USER MOD reduce.3.24.130724 H: found=0, std=0, add=913, rem=0, adj=27 USER MOD reduce.3.24.130724 removed 914 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 396 HIS : no HD1:sc= -2.7 K(o=-2.7,f=-1.9) USER MOD Set 1.2: A 399 LYS NZ :NH3+ 174:sc= 0 (180deg=-0.0373) USER MOD Set 2.1: A 386 THR OG1 : rot -139:sc= -2.83! USER MOD Set 2.2: A 389 LYS NZ :NH3+ -158:sc= 1.42 (180deg=1.09) USER MOD Set 3.1: A 343 GLN : amide:sc= -0.745 X(o=-0.31,f=0.16) USER MOD Set 3.2: A 350 TYR OH : rot -128:sc= 0.436 USER MOD Single : A 332 SER OG : rot 180:sc= 0 USER MOD Single : A 333 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 334 MET CE :methyl 167:sc= -0.0591 (180deg=-0.355) USER MOD Single : A 340 TYR OH : rot 121:sc= 0.428 USER MOD Single : A 342 TYR OH : rot 121:sc= -0.431 USER MOD Single : A 346 SER OG : rot 8:sc= 0.565 USER MOD Single : A 348 SER OG : rot 85:sc= 1.21 USER MOD Single : A 352 ASN : amide:sc=-0.00576 X(o=-0.0058,f=-0.0058) USER MOD Single : A 359 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 361 SER OG : rot 180:sc= 0 USER MOD Single : A 362 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 370 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 378 ASN : amide:sc= 1.22 K(o=1.2,f=-0.17) USER MOD Single : A 379 HIS : no HD1:sc= -0.604 K(o=-0.6,f=0) USER MOD Single : A 380 LYS NZ :NH3+ 167:sc= -0.169 (180deg=-0.434) USER MOD Single : A 381 ASN : amide:sc= -0.89 K(o=-0.89,f=0) USER MOD Single : A 383 THR OG1 : rot 180:sc= 0 USER MOD Single : A 384 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 385 MET CE :methyl 149:sc= -5.6! (180deg=-6.56!) USER MOD Single : A 387 TYR OH : rot 180:sc= 0 USER MOD Single : A 390 MET CE :methyl -173:sc= -0.824 (180deg=-1.12) USER MOD Single : A 391 SER OG : rot 24:sc= 0.52 USER MOD Single : A 397 TYR OH : rot 62:sc= 0.341! USER MOD Single : A 398 TYR OH : rot -26:sc= 0.833 USER MOD Single : A 401 ASN : amide:sc= -0.172 K(o=-0.17,f=-1.1) USER MOD Single : A 405 LYS NZ :NH3+ -166:sc= -0.0219 (180deg=-0.273) USER MOD Single : A 409 GLN : amide:sc= -2.34! C(o=-2.3!,f=-4.5!) USER MOD Single : A 416 MET CE :methyl -162:sc= -0.256 (180deg=-0.834) USER MOD Single : A 417 LYS NZ :NH3+ -150:sc= 1.25 (180deg=0.953) USER MOD Single : A 418 THR OG1 : rot 180:sc= 0.00381 USER MOD Single : A 423 MET CE :methyl 154:sc= -0.231 (180deg=-0.914) USER MOD Single : A 424 SER OG : rot -43:sc= 0.538 USER MOD Single : A 427 THR OG1 : rot 150:sc= -1.93! USER MOD Single : A 432 HIS : no HD1:sc= -0.223 