 259 -7.596 4.903 -8.324 1.00 1.11 C ATOM 827 CD LYS A 259 -8.615 4.650 -7.234 1.00 1.59 C ATOM 828 CE LYS A 259 -10.032 4.635 -7.781 1.00 2.02 C ATOM 829 NZ LYS A 259 -10.283 3.450 -8.641 1.00 2.41 N ATOM 0 H LYS A 259 -5.761 7.288 -8.319 1.00 0.51 H new ATOM 0 HA LYS A 259 -6.395 5.742 -5.893 1.00 0.37 H new ATOM 0 HB2 LYS A 259 -5.487 4.834 -8.640 1.00 0.48 H new ATOM 0 HB3 LYS A 259 -6.052 3.816 -7.330 1.00 0.48 H new ATOM 0 HG2 LYS A 259 -7.752 5.896 -8.746 1.00 1.11 H new ATOM 0 HG3 LYS A 259 -7.741 4.187 -9.132 1.00 1.11 H new ATOM 0 HD2 LYS A 259 -8.402 3.697 -6.751 1.00 1.59 H new ATOM 0 HD3 LYS A 259 -8.529 5.422 -6.469 1.00 1.59 H new ATOM 0 HE2 LYS A 259 -10.741 4.639 -6.953 1.00 2.02 H new ATOM 0 HE3 LYS A 259 -10.209 5.544 -8.356 1.00 2.02 H new ATOM 0 HZ1 LYS A 259 -11.303 3.366 -8.827 1.00 2.41 H new ATOM 0 HZ2 LYS A 259 -9.774 3.561 -9.541 1.00 2.41 H new ATOM 0 HZ3 LYS A 259 -9.948 2.593 -8.157 1.00 2.41 H new ATOM 843 N TYR A 260 -3.957 5.003 -5.422 1.00 0.24 N ATOM 844 CA TYR A 260 -2.547 4.759 -5.107 1.00 0.27 C ATOM 845 C TYR A 260 -1.775 6.080 -4.989 1.00 0.27 C ATOM 846 O TYR A 260 -0.829 6.337 -5.738 1.00 0.29 O ATOM 847 CB TYR A 260 -1.908 3.861 -6.179 1.00 0.33 C ATOM 848 CG TYR A 260 -2.892 2.936 -6.868 1.00 0.43 C ATOM 849 CD1 TYR A 260 -3.713 2.083 -6.139 1.00 0.29 C ATOM 850 CD2 TYR A 260 -3.014 2.936 -8.250 1.00 0.84 C ATOM 851 CE1 TYR A 260 -4.624 1.258 -6.769 1.00 0.52 C ATOM 852 CE2 TYR A 260 -3.921 2.118 -8.888 1.00 1.11 C ATOM 853 CZ TYR A 260 -4.723 1.280 -8.146 1.00 0.95 C ATOM 854 OH TYR A 260 -5.629 0.458 -8.781 1.00 1.24 O ATOM 0 H TYR A 260 -4.619 4.559 -4.786 1.00 0.24 H new ATOM 0 HA TYR A 260 -2.497 4.249 -4.145 1.00 0.27 H new ATOM 0 HB2 TYR A 260 -1.429 4.491 -6.929 1.00 0.33 H new ATOM 0 HB3 TYR A 260 -1.123 3.262 -5.717 1.00 0.33 H new ATOM 0 HD1 TYR A 260 -3.637 2.065 -5.062 1.00 0.29 H new ATOM 0 HD2 TYR A 260 -2.386 3.590 -8.837 1.00 0.84 H new ATOM 0 HE1 TYR A 260 -5.254 0.600 -6.189 1.00 0.52 H new ATOM 0 HE2 TYR A 260 -4.002 2.134 -9.965 1.00 1.11 H new ATOM 0 HH TYR A 260 -5.573 0.596 -9.750 1.00 1.24 H new ATOM 864 N ILE A 261 -2.224 6.923 -4.077 1.00 0.26 N ATOM 865 CA ILE A 261 -1.641 8.240 -3.864 1.00 0.27 C ATOM 866 C ILE A 261 -0.419 8.150 -2.950 1.00 0.28 C ATOM 867 O ILE A 261 -0.434 7.437 -1.955 1.00 0.35 O ATOM 868 CB ILE A 261 -2.686 9.173 -3.219 1.00 0.29 C ATOM 869 CG1 ILE A 261 -3.918 9.311 -4.121 1.00 0.32 C ATOM 870 CG2 ILE A 261 -2.086 10.533 -2.904 1.00 0.33 C ATOM 871 CD1 ILE A 261 -5.038 10.108 -3.487 1.00 0.39 C ATOM 0 H ILE A 261 -3.008 6.714 -3.459 1.00 0.26 H new ATOM 0 HA ILE A 261 -1.331 8.638 -4.830 1.00 0.27 H new ATOM 0 HB ILE A 261 -3.003 8.725 -2.277 1.00 0.29 H new ATOM 0 HG12 ILE A 261 -3.624 9.790 -5.055 1.00 0.32 H new ATOM 0 HG13 ILE A 261 -4.287 8.317 -4.375 1.00 0.32 H new ATOM 0 HG21 ILE A 261 -2.846 11.170 -2.450 1.00 0.33 H new ATOM 0 HG22 ILE A 261 -1.253 10.412 -2.211 1.00 0.33 H new ATOM 0 HG23 ILE A 261 -1.728 10.995 -3.824 1.00 0.33 H new ATOM 0 HD11 ILE A 261 -5.879 10.167 -4.178 1.00 0.39 H new ATOM 0 HD12 ILE A 261 -5.358 9.618 -2.567 1.00 0.39 H new ATOM 0 HD13 ILE A 261 -4.685 11.113 -3.258 1.00 0.39 H new ATOM 883 N PHE A 262 0.647 8.853 -3.290 1.00 0.30 N ATOM 884 CA PHE A 262 1.855 8.813 -2.477 1.00 0.32 C ATOM 885 C PHE A 262 1.780 9.786 -1.301 1.00 0.30 C ATOM 886 O PHE A 262 1.381 10.943 -1.460 1.00 0.37 O ATOM 887 CB PHE A 262 3.100 9.089 -3.334 1.00 0.46 C ATOM 888 CG PHE A 262 3.029 10.328 -4.195 1.00 0.63 C ATOM 889 CD1 PHE A 262 3.204 11.584 -3.633 1.00 0.87 C ATOM 890 CD2 PHE A 262 2.759 10.243 -5.551 1.00 0.84 C ATOM 891 CE1 PHE A 262 3.116 12.726 -4.406 1.00 1.13 C ATOM 892 CE2 PHE A 262 2.674 11.380 -6.330 1.00 1.09 C ATOM 893 CZ PHE A 262 2.944 12.596 -5.805 1.00 1.18 C ATOM 0 H PHE A 262 0.704 9.453 -4.113 1.00 0.30 H new ATOM 0 HA PHE A 262 1.936 7.807 -2.064 1.00 0.32 H new ATOM 0 HB2 PHE A 262 3.963 9.174 -2.674 1.00 0.46 H new ATOM 0 HB3 PHE A 262 3.275 8.228 -3.979 1.00 0.46 H new ATOM 0 HD1 PHE A 262 3.412 11.671 -2.577 1.00 0.87 H new ATOM 0 HD2 PHE A 262 2.613 9.274 -6.005 1.00 0.84 H new ATOM 0 HE1 PHE A 262 3.178 13.703 -3.950 1.00 1.13 H new ATOM 0 HE2 PHE A 262 2.389 11.297 -7.368 1.00 1.09 H new ATOM 0 HZ PHE A 262 3.028 13.460 -6.447 1.00 1.18 H new ATOM 903 N GLU A 263 2.218 9.327 -0.134 1.00 0.26 N ATOM 904 CA GLU A 263 2.319 10.187 1.039 1.00 0.30 C ATOM 905 C GLU A 263 3.414 9.660 1.961 1.00 0.28 C ATOM 906 O GLU A 263 3.435 8.478 2.281 1.00 0.33 O ATOM 907 CB GLU A 263 0.979 10.257 1.775 1.00 0.37 C ATOM 908 