X(o=-0.22,f=0) USER MOD Single : A 435 SER OG : rot 180:sc= 0 USER MOD Single : A 436 GLN : amide:sc= 0.404 K(o=0.4,f=-0.54) USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 331 -14.926 -8.924 8.662 1.00 6.78 N ATOM 2 CA GLY A 331 -13.572 -8.335 8.797 1.00 6.11 C ATOM 3 C GLY A 331 -13.364 -7.692 10.151 1.00 5.22 C ATOM 4 O GLY A 331 -14.203 -6.915 10.611 1.00 5.14 O ATOM 0 HA2 GLY A 331 -12.822 -9.112 8.646 1.00 6.11 H new ATOM 0 HA3 GLY A 331 -13.421 -7.590 8.015 1.00 6.11 H new ATOM 10 N SER A 332 -12.245 -8.013 10.784 1.00 4.99 N ATOM 11 CA SER A 332 -11.935 -7.505 12.113 1.00 4.63 C ATOM 12 C SER A 332 -11.124 -6.216 12.011 1.00 3.82 C ATOM 13 O SER A 332 -10.986 -5.474 12.982 1.00 4.13 O ATOM 14 CB SER A 332 -11.153 -8.558 12.897 1.00 5.44 C ATOM 15 OG SER A 332 -11.771 -9.831 12.789 1.00 6.08 O ATOM 0 H SER A 332 -11.531 -8.628 10.395 1.00 4.99 H new ATOM 0 HA SER A 332 -12.866 -7.288 12.636 1.00 4.63 H new ATOM 0 HB2 SER A 332 -10.131 -8.612 12.522 1.00 5.44 H new ATOM 0 HB3 SER A 332 -11.093 -8.266 13.945 1.00 5.44 H new ATOM 0 HG SER A 332 -11.253 -10.490 13.297 1.00 6.08 H new ATOM 21 N HIS A 333 -10.578 -5.969 10.827 1.00 3.28 N ATOM 22 CA HIS A 333 -9.814 -4.756 10.562 1.00 2.94 C ATOM 23 C HIS A 333 -10.227 -4.177 9.220 1.00 2.02 C ATOM 24 O HIS A 333 -10.810 -4.881 8.394 1.00 2.49 O ATOM 25 CB HIS A 333 -8.307 -5.035 10.560 1.00 3.89 C ATOM 26 CG HIS A 333 -7.746 -5.387 11.903 1.00 4.68 C ATOM 27 ND1 HIS A 333 -7.535 -4.458 12.899 1.00 5.34 N ATOM 28 CD2 HIS A 333 -7.345 -6.577 12.411 1.00 5.35 C ATOM 29 CE1 HIS A 333 -7.030 -5.058 13.958 1.00 6.24 C ATOM 30 NE2 HIS A 333 -6.905 -6.342 13.689 1.00 6.26 N ATOM 0 H HIS A 333 -10.651 -6.599 10.028 1.00 3.28 H new ATOM 0 HA HIS A 333 -10.026 -4.041 11.357 1.00 2.94 H new ATOM 0 HB2 HIS A 333 -8.101 -5.851 9.867 1.00 3.89 H new ATOM 0 HB3 HIS A 333 -7.787 -4.156 10.180 1.00 3.89 H new ATOM 0 HD2 HIS A 333 -7.367 -7.531 11.905 1.00 5.35 H new ATOM 0 HE1 HIS A 333 -6.764 -4.579 14.889 1.00 6.24 H new ATOM 0 HE2 HIS A 333 -6.540 -7.048 14.328 1.00 6.26 H new ATOM 39 N MET A 334 -9.923 -2.909 9.002 1.00 1.20 N ATOM 40 CA MET A 334 -10.266 -2.256 7.751 1.00 0.62 C ATOM 41 C MET A 334 -9.098 -1.415 7.254 1.00 0.57 C ATOM 42 O MET A 334 -9.046 -0.201 7.464 1.00 0.92 O ATOM 43 CB MET A 334 -11.522 -1.395 7.917 1.00 1.35 C ATOM 44 CG MET A 334 -12.004 -0.753 6.623 1.00 2.01 C ATOM 45 SD MET A 334 -12.224 -1.949 5.289 1.00 3.03 S ATOM 46 CE MET A 334 -13.408 -3.076 6.024 1.00 3.71 C ATOM 0 H MET