CG GLU A 263 0.991 11.191 2.976 1.00 0.56 C ATOM 909 CD GLU A 263 -0.387 11.410 3.563 1.00 1.07 C ATOM 910 OE1 GLU A 263 -1.269 11.929 2.850 1.00 1.79 O ATOM 911 OE2 GLU A 263 -0.596 11.058 4.745 1.00 1.73 O ATOM 0 H GLU A 263 2.509 8.362 0.025 1.00 0.26 H new ATOM 0 HA GLU A 263 2.577 11.197 0.720 1.00 0.30 H new ATOM 0 HB2 GLU A 263 0.208 10.585 1.078 1.00 0.37 H new ATOM 0 HB3 GLU A 263 0.704 9.256 2.107 1.00 0.37 H new ATOM 0 HG2 GLU A 263 1.647 10.780 3.744 1.00 0.56 H new ATOM 0 HG3 GLU A 263 1.411 12.152 2.679 1.00 0.56 H new ATOM 918 N SER A 264 4.401 10.487 2.263 1.00 0.34 N ATOM 919 CA SER A 264 5.551 10.027 3.027 1.00 0.36 C ATOM 920 C SER A 264 5.630 10.748 4.370 1.00 0.34 C ATOM 921 O SER A 264 5.544 11.975 4.432 1.00 0.39 O ATOM 922 CB SER A 264 6.834 10.262 2.225 1.00 0.46 C ATOM 923 OG SER A 264 7.829 9.302 2.550 1.00 1.41 O ATOM 0 H SER A 264 4.431 11.471 1.995 1.00 0.34 H new ATOM 0 HA SER A 264 5.438 8.960 3.218 1.00 0.36 H new ATOM 0 HB2 SER A 264 6.613 10.213 1.159 1.00 0.46 H new ATOM 0 HB3 SER A 264 7.213 11.264 2.426 1.00 0.46 H new ATOM 0 HG SER A 264 8.636 9.476 2.022 1.00 1.41 H new ATOM 929 N ILE A 265 5.755 9.983 5.445 1.00 0.31 N ATOM 930 CA ILE A 265 5.831 10.558 6.782 1.00 0.34 C ATOM 931 C ILE A 265 7.088 10.078 7.501 1.00 0.38 C ATOM 932 O ILE A 265 7.141 8.940 7.976 1.00 0.42 O ATOM 933 CB ILE A 265 4.597 10.200 7.649 1.00 0.42 C ATOM 934 CG1 ILE A 265 3.289 10.561 6.936 1.00 0.82 C ATOM 935 CG2 ILE A 265 4.671 10.915 8.994 1.00 0.73 C ATOM 936 CD1 ILE A 265 2.780 9.491 5.993 1.00 1.31 C ATOM 0 H ILE A 265 5.806 8.965 5.419 1.00 0.31 H new ATOM 0 HA ILE A 265 5.859 11.640 6.652 1.00 0.34 H new ATOM 0 HB ILE A 265 4.607 9.122 7.813 1.00 0.42 H new ATOM 0 HG12 ILE A 265 2.524 10.763 7.685 1.00 0.82 H new ATOM 0 HG13 ILE A 265 3.437 11.484 6.375 1.00 0.82 H new ATOM 0 HG21 ILE A 265 3.798 10.655 9.593 1.00 0.73 H new ATOM 0 HG22 ILE A 265 5.576 10.609 9.519 1.00 0.73 H new ATOM 0 HG23 ILE A 265 4.692 11.993 8.832 1.00 0.73 H new ATOM 0 HD11 ILE A 265 1.852 9.826 5.530 1.00 1.31 H new ATOM 0 HD12 ILE A 265 3.524 9.304 5.219 1.00 1.31 H new ATOM 0 HD13 ILE A 265 2.597 8.572 6.550 1.00 1.31 H new ATOM 948 N GLY A 266 8.079 10.965 7.610 1.00 0.48 N ATOM 949 CA GLY A 266 9.309 10.643 8.319 1.00 0.65 C ATOM 950 C GLY A 266 9.890 9.310 7.896 1.00 0.86 C ATOM 951 O GLY A 266 9.939 8.379 8.700 1.00 1.93 O ATOM 0 H GLY A 266 8.050 11.906 7.217 1.00 0.48 H new ATOM 0 HA2 GLY A 266 10.043 11.429 8.141 1.00 0.65 H new ATOM 0 HA3 GLY A 266 9.113 10.627 9.391 1.00 0.65 H new ATOM 955 N ALA A 267 10.141 9.178 6.593 1.00 0.48 N ATOM 956 CA ALA A 267 10.567 7.917 5.975 1.00 0.39 C ATOM 957 C ALA A 267 9.407 6.963 5.793 1.00 0.30 C ATOM 958 O ALA A 267 9.364 6.231 4.805 1.00 0.32 O ATOM 959 CB ALA A 267 11.656 7.212 6.760 1.00 0.44 C ATOM 0 H ALA A 267 10.054 9.948 5.930 1.00 0.48 H new ATOM 0 HA ALA A 267 10.970 8.198 5.002 1.00 0.39 H new ATOM 0 HB1 ALA A 267 11.929 6.286 6.253 1.00 0.44 H new ATOM 0 HB2 ALA A 267 12.531 7.859 6.830 1.00 0.44 H new ATOM 0 HB3 ALA A 267 11.293 6.984 7.762 1.00 0.44 H new ATOM 965 N LYS A 268 8.516 6.893 6.775 1.00 0.26 N ATOM 966 CA LYS A 268 7.419 5.950 6.702 1.00 0.25 C ATOM 967 C LYS A 268 6.520 6.309 5.539 1.00 0.29 C ATOM 968 O LYS A 268 5.845 7.344 5.541 1.00 0.47 O ATOM 969 CB LYS A 268 6.625 5.906 8.008 1.00 0.28 C ATOM 970 CG LYS A 268 7.427 5.367 9.179 1.00 0.30 C ATOM 971 CD LYS A 268 6.551 5.163 10.403 1.00 0.41 C ATOM 972 CE LYS A 268 7.380 4.845 11.639 1.00 1.20 C ATOM 973 NZ LYS A 268 8.227 5.995 12.045 1.00 2.00 N ATOM 0 H LYS A 268 8.534 7.470 7.616 1.00 0.26 H new ATOM 0 HA LYS A 268 7.832 4.954 6.544 1.00 0.25 H new ATOM 0 HB2 LYS A 268 6.276 6.910 8.247 1.00 0.28 H new ATOM 0 HB3 LYS A 268 5.740 5.286 7.866 1.00 0.28 H new ATOM 0 HG2 LYS A 268 7.891 4.421 8.900 1.00 0.30 H new ATOM 0 HG3 LYS A 268 8.234 6.059 9.419 1.00 0.30 H new ATOM 0 HD2 LYS A 268 5.960 6.061 10.582 1.00 0.41 H new ATOM 0 HD3 LYS A 268 5.848 4.351 10.217 1.00 0.41 H new ATOM 0 HE2 LYS A 268 6.718 4.573 12.461 1.00 1.20 H new ATOM 0 HE3 LYS A 268 8.013 3.980 11.440 1.00 1.20 H new ATOM 0 HZ1 LYS A 268 8.550 5.860 13.024 1.00 2.00 H new ATOM 0 HZ2 LYS A 268 9.052 6.058 11.415 1.00 2.00 H new ATOM 0 HZ3 LYS A 268 7.674 6.873 11.981 1.00 2.00 H new ATOM 987 N ARG A 269 6.588 5.490 4.508 1.00 0.16 N ATOM 988 CA ARG A 269 5.841 5.735 3.308 1.00 0.16 C ATOM 989 C ARG A 269 4.414 5.242 3.458 1.00 0.18 C ATOM 990 O ARG A 269 4.152 4.244 4.113 1.00 0.17 O ATOM 991 CB ARG A 269 6.512 5.080 2.099 1.00 0.20 C ATOM 992 CG ARG A 