A 334 -9.440 -2.312 9.674 1.00 1.20 H new ATOM 0 HA MET A 334 -10.478 -3.024 7.007 1.00 0.62 H new ATOM 0 HB2 MET A 334 -12.322 -2.012 8.325 1.00 1.35 H new ATOM 0 HB3 MET A 334 -11.320 -0.611 8.647 1.00 1.35 H new ATOM 0 HG2 MET A 334 -12.949 -0.242 6.806 1.00 2.01 H new ATOM 0 HG3 MET A 334 -11.287 0.006 6.310 1.00 2.01 H new ATOM 0 HE1 MET A 334 -13.815 -3.730 5.253 1.00 3.71 H new ATOM 0 HE2 MET A 334 -12.913 -3.678 6.786 1.00 3.71 H new ATOM 0 HE3 MET A 334 -14.217 -2.506 6.481 1.00 3.71 H new ATOM 56 N ARG A 335 -8.145 -2.073 6.616 1.00 0.40 N ATOM 57 CA ARG A 335 -7.005 -1.388 6.039 1.00 0.32 C ATOM 58 C ARG A 335 -7.120 -1.381 4.527 1.00 0.28 C ATOM 59 O ARG A 335 -7.473 -2.393 3.922 1.00 0.42 O ATOM 60 CB ARG A 335 -5.688 -2.052 6.442 1.00 0.37 C ATOM 61 CG ARG A 335 -5.478 -2.135 7.938 1.00 0.56 C ATOM 62 CD ARG A 335 -4.008 -2.236 8.275 1.00 0.93 C ATOM 63 NE ARG A 335 -3.759 -2.126 9.713 1.00 1.32 N ATOM 64 CZ ARG A 335 -2.807 -1.356 10.246 1.00 2.05 C ATOM 65 NH1 ARG A 335 -2.055 -0.586 9.468 1.00 2.81 N ATOM 66 NH2 ARG A 335 -2.632 -1.337 11.560 1.00 2.51 N ATOM 0 H ARG A 335 -8.140 -3.085 6.485 1.00 0.40 H new ATOM 0 HA ARG A 335 -7.004 -0.366 6.419 1.00 0.32 H new ATOM 0 HB2 ARG A 335 -5.656 -3.058 6.024 1.00 0.37 H new ATOM 0 HB3 ARG A 335 -4.861 -1.497 5.999 1.00 0.37 H new ATOM 0 HG2 ARG A 335 -5.905 -1.254 8.418 1.00 0.56 H new ATOM 0 HG3 ARG A 335 -6.006 -3.002 8.335 1.00 0.56 H new ATOM 0 HD2 ARG A 335 -3.619 -3.188 7.913 1.00 0.93 H new ATOM 0 HD3 ARG A 335 -3.463 -1.450 7.753 1.00 0.93 H new ATOM 0 HE ARG A 335 -4.347 -2.669 10.345 1.00 1.32 H new ATOM 0 HH11 ARG A 335 -2.203 -0.581 8.459 1.00 2.81 H new ATOM 0 HH12 ARG A 335 -1.329 0.000 9.880 1.00 2.81 H new ATOM 0 HH21 ARG A 335 -3.224 -1.910 12.162 1.00 2.51 H new ATOM 0 HH22 ARG A 335 -1.905 -0.750 11.969 1.00 2.51 H new ATOM 80 N LEU A 336 -6.843 -0.232 3.925 1.00 0.23 N ATOM 81 CA LEU A 336 -6.744 -0.142 2.476 1.00 0.28 C ATOM 82 C LEU A 336 -5.421 -0.754 2.063 1.00 0.14 C ATOM 83 O LEU A 336 -4.680 -1.223 2.917 1.00 0.20 O ATOM 84 CB LEU A 336 -6.804 1.312 1.980 1.00 0.48 C ATOM 85 CG LEU A 336 -8.041 2.135 2.364 1.00 0.39 C ATOM 86 CD1 LEU A 336 -8.532 2.917 1.166 1.00 0.33 C ATOM 87 CD2 LEU A 336 -9.151 1.266 2.914 1.00 0.67 C ATOM 0 H LEU A 336 -6.683 0.647 4.416 1.00 0.23 H new ATOM 0 HA LEU A 336 -7.589 -0.671 2.034 1.00 0.28 H new ATOM 0 HB2 LEU A 336 -5.923 1.833 2.354 1.00 0.48 H new ATOM 0 HB3 LEU A 336 -6.730 1.301 0.893 1.00 0.48 H new ATOM 0 HG LEU A 