269 5.748 5.313 0.822 1.00 0.53 C ATOM 993 CD ARG A 269 5.471 6.800 0.618 1.00 0.79 C ATOM 994 NE ARG A 269 6.694 7.591 0.448 1.00 0.69 N ATOM 995 CZ ARG A 269 7.205 7.933 -0.734 1.00 0.97 C ATOM 996 NH1 ARG A 269 6.572 7.607 -1.854 1.00 1.85 N ATOM 997 NH2 ARG A 269 8.332 8.632 -0.795 1.00 1.17 N ATOM 0 H ARG A 269 7.160 4.645 4.486 1.00 0.16 H new ATOM 0 HA ARG A 269 5.819 6.812 3.139 1.00 0.16 H new ATOM 0 HB2 ARG A 269 7.523 5.473 1.991 1.00 0.20 H new ATOM 0 HB3 ARG A 269 6.603 4.008 2.274 1.00 0.20 H new ATOM 0 HG2 ARG A 269 6.317 4.926 -0.023 1.00 0.53 H new ATOM 0 HG3 ARG A 269 4.807 4.764 0.851 1.00 0.53 H new ATOM 0 HD2 ARG A 269 4.836 6.929 -0.259 1.00 0.79 H new ATOM 0 HD3 ARG A 269 4.914 7.181 1.474 1.00 0.79 H new ATOM 0 HE ARG A 269 7.184 7.899 1.288 1.00 0.69 H new ATOM 0 HH11 ARG A 269 5.692 7.093 -1.811 1.00 1.85 H new ATOM 0 HH12 ARG A 269 6.966 7.870 -2.757 1.00 1.85 H new ATOM 0 HH21 ARG A 269 8.808 8.908 0.064 1.00 1.17 H new ATOM 0 HH22 ARG A 269 8.722 8.893 -1.701 1.00 1.17 H new ATOM 1011 N THR A 270 3.493 5.985 2.897 1.00 0.18 N ATOM 1012 CA THR A 270 2.103 5.629 2.950 1.00 0.18 C ATOM 1013 C THR A 270 1.449 5.790 1.584 1.00 0.19 C ATOM 1014 O THR A 270 1.556 6.843 0.931 1.00 0.22 O ATOM 1015 CB THR A 270 1.360 6.480 3.991 1.00 0.20 C ATOM 1016 OG1 THR A 270 1.878 6.214 5.301 1.00 0.25 O ATOM 1017 CG2 THR A 270 -0.125 6.193 3.959 1.00 0.24 C ATOM 0 H THR A 270 3.688 6.850 2.393 1.00 0.18 H new ATOM 0 HA THR A 270 2.040 4.582 3.246 1.00 0.18 H new ATOM 0 HB THR A 270 1.515 7.531 3.748 1.00 0.20 H new ATOM 0 HG1 THR A 270 1.239 5.663 5.800 1.00 0.25 H new ATOM 0 HG21 THR A 270 -0.630 6.807 4.704 1.00 0.24 H new ATOM 0 HG22 THR A 270 -0.519 6.425 2.970 1.00 0.24 H new ATOM 0 HG23 THR A 270 -0.297 5.140 4.180 1.00 0.24 H new ATOM 1025 N LEU A 271 0.779 4.731 1.166 1.00 0.17 N ATOM 1026 CA LEU A 271 0.055 4.726 -0.088 1.00 0.17 C ATOM 1027 C LEU A 271 -1.403 5.092 0.177 1.00 0.16 C ATOM 1028 O LEU A 271 -2.180 4.267 0.637 1.00 0.17 O ATOM 1029 CB LEU A 271 0.166 3.334 -0.717 1.00 0.20 C ATOM 1030 CG LEU A 271 -0.239 3.196 -2.185 1.00 0.26 C ATOM 1031 CD1 LEU A 271 -1.730 2.958 -2.319 1.00 0.56 C ATOM 1032 CD2 LEU A 271 0.195 4.419 -2.974 1.00 0.49 C ATOM 0 H LEU A 271 0.723 3.855 1.685 1.00 0.17 H new ATOM 0 HA LEU A 271 0.475 5.457 -0.779 1.00 0.17 H new ATOM 0 HB2 LEU A 271 1.199 3.000 -0.619 1.00 0.20 H new ATOM 0 HB3 LEU A 271 -0.447 2.649 -0.132 1.00 0.20 H new ATOM 0 HG LEU A 271 0.271 2.326 -2.600 1.00 0.26 H new ATOM 0 HD11 LEU A 271 -1.990 2.864 -3.373 1.00 0.56 H new ATOM 0 HD12 LEU A 271 -2.001 2.041 -1.795 1.00 0.56 H new ATOM 0 HD13 LEU A 271 -2.273 3.798 -1.885 1.00 0.56 H new ATOM 0 HD21 LEU A 271 -0.101 4.303 -4.017 1.00 0.49 H new ATOM 0 HD22 LEU A 271 -0.280 5.308 -2.558 1.00 0.49 H new ATOM 0 HD23 LEU A 271 1.278 4.525 -2.914 1.00 0.49 H new ATOM 1044 N THR A 272 -1.767 6.326 -0.099 1.00 0.18 N ATOM 1045 CA THR A 272 -3.128 6.775 0.118 1.00 0.21 C ATOM 1046 C THR A 272 -4.039 6.270 -0.994 1.00 0.22 C ATOM 1047 O THR A 272 -3.935 6.688 -2.141 1.00 0.29 O ATOM 1048 CB THR A 272 -3.193 8.310 0.183 1.00 0.27 C ATOM 1049 OG1 THR A 272 -2.092 8.806 0.958 1.00 0.33 O ATOM 1050 CG2 THR A 272 -4.496 8.766 0.812 1.00 0.30 C ATOM 0 H THR A 272 -1.140 7.038 -0.474 1.00 0.18 H new ATOM 0 HA THR A 272 -3.468 6.369 1.071 1.00 0.21 H new ATOM 0 HB THR A 272 -3.138 8.702 -0.833 1.00 0.27 H new ATOM 0 HG1 THR A 272 -2.134 9.784 0.997 1.00 0.33 H new ATOM 0 HG21 THR A 272 -4.521 9.855 0.848 1.00 0.30 H new ATOM 0 HG22 THR A 272 -5.334 8.403 0.217 1.00 0.30 H new ATOM 0 HG23 THR A 272 -4.571 8.368 1.824 1.00 0.30 H new ATOM 1058 N ILE A 273 -4.897 5.334 -0.664 1.00 0.23 N ATOM 1059 CA ILE A 273 -5.793 4.767 -1.643 1.00 0.26 C ATOM 1060 C ILE A 273 -7.186 5.357 -1.492 1.00 0.28 C ATOM 1061 O ILE A 273 -7.776 5.347 -0.402 1.00 0.27 O ATOM 1062 CB ILE A 273 -5.809 3.223 -1.554 1.00 0.31 C ATOM 1063 CG1 ILE A 273 -5.138 2.639 -2.791 1.00 0.41 C ATOM 1064 CG2 ILE A 273 -7.220 2.667 -1.397 1.00 0.32 C ATOM 1065 CD1 ILE A 273 -4.888 1.155 -2.695 1.00 0.86 C ATOM 0 H ILE A 273 -4.993 4.949 0.276 1.00 0.23 H new ATOM 0 HA ILE A 273 -5.429 5.026 -2.637 1.00 0.26 H new ATOM 0 HB ILE A 273 -5.256 2.931 -0.661 1.00 0.31 H new ATOM 0 HG12 ILE A 273 -5.762 2.839 -3.662 1.00 0.41 H new ATOM 0 HG13 ILE A 273 -4.189 3.150 -2.955 1.00 0.41 H new ATOM 0 HG21 ILE A 273 -7.178 1.579 -1.339 1.00 0.32 H new ATOM 0 HG22 ILE A 273 -7.667 3.062 -0.485 1.00 0.32 H new ATOM 0 HG23 ILE A 273 -7.825 2.962 -2.255 1.00 0.32 H new ATOM 0 HD11 ILE A 273 -4.408 0.807 -3.610 1.00 0.86 H new ATOM 0 HD12 ILE A 273 -4.239 0.950 -1.844 1.00 0.86 H new ATOM 0 HD13 ILE A 273 -5.836 0.634 -2.562 1.00 0.86 H new ATOM 1077 N SER A 274 -7.671 5.926 -2.580 1.00 0.33 N ATOM 1078 CA SER A 274 -8.965 6.560 -2.611 1.00 0.39 C ATOM 1079 C SER A 274 -9.898 5.762 -3.511 1.00 0.45 C ATOM 1080 O SER A 274 -9.455 5.207 -4.511 1.00 0.50 O ATOM 1081 CB SER A 274 -8.823 7.999 -3.114 1.00 0.52 C ATOM 1082 OG SER A 274 -10.056 8.696 -3.094 1.00 1.13 O ATOM 0 H SER A 274 -7.172 5.959 -3.469 1.00 0.33 H new ATOM 0 HA SER A 274 -9.387 6.587 -1.606 1.00 0.39 H new ATOM 0 HB2 SER A 274 -8.098 8.528 -2.496 1.00 0.52 H new ATOM 0 HB3 SER A 274 -8.429 7.990 -4.130 1.00 0.52 H new ATOM 0 HG SER A 274 -9.920 9.610 -3.421 1.00 1.13 H new ATOM 1088 N GLN A 275 -11.171 5.672 -3.128 1.00 0.51 N ATOM 1089 CA GLN A 275 -12.166 4.917 -3.894 1.00 0.62 C ATOM 1090 C GLN A 275 -11.754 3.452 -4.017 1.00 0.62 C ATOM 1091 O GLN A 275 -11.529 2.948 -5.119 1.00 0.74 O ATOM 1092 CB GLN A 275 -12.376 5.527 -5.285 1.00 0.75 C ATOM 1093 CG GLN A 275 -12.673 7.019 -5.269 1.00 0.90 C ATOM 1094 CD GLN A 275 -12.948 7.580 -6.654 1.00 1.53 C ATOM 1095 OE1 GLN A 275 -13.138 6.700 -7.627 1.00 2.14 O flip ATOM 1096 NE2 GLN A 275 -13.011 8.795 -6.843 1.00 2.27 N flip ATOM 0 H GLN A 275 -11.541 6.115 -2.287 1.00 0.51 H new ATOM 0 HA GLN A 275 -13.111 4.971 -3.353 1.00 0.62 H new ATOM 0 HB2 GLN A 275 -11.484 5.351 -5.886 1.00 0.75 H new ATOM 0 HB3 GLN A 275 -13.199 5.009 -5.777 1.00 0.75 H new ATOM 0 HG2 GLN A 275 -13.535 7.206 -4.629 1.00 0.90 H new ATOM 0 HG3 GLN A 275 -11.828 7.548 -4.829 1.00 0.90 H new ATOM 0 HE21 GLN A 275 -12.859 9.440 -6.068 1.00 2.27 H new ATOM 0 HE22 GLN A 275 -13.216 9.156 -7.775 1.00 2.27 H new ATOM 1105 N CYS A 276 -11.709 2.767 -2.882 1.00 0.60 N ATOM 1106 CA CYS A 276 -11.351 1.357 -2.840 1.00 0.69 C ATOM 1107 C CYS A 276 -12.088 0.724 -1.691 1.00 0.75 C ATOM 1108 O CYS A 276 -11.502 0.309 -0.692 1.00 1.27 O ATOM 1109 CB CYS A 276 -9.841 1.169 -2.682 1.00 0.80 C ATOM 1110 SG CYS A 276 -8.876 1.568 -4.161 1.00 2.00 S ATOM 0 H CYS A 276 -11.919 3.171 -1.969 1.00 0.60 H new ATOM 0 HA CYS A 276 -11.633 0.880 -3.779 1.00 0.69 H new ATOM 0 HB2 CYS A 276 -9.494 1.793 -1.858 1.00 0.80 H new ATOM 0 HB3 CYS A 276 -9.644 0.134 -2.403 1.00 0.80 H new ATOM 0 HG CYS A 276 -9.058 0.647 -5.060 1.00 2.00 H new ATOM 1116 N SER A 277 -13.390 0.869 -1.758 1.00 0.54 N ATOM 1117 CA SER A 277 -14.253 0.504 -0.675 1.00 0.52 C ATOM 1118 C SER A 277 -14.682 -0.962 -0.787 1.00 0.48 C ATOM 1119 O SER A 277 -13.838 -1.847 -0.951 1.00 0.47 O ATOM 1120 CB SER A 277 -15.449 1.448 -0.677 1.00 0.56 C ATOM 1121 OG SER A 277 -15.955 1.631 -1.987 1.00 0.63 O ATOM 0 H SER A 277 -13.877 1.246 -2.572 1.00 0.54 H new ATOM 0 HA SER A 277 -13.725 0.599 0.274 1.00 0.52 H new ATOM 0 HB2 SER A 277 -16.233 1.047 -0.034 1.00 0.56 H new ATOM 0 HB3 SER A 277 -15.156 2.411 -0.260 1.00 0.56 H new ATOM 0 HG SER A 277 -16.723 2.240 -1.959 1.00 0.63 H new ATOM 1127 N LEU A 278 -15.991 -1.216 -0.695 1.00 0.51 N ATOM 1128 CA LEU A 278 -16.541 -2.572 -0.743 1.00 0.54 C ATOM 1129 C LEU A 278 -16.441 -3.187 -2.145 1.00 0.58 C ATOM 1130 O LEU A 278 -17.448 -3.605 -2.723 1.00 0.71 O ATOM 1131 CB LEU A 278 -18.008 -2.569 -0.286 1.00 0.63 C ATOM 1132 CG LEU A 278 -18.251 -2.750 1.220 1.00 0.78 C ATOM 1133 CD1 LEU A 278 -17.748 -4.107 1.685 1.00 1.22 C ATOM 1134 CD2 LEU A 278 -17.594 -1.639 2.019 1.00 0.79 C ATOM 0 H LEU A 278 -16.697 -0.488 -0.585 1.00 0.51 H new ATOM 0 HA LEU A 278 -15.945 -3.184 -0.066 1.00 0.54 H new ATOM 0 HB2 LEU A 278 -18.461 -1.627 -0.595 1.00 0.63 H new ATOM 0 HB3 LEU A 278 -18.533 -3.364 -0.815 1.00 0.63 H new ATOM 0 HG LEU A 278 -19.326 -2.700 1.393 1.00 0.78 H new ATOM 0 HD11 LEU A 278 -17.929 -4.215 2.754 1.00 1.22 H new ATOM 0 HD12 LEU A 278 -18.275 -4.895 1.146 1.00 1.22 H new ATOM 0 HD13 LEU A 278 -16.679 -4.185 1.489 1.00 1.22 H new ATOM 0 HD21 LEU A 278 -17.783 -1.794 3.081 1.00 0.79 H new ATOM 0 HD22 LEU A 278 -16.519 -1.646 1.837 1.00 0.79 H new ATOM 0 HD23 LEU A 278 -18.007 -0.678 1.713 1.00 0.79 H new ATOM 1146 N ALA A 279 -15.232 -3.246 -2.681 1.00 0.53 N ATOM 1147 CA ALA A 279 -15.001 -3.812 -4.002 1.00 0.61 C ATOM 1148 C ALA A 279 -13.534 -4.172 -4.189 1.00 0.58 C ATOM 1149 O ALA A 279 -13.209 -5.232 -4.721 1.00 0.62 O ATOM 1150 CB ALA A 279 -15.447 -2.841 -5.084 1.00 0.71 C ATOM 0 H ALA A 279 -14.389 -2.906 -2.218 1.00 0.53 H new ATOM 0 HA ALA A 279 -15.591 -4.724 -4.086 1.00 0.61 H new ATOM 0 HB1 ALA A 279 -15.267 -3.281 -6.065 1.00 0.71 H new ATOM 0 HB2 ALA A 279 -16.511 -2.633 -4.970 1.00 0.71 H new ATOM 0 HB3 ALA A 279 -14.884 -1.912 -4.994 1.00 0.71 H new ATOM 1156 N ASP A 280 -12.650 -3.279 -3.760 1.00 0.56 N ATOM 1157 CA ASP A 280 -11.211 -3.493 -3.898 1.00 0.59 C ATOM 1158 C ASP A 280 -10.696 -4.457 -2.833 1.00 0.50 C ATOM 1159 O ASP A 280 -9.511 -4.795 -2.809 1.00 0.70 O ATOM 1160 CB ASP A 280 -10.454 -2.165 -3.809 1.00 0.70 C ATOM 1161 CG ASP A 280 -10.701 -1.264 -5.003 1.00 1.21 C ATOM 1162 OD1 ASP A 280 -11.863 -0.852 -5.221 1.00 1.84 O ATOM 1163 OD2 ASP A 280 -9.739 -0.970 -5.743 1.00 1.77 O ATOM 0 H ASP A 280 -12.903 -2.398 -3.313 1.00 0.56 H new ATOM 0 HA ASP A 280 -11.035 -3.934 -4.879 1.00 0.59 H new ATOM 0 HB2 ASP A 280 -10.751 -1.644 -2.899 1.00 0.70 H new ATOM 0 HB3 ASP A 280 -9.386 -2.366 -3.727 1.00 0.70 H new ATOM 1168 N ASP A 281 -11.604 -4.890 -1.961 1.00 0.37 N ATOM 1169 CA ASP A 281 -11.289 -5.847 -0.896 1.00 0.33 C ATOM 1170 C ASP A 281 -10.611 -7.089 -1.480 1.00 0.34 C ATOM 1171 O ASP A 281 -11.205 -7.799 -2.296 1.00 0.43 O ATOM 1172 CB ASP A 281 -12.589 -6.232 -0.177 1.00 0.40 C ATOM 1173 CG ASP A 281 -12.390 -7.145 1.023 1.00 0.52 C ATOM 1174 OD1 ASP A 281 -11.851 -8.261 0.836 1.00 0.81 O ATOM 1175 OD2 ASP A 281 -12.718 -6.734 2.159 1.00 1.12 O ATOM 0 H ASP A 281 -12.579 -4.589 -1.970 1.00 0.37 H new ATOM 0 HA ASP A 281 -10.600 -5.391 -0.185 1.00 0.33 H new ATOM 0 HB2 ASP A 281 -13.092 -5.323 0.152 1.00 0.40 H new ATOM 0 HB3 ASP A 281 -13.252 -6.724 -0.888 1.00 0.40 H new ATOM 1180 N ALA A 282 -9.346 -7.295 -1.116 1.00 0.31 N ATOM 1181 CA ALA A 282 -8.533 -8.383 -1.670 1.00 0.37 C ATOM 1182 C ALA A 282 -7.181 -8.440 -0.958 1.00 0.35 C ATOM 1183 O ALA A 282 -7.130 -8.647 0.249 1.00 0.58 O ATOM 1184 CB ALA A 282 -8.339 -8.201 -3.173 1.00 0.48 C ATOM 0 H ALA A 282 -8.856 -6.718 -0.433 1.00 0.31 H new ATOM 0 HA ALA A 282 -9.056 -9.326 -1.508 1.00 0.37 H new ATOM 0 HB1 ALA A 282 -7.733 -9.019 -3.563 1.00 0.48 H new ATOM 0 HB2 ALA A 282 -9.310 -8.201 -3.668 1.00 0.48 H new ATOM 0 HB3 ALA A 282 -7.835 -7.253 -3.363 1.00 0.48 H new ATOM 1190 N ALA A 283 -6.103 -8.153 -1.687 1.00 0.22 N ATOM 1191 CA ALA A 283 -4.776 -8.022 -1.087 1.00 0.17 C ATOM 1192 C ALA A 283 -3.947 -7.036 -1.895 1.00 0.15 C ATOM 1193 O ALA A 283 -3.902 -7.127 -3.121 1.00 0.19 O ATOM 1194 CB ALA A 283 -4.073 -9.370 -1.003 1.00 0.22 C ATOM 0 H ALA A 283 -6.123 -8.007 -2.696 1.00 0.22 H new ATOM 0 HA ALA A 283 -4.890 -7.647 -0.070 1.00 0.17 H new ATOM 0 HB1 ALA A 283 -3.089 -9.240 -0.553 1.00 0.22 H new ATOM 0 HB2 ALA A 283 -4.665 -10.051 -0.392 1.00 0.22 H new ATOM 0 HB3 ALA A 283 -3.961 -9.785 -2.005 1.00 0.22 H new ATOM 1200 N TYR A 284 -3.294 -6.096 -1.221 1.00 0.12 N ATOM 1201 CA TYR A 284 -2.456 -5.119 -1.910 1.00 0.13 C ATOM 1202 C TYR A 284 -1.007 -5.227 -1.438 1.00 0.14 C ATOM 1203 O TYR A 284 -0.681 -4.914 -0.300 1.00 0.16 O ATOM 1204 CB TYR A 284 -2.992 -3.672 -1.747 1.00 0.15 C ATOM 1205 CG TYR A 284 -4.198 -3.366 -2.636 1.00 0.19 C ATOM 1206 CD1 TYR A 284 -5.107 -4.360 -3.021 1.00 0.22 C ATOM 1207 CD2 TYR A 284 -4.444 -2.069 -3.074 1.00 0.26 C ATOM 1208 CE1 TYR A 284 -6.203 -4.050 -3.812 1.00 0.29 C ATOM 1209 CE2 TYR A 284 -5.538 -1.762 -3.852 1.00 0.32 C ATOM 1210 CZ TYR A 284 -6.381 -2.859 -4.299 1.00 0.35 C ATOM 1211 OH TYR A 284 -7.512 -2.440 -4.985 1.00 0.41 O ATOM 0 H TYR A 284 -3.327 -5.989 -0.207 1.00 0.12 H new ATOM 0 HA TYR A 284 -2.491 -5.351 -2.975 1.00 0.13 H new ATOM 0 HB2 TYR A 284 -3.268 -3.510 -0.705 1.00 0.15 H new ATOM 0 HB3 TYR A 284 -2.192 -2.968 -1.978 1.00 0.15 H new ATOM 0 HD1 TYR A 284 -4.952 -5.379 -2.698 1.00 0.22 H new ATOM 0 HD2 TYR A 284 -3.759 -1.282 -2.797 1.00 0.26 H new ATOM 0 HE1 TYR A 284 -6.929 -4.820 -4.029 1.00 0.29 H new ATOM 0 HE2 TYR A 284 -5.762 -0.740 -4.121 1.00 0.32 H new ATOM 0 HH TYR A 284 -7.731 -1.521 -4.725 1.00 0.41 H new ATOM 1221 N GLN A 285 -0.148 -5.694 -2.332 1.00 0.13 N ATOM 1222 CA GLN A 285 1.264 -5.849 -2.053 1.00 0.13 C ATOM 1223 C GLN A 285 1.986 -4.508 -2.190 1.00 0.12 C ATOM 1224 O GLN A 285 1.424 -3.541 -2.698 1.00 0.13 O ATOM 1225 CB GLN A 285 1.892 -6.877 -3.005 1.00 0.12 C ATOM 1226 CG GLN A 285 1.237 -8.251 -2.975 1.00 0.15 C ATOM 1227 CD GLN A 285 0.015 -8.378 -3.877 1.00 0.21 C ATOM 1228 OE1 GLN A 285 -0.201 -7.411 -4.759 1.00 0.29 O flip ATOM 1229 NE2 GLN A 285 -0.714 -9.366 -3.805 1.00 0.18 N flip ATOM 0 H GLN A 285 -0.416 -5.976 -3.275 1.00 0.13 H new ATOM 0 HA GLN A 285 1.371 -6.206 -1.029 1.00 0.13 H new ATOM 0 HB2 GLN A 285 1.844 -6.488 -4.022 1.00 0.12 H new ATOM 0 HB3 GLN A 285 2.947 -6.987 -2.756 1.00 0.12 H new ATOM 0 HG2 GLN A 285 1.973 -8.999 -3.271 1.00 0.15 H new ATOM 0 HG3 GLN A 285 0.944 -8.480 -1.950 1.00 0.15 H new ATOM 0 HE21 GLN A 285 -0.521 -10.093 -3.116 1.00 0.18 H new ATOM 0 HE22 GLN A 285 -1.511 -9.459 -4.435 1.00 0.18 H new ATOM 1238 N CYS A 286 3.213 -4.444 -1.698 1.00 0.14 N ATOM 1239 CA CYS A 286 3.981 -3.202 -1.721 1.00 0.19 C ATOM 1240 C CYS A 286 5.300 -3.390 -2.414 1.00 0.19 C ATOM 1241 O CYS A 286 5.867 -4.470 -2.355 1.00 0.20 O ATOM 1242 CB CYS A 286 4.211 -2.731 -0.323 1.00 0.28 C ATOM 1243 SG CYS A 286 5.216 -3.831 0.700 1.00 1.00 S ATOM 0 H CYS A 286 3.701 -5.235 -1.278 1.00 0.14 H new ATOM 0 HA CYS A 286 3.409 -2.457 -2.275 1.00 0.19 H new ATOM 0 HB2 CYS A 286 4.692 -1.754 -0.360 1.00 0.28 H new ATOM 0 HB3 CYS A 286 3.244 -2.592 0.161 1.00 0.28 H new ATOM 0 HG CYS A 286 6.372 -3.280 0.923 1.00 1.00 H new ATOM 1249 N VAL A 287 5.655 -2.447 -3.276 1.00 0.20 N ATOM 1250 CA VAL A 287 6.710 -2.720 -4.224 1.00 0.21 C ATOM 1251 C VAL A 287 7.613 -1.511 -4.510 1.00 0.22 C ATOM 1252 O VAL A 287 7.167 -0.375 -4.702 1.00 0.24 O ATOM 1253 CB VAL A 287 6.087 -3.304 -5.525 1.00 0.21 C ATOM 1254 CG1 VAL A 287 4.591 -3.559 -5.316 1.00 0.18 C ATOM 1255 CG2 VAL A 287 6.315 -2.416 -6.740 1.00 0.27 C ATOM 0 H VAL A 287 5.240 -1.517 -3.335 1.00 0.20 H new ATOM 0 HA VAL A 287 7.376 -3.457 -3.775 1.00 0.21 H new ATOM 0 HB VAL A 287 6.594 -4.246 -5.732 1.00 0.21 H new ATOM 0 HG11 VAL A 287 4.160 -3.968 -6.230 1.00 0.18 H new ATOM 0 HG12 VAL A 287 4.453 -4.269 -4.501 1.00 0.18 H new ATOM 0 HG13 VAL A 287 4.093 -2.621 -5.068 1.00 0.18 H new ATOM 0 HG21 VAL A 287 5.858 -2.875 -7.617 1.00 0.27 H new ATOM 0 HG22 VAL A 287 5.865 -1.439 -6.566 1.00 0.27 H new ATOM 0 HG23 VAL A 287 7.385 -2.298 -6.908 1.00 0.27 H new ATOM 1265 N VAL A 288 8.904 -1.779 -4.543 1.00 0.24 N ATOM 1266 CA VAL A 288 9.892 -0.764 -4.855 1.00 0.26 C ATOM 1267 C VAL A 288 10.895 -1.324 -5.850 1.00 0.33 C ATOM 1268 O VAL A 288 11.535 -2.348 -5.589 1.00 0.37 O ATOM 1269 CB VAL A 288 10.633 -0.269 -3.591 1.00 0.27 C ATOM 1270 CG1 VAL A 288 11.849 0.556 -3.965 1.00 0.31 C ATOM 1271 CG2 VAL A 288 9.705 0.548 -2.707 1.00 0.36 C ATOM 0 H VAL A 288 9.296 -2.702 -4.355 1.00 0.24 H new ATOM 0 HA VAL A 288 9.369 0.090 -5.286 1.00 0.26 H new ATOM 0 HB VAL A 288 10.964 -1.146 -3.035 1.00 0.27 H new ATOM 0 HG11 VAL A 288 12.353 0.893 -3.059 1.00 0.31 H new ATOM 0 HG12 VAL A 288 12.533 -0.052 -4.556 1.00 0.31 H new ATOM 0 HG13 VAL A 288 11.536 1.422 -4.549 1.00 0.31 H new ATOM 0 HG21 VAL A 288 10.248 0.886 -1.824 1.00 0.36 H new ATOM 0 HG22 VAL A 288 9.341 1.413 -3.262 1.00 0.36 H new ATOM 0 HG23 VAL A 288 8.860 -0.068 -2.400 1.00 0.36 H new ATOM 1281 N GLY A 289 10.938 -0.715 -7.028 1.00 0.43 N ATOM 1282 CA GLY A 289 11.789 -1.200 -8.100 1.00 0.57 C ATOM 1283 C GLY A 289 11.208 -2.415 -8.797 1.00 0.73 C ATOM 1284 O GLY A 289 11.153 -2.472 -10.025 1.00 1.51 O ATOM 0 H GLY A 289 10.393 0.115 -7.263 1.00 0.43 H new ATOM 0 HA2 GLY A 289 11.939 -0.404 -8.829 1.00 0.57 H new ATOM 0 HA3 GLY A 289 12.770 -1.451 -7.696 1.00 0.57 H new ATOM 1288 N GLY A 290 10.756 -3.374 -8.008 1.00 0.41 N ATOM 1289 CA GLY A 290 10.175 -4.588 -8.546 1.00 0.41 C ATOM 1290 C GLY A 290 9.685 -5.505 -7.445 1.00 0.37 C ATOM 1291 O GLY A 290 8.678 -6.194 -7.598 1.00 0.64 O ATOM 0 H GLY A 290 10.781 -3.333 -6.989 1.00 0.41 H new ATOM 0 HA2 GLY A 290 9.345 -4.334 -9.205 1.00 0.41 H new ATOM 0 HA3 GLY A 290 10.916 -5.109 -9.152 1.00 0.41 H new ATOM 1295 N GLU A 291 10.402 -5.496 -6.328 1.00 0.27 N ATOM 1296 CA GLU A 291 10.058 -6.309 -5.168 1.00 0.22 C ATOM 1297 C GLU A 291 8.688 -5.937 -4.606 1.00 0.16 C ATOM 1298 O GLU A 291 8.490 -4.806 -4.187 1.00 0.19 O ATOM 1299 CB GLU A 291 11.112 -6.097 -4.083 1.00 0.26 C ATOM 1300 CG GLU A 291 12.281 -7.057 -4.155 1.00 0.53 C ATOM 1301 CD GLU A 291 13.340 -6.728 -3.129 1.00 1.48 C ATOM 1302 OE1 GLU A 291 14.010 -5.683 -3.279 1.00 2.11 O ATOM 1303 OE2 GLU A 291 13.478 -7.487 -2.149 1.00 2.19 O ATOM 0 H GLU A 291 11.238 -4.925 -6.201 1.00 0.27 H new ATOM 0 HA GLU A 291 10.026 -7.352 -5.482 1.00 0.22 H new ATOM 0 HB2 GLU A 291 11.490 -5.077 -4.154 1.00 0.26 H new ATOM 0 HB3 GLU A 291 10.637 -6.194 -3.107 1.00 0.26 H new ATOM 0 HG2 GLU A 291 11.926 -8.075 -3.997 1.00 0.53 H new ATOM 0 HG3 GLU A 291 12.718 -7.023 -5.153 1.00 0.53 H new ATOM 1310 N LYS A 292 7.807 -6.928 -4.477 1.00 0.18 N ATOM 1311 CA LYS A 292 6.491 -6.736 -3.862 1.00 0.16 C ATOM 1312 C LYS A 292 6.356 -7.559 -2.578 1.00 0.17 C ATOM 1313 O LYS A 292 6.878 -8.665 -2.495 1.00 0.29 O ATOM 1314 CB LYS A 292 5.384 -7.101 -4.847 1.00 0.18 C ATOM 1315 CG LYS A 292 5.626 -8.394 -5.594 1.00 0.23 C ATOM 1316 CD LYS A 292 4.538 -8.640 -6.616 1.00 0.29 C ATOM 1317 CE LYS A 292 4.895 -9.791 -7.543 1.00 0.49 C ATOM 1318 NZ LYS A 292 6.183 -9.555 -8.252 1.00 1.33 N ATOM 0 H LYS A 292 7.982 -7.882 -4.793 1.00 0.18 H new ATOM 0 HA LYS A 292 6.393 -5.683 -3.599 1.00 0.16 H new ATOM 0 HB2 LYS A 292 4.441 -7.177 -4.306 1.00 0.18 H new ATOM 0 HB3 LYS A 292 5.273 -6.292 -5.569 1.00 0.18 H new ATOM 0 HG2 LYS A 292 6.595 -8.355 -6.091 1.00 0.23 H new ATOM 0 HG3 LYS A 292 5.662 -9.224 -4.889 1.00 0.23 H new ATOM 0 HD2 LYS A 292 3.601 -8.860 -6.105 1.00 0.29 H new ATOM 0 HD3 LYS A 292 4.377 -7.735 -7.202 1.00 0.29 H new ATOM 0 HE2 LYS A 292 4.962 -10.714 -6.967 1.00 0.49 H new ATOM 0 HE3 LYS A 292 4.098 -9.929 -8.274 1.00 0.49 H new ATOM 0 HZ1 LYS A 292 6.223 -10.148 -9.106 1.00 1.33 H new ATOM 0 HZ2 LYS A 292 6.252 -8.553 -8.523 1.00 1.33 H new ATOM 0 HZ3 LYS A 292 6.975 -9.799 -7.624 1.00 1.33 H new ATOM 1332 N CYS A 293 5.695 -6.987 -1.572 1.00 0.16 N ATOM 1333 CA CYS A 293 5.429 -7.672 -0.305 1.00 0.18 C ATOM 1334 C CYS A 293 3.927 -7.729 -0.113 1.00 0.15 C ATOM 1335 O CYS A 293 3.255 -6.724 -0.311 1.00 0.14 O ATOM 1336 CB CYS A 293 6.048 -6.938 0.890 1.00 0.28 C ATOM 1337 SG CYS A 293 6.027 -7.896 2.422 1.00 1.55 S ATOM 0 H CYS A 293 5.328 -6.036 -1.611 1.00 0.16 H new ATOM 0 HA CYS A 293 5.873 -8.666 -0.350 1.00 0.18 H new ATOM 0 HB2 CYS A 293 7.078 -6.676 0.650 1.00 0.28 H new ATOM 0 HB3 CYS A 293 5.510 -6.003 1.049 1.00 0.28 H new ATOM 0 HG CYS A 293 5.837 -9.152 2.146 1.00 1.55 H new ATOM 1343 N SER A 294 3.390 -8.908 0.152 1.00 0.17 N ATOM 1344 CA SER A 294 1.945 -9.079 0.161 1.00 0.18 C ATOM 1345 C SER A 294 1.309 -8.606 1.458 1.00 0.17 C ATOM 1346 O SER A 294 1.773 -8.924 2.552 1.00 0.20 O ATOM 1347 CB SER A 294 1.573 -10.539 -0.074 1.00 0.27 C ATOM 1348 OG SER A 294 2.291 -11.096 -1.163 1.00 0.61 O ATOM 0 H SER A 294 3.924 -9.752 0.361 1.00 0.17 H new ATOM 0 HA SER A 294 1.558 -8.461 -0.649 1.00 0.18 H new ATOM 0 HB2 SER A 294 1.776 -11.116 0.828 1.00 0.27 H new ATOM 0 HB3 SER A 294 0.503 -10.615 -0.267 1.00 0.27 H new ATOM 0 HG SER A 294 1.825 -11.894 -1.488 1.00 0.61 H new ATOM 1354 N THR A 295 0.174 -7.944 1.315 1.00 0.17 N ATOM 1355 CA THR A 295 -0.630 -7.543 2.444 1.00 0.15 C ATOM 1356 C THR A 295 -2.098 -7.626 2.045 1.00 0.15 C ATOM 1357 O THR A 295 -2.454 -7.272 0.923 1.00 0.15 O ATOM 1358 CB THR A 295 -0.255 -6.117 2.924 1.00 0.18 C ATOM 1359 OG1 THR A 295 -0.050 -6.130 4.340 1.00 0.29 O ATOM 1360 CG2 THR A 295 -1.326 -5.085 2.573 1.00 0.20 C ATOM 0 H THR A 295 -0.212 -7.672 0.411 1.00 0.17 H new ATOM 0 HA THR A 295 -0.442 -8.213 3.283 1.00 0.15 H new ATOM 0 HB THR A 295 0.660 -5.827 2.408 1.00 0.18 H new ATOM 0 HG1 THR A 295 -0.256 -5.246 4.708 1.00 0.29 H new ATOM 0 HG21 THR A 295 -1.016 -4.103 2.930 1.00 0.20 H new ATOM 0 HG22 THR A 295 -1.459 -5.052 1.492 1.00 0.20 H new ATOM 0 HG23 THR A 295 -2.268 -5.363 3.046 1.00 0.20 H new ATOM 1368 N GLU A 296 -2.919 -8.233 2.886 1.00 0.15 N ATOM 1369 CA GLU A 296 -4.318 -8.429 2.545 1.00 0.15 C ATOM 1370 C GLU A 296 -5.077 -7.122 2.709 1.00 0.14 C ATOM 1371 O GLU A 296 -4.638 -6.230 3.431 1.00 0.19 O ATOM 1372 CB GLU A 296 -4.932 -9.532 3.400 1.00 0.18 C ATOM 1373 CG GLU A 296 -4.092 -10.794 3.409 1.00 0.22 C ATOM 1374 CD GLU A 296 -4.741 -11.936 4.165 1.00 0.34 C ATOM 1375 OE1 GLU A 296 -5.927 -12.231 3.899 1.00 0.96 O ATOM 1376 OE2 GLU A 296 -4.086 -12.526 5.045 1.00 0.76 O ATOM 0 H GLU A 296 -2.645 -8.595 3.800 1.00 0.15 H new ATOM 0 HA GLU A 296 -4.388 -8.742 1.503 1.00 0.15 H new ATOM 0 HB2 GLU A 296 -5.052 -9.171 4.422 1.00 0.18 H new ATOM 0 HB3 GLU A 296 -5.929 -9.765 3.026 1.00 0.18 H new ATOM 0 HG2 GLU A 296 -3.905 -11.106 2.381 1.00 0.22 H new ATOM 0 HG3 GLU A 296 -3.123 -10.575 3.856 1.00 0.22 H new ATOM 1383 N LEU A 297 -6.152 -6.970 1.967 1.00 0.15 N ATOM 1384 CA LEU A 297 -6.928 -5.748 2.001 1.00 0.15 C ATOM 1385 C LEU A 297 -8.382 -6.057 2.304 1.00 0.15 C ATOM 1386 O LEU A 297 -9.072 -6.690 1.498 1.00 0.23 O ATOM 1387 CB LEU A 297 -6.828 -5.008 0.666 1.00 0.22 C ATOM 1388 CG LEU A 297 -7.519 -3.646 0.644 1.00 0.21 C ATOM 1389 CD1 LEU A 297 -6.881 -2.729 1.671 1.00 0.26 C ATOM 1390 CD2 LEU A 297 -7.455 -3.033 -0.745 1.00 0.29 C ATOM 0 H LEU A 297 -6.511 -7.681 1.329 1.00 0.15 H new ATOM 0 HA LEU A 297 -6.524 -5.111 2.788 1.00 0.15 H new ATOM 0 HB2 LEU A 297 -5.775 -4.871 0.419 1.00 0.22 H new ATOM 0 HB3 LEU A 297 -7.260 -5.633 -0.115 1.00 0.22 H new ATOM 0 HG LEU A 297 -8.570 -3.779 0.900 1.00 0.21 H new ATOM 0 HD11 LEU A 297 -7.378 -1.759 1.651 1.00 0.26 H new ATOM 0 HD12 LEU A 297 -6.982 -3.168 2.664 1.00 0.26 H new ATOM 0 HD13 LEU A 297 -5.824 -2.600 1.437 1.00 0.26 H new ATOM 0 HD21 LEU A 297 -7.953 -2.063 -0.738 1.00 0.29 H new ATOM 0 HD22 LEU A 297 -6.413 -2.904 -1.038 1.00 0.29 H new ATOM 0 HD23 LEU A 297 -7.953 -3.692 -1.457 1.00 0.29 H new ATOM 1402 N PHE A 298 -8.846 -5.564 3.440 1.00 0.14 N ATOM 1403 CA PHE A 298 -10.232 -5.733 3.854 1.00 0.19 C ATOM 1404 C PHE A 298 -10.879 -4.369 3.983 1.00 0.19 C ATOM 1405 O PHE A 298 -10.253 -3.437 4.486 1.00 0.24 O ATOM 1406 CB PHE A 298 -10.322 -6.450 5.209 1.00 0.26 C ATOM 1407 CG PHE A 298 -9.825 -7.870 5.214 1.00 0.28 C ATOM 1408 CD1 PHE A 298 -8.514 -8.148 4.869 1.00 0.25 C ATOM 1409 CD2 PHE A 298 -10.665 -8.923 5.539 1.00 0.50 C ATOM 1410 CE1 PHE A 298 -8.049 -9.446 4.852 1.00 0.32 C ATOM 1411 CE2 PHE A 298 -10.203 -10.224 5.525 1.00 0.58 C ATOM 1412 CZ PHE A 298 -8.923 -10.496 5.269 1.00 0.45 C ATOM 0 H PHE A 298 -8.276 -5.036 4.101 1.00 0.14 H new ATOM 0 HA PHE A 298 -10.744 -6.336 3.104 1.00 0.19 H new ATOM 0 HB2 PHE A 298 -9.753 -5.880 5.943 1.00 0.26 H new ATOM 0 HB3 PHE A 298 -11.361 -6.444 5.537 1.00 0.26 H new ATOM 0 HD1 PHE A 298 -7.847 -7.339 4.610 1.00 0.25 H new ATOM 0 HD2 PHE A 298 -11.692 -8.724 5.806 1.00 0.50 H new ATOM 0 HE1 PHE A 298 -7.042 -9.665 4.529 1.00 0.32 H new ATOM 0 HE2 PHE A 298 -10.889 -11.034 5.724 1.00 0.58 H new ATOM 0 HZ PHE A 298 -8.550 -11.504 5.376 1.00 0.45 H new ATOM 1422 N VAL A 299 -12.117 -4.229 3.545 1.00 0.28 N ATOM 1423 CA VAL A 299 -12.786 -2.949 3.684 1.00 0.28 C ATOM 1424 C VAL A 299 -13.883 -2.986 4.741 1.00 0.32 C ATOM 1425 O VAL A 299 -14.857 -3.738 4.642 1.00 0.40 O ATOM 1426 CB VAL A 299 -13.342 -2.405 2.346 1.00 0.33 C ATOM 1427 CG1 VAL A 299 -14.267 -3.384 1.670 1.00 0.44 C ATOM 1428 CG2 VAL A 299 -14.046 -1.077 2.559 1.00 0.35 C ATOM 0 H VAL A 299 -12.667 -4.964 3.101 1.00 0.28 H new ATOM 0 HA VAL A 299 -12.014 -2.256 4.017 1.00 0.28 H new ATOM 0 HB VAL A 299 -12.488 -2.255 1.685 1.00 0.33 H new ATOM 0 HG11 VAL A 299 -14.630 -2.956 0.736 1.00 0.44 H new ATOM 0 HG12 VAL A 299 -13.728 -4.308 1.460 1.00 0.44 H new ATOM 0 HG13 VAL A 299 -15.112 -3.597 2.324 1.00 0.44 H new ATOM 0 HG21 VAL A 299 -14.430 -0.712 1.606 1.00 0.35 H new ATOM 0 HG22 VAL A 299 -14.873 -1.211 3.256 1.00 0.35 H new ATOM 0 HG23 VAL A 299 -13.341 -0.353 2.968 1.00 0.35 H new ATOM 1438 N LYS A 300 -13.762 -2.077 5.691 1.00 0.33 N ATOM 1439 CA LYS A 300 -14.784 -1.854 6.686 1.00 0.41 C ATOM 1440 C LYS A 300 -15.734 -0.781 6.172 1.00 0.40 C ATOM 1441 O LYS A 300 -15.294 0.200 5.567 1.00 0.37 O ATOM 1442 CB LYS A 300 -14.149 -1.416 8.010 1.00 0.48 C ATOM 1443 CG LYS A 300 -15.142 -1.296 9.154 1.00 1.17 C ATOM 1444 CD LYS A 300 -14.465 -0.856 10.441 1.00 1.72 C ATOM 1445 CE LYS A 300 -15.461 -0.764 11.582 1.00 2.32 C ATOM 1446 NZ LYS A 300 -14.813 -0.345 12.850 1.00 3.03 N ATOM 0 H LYS A 300 -12.947 -1.472 5.791 1.00 0.33 H new ATOM 0 HA LYS A 300 -15.334 -2.777 6.866 1.00 0.41 H new ATOM 0 HB2 LYS A 300 -13.375 -2.132 8.286 1.00 0.48 H new ATOM 0 HB3 LYS A 300 -13.656 -0.454 7.866 1.00 0.48 H new ATOM 0 HG2 LYS A 300 -15.919 -0.579 8.888 1.00 1.17 H new ATOM 0 HG3 LYS A 300 -15.634 -2.256 9.311 1.00 1.17 H new ATOM 0 HD2 LYS A 300 -13.676 -1.562 10.700 1.00 1.72 H new ATOM 0 HD3 LYS A 300 -13.989 0.113 10.292 1.00 1.72 H new ATOM 0 HE2 LYS A 300 -16.245 -0.053 11.323 1.00 2.32 H new ATOM 0 HE3 LYS A 300 -15.942 -1.732 11.723 1.00 2.32 H new ATOM 0 HZ1 LYS A 300 -15.527 -0.294 13.604 1.00 3.03 H new ATOM 0 HZ2 LYS A 300 -14.082 -1.037 13.111 1.00 3.03 H new ATOM 0 HZ3 LYS A 300 -14.376 0.590 12.724 1.00 3.03 H new ATOM 1460 N GLU A 301 -17.025 -1.017 6.315 1.00 0.50 N ATOM 1461 CA GLU A 301 -18.027 -0.109 5.780 1.00 0.57 C ATOM 1462 C GLU A 301 -17.985 1.242 6.494 1.00 0.65 C ATOM 1463 O GLU A 301 -17.905 2.280 5.803 1.00 1.41 O ATOM 1464 CB GLU A 301 -19.418 -0.728 5.898 1.00 0.83 C ATOM 1465 CG GLU A 301 -19.608 -1.952 5.020 1.00 0.66 C ATOM 1466 CD GLU A 301 -20.905 -2.686 5.294 1.00 0.90 C ATOM 1467 OE1 GLU A 301 -21.696 -2.205 6.130 1.00 1.44 O ATOM 1468 OE2 GLU A 301 -21.142 -3.752 4.683 1.00 1.21 O ATOM 1469 OXT GLU A 301 -18.036 1.259 7.743 1.00 1.20 O ATOM 0 H GLU A 301 -17.406 -1.831 6.798 1.00 0.50 H new ATOM 0 HA GLU A 301 -17.803 0.060 4.727 1.00 0.57 H new ATOM 0 HB2 GLU A 301 -19.598 -1.003 6.937 1.00 0.83 H new ATOM 0 HB3 GLU A 301 -20.165 0.020 5.632 1.00 0.83 H new ATOM 0 HG2 GLU A 301 -19.584 -1.648 3.974 1.00 0.66 H new ATOM 0 HG3 GLU A 301 -18.772 -2.635 5.173 1.00 0.66 H new TER 1476 GLU A 301