336 -7.748 2.826 3.154 1.00 0.39 H new ATOM 0 HD11 LEU A 336 -9.410 3.499 1.446 1.00 0.33 H new ATOM 0 HD12 LEU A 336 -7.746 3.589 0.823 1.00 0.33 H new ATOM 0 HD13 LEU A 336 -8.795 2.227 0.364 1.00 0.33 H new ATOM 0 HD21 LEU A 336 -10.007 1.889 3.173 1.00 0.67 H new ATOM 0 HD22 LEU A 336 -9.448 0.536 2.161 1.00 0.67 H new ATOM 0 HD23 LEU A 336 -8.798 0.746 3.805 1.00 0.67 H new ATOM 99 N LEU A 337 -5.099 -0.734 0.784 1.00 0.15 N ATOM 100 CA LEU A 337 -3.848 -1.320 0.333 1.00 0.12 C ATOM 101 C LEU A 337 -2.684 -0.575 0.972 1.00 0.11 C ATOM 102 O LEU A 337 -1.771 -1.185 1.518 1.00 0.12 O ATOM 103 CB LEU A 337 -3.777 -1.301 -1.202 1.00 0.14 C ATOM 104 CG LEU A 337 -2.545 -1.929 -1.846 1.00 0.14 C ATOM 105 CD1 LEU A 337 -1.441 -0.910 -1.941 1.00 0.14 C ATOM 106 CD2 LEU A 337 -2.078 -3.146 -1.069 1.00 0.15 C ATOM 0 H LEU A 337 -5.675 -0.326 0.048 1.00 0.15 H new ATOM 0 HA LEU A 337 -3.790 -2.363 0.643 1.00 0.12 H new ATOM 0 HB2 LEU A 337 -4.659 -1.812 -1.588 1.00 0.14 H new ATOM 0 HB3 LEU A 337 -3.840 -0.264 -1.531 1.00 0.14 H new ATOM 0 HG LEU A 337 -2.814 -2.259 -2.849 1.00 0.14 H new ATOM 0 HD11 LEU A 337 -0.564 -1.365 -2.402 1.00 0.14 H new ATOM 0 HD12 LEU A 337 -1.774 -0.068 -2.548 1.00 0.14 H new ATOM 0 HD13 LEU A 337 -1.184 -0.558 -0.942 1.00 0.14 H new ATOM 0 HD21 LEU A 337 -1.199 -3.571 -1.553 1.00 0.15 H new ATOM 0 HD22 LEU A 337 -1.825 -2.852 -0.050 1.00 0.15 H new ATOM 0 HD23 LEU A 337 -2.874 -3.890 -1.045 1.00 0.15 H new ATOM 118 N TRP A 338 -2.753 0.747 0.955 1.00 0.12 N ATOM 119 CA TRP A 338 -1.724 1.567 1.586 1.00 0.14 C ATOM 120 C TRP A 338 -1.754 1.401 3.109 1.00 0.14 C ATOM 121 O TRP A 338 -0.713 1.408 3.761 1.00 0.17 O ATOM 122 CB TRP A 338 -1.894 3.043 1.196 1.00 0.16 C ATOM 123 CG TRP A 338 -3.195 3.637 1.628 1.00 0.14 C ATOM 124 CD1 TRP A 338 -4.316 3.762 0.875 1.00 0.15 C ATOM 125 CD2 TRP A 338 -3.510 4.189 2.909 1.00 0.15 C ATOM 126 NE1 TRP A 338 -5.311 4.340 1.607 1.00 0.15 N ATOM 127 CE2 TRP A 338 -4.844 4.617 2.860 1.00 0.16 C ATOM 128 CE3 TRP A 338 -2.794 4.357 4.091 1.00 0.18 C ATOM 129 CZ2 TRP A 338 -5.481 5.201 3.948 1.00 0.19 C ATOM 130 CZ3 TRP A 338 -3.422 4.934 5.169 1.00 0.21 C ATOM 131 CH2 TRP A 338 -4.758 5.352 5.094 1.00 0.21 C ATOM 0 H TRP A 338 -3.506 1.275 0.514 1.00 0.12 H new ATOM 0 HA TRP A 338 -0.752 1.229 1.228 1.00 0.14 H new ATOM 0 HB2 TRP A 338 -1.079 3.620 1.633 1.00 0.16 H new ATOM 0 HB3 TRP A 338 -1.805 3.135 0.114 1.00 0.16 H new ATOM 0 HD1 TRP A 338 -4.407 3.449 -0.155 1.00 0.15 H new ATOM 0 HE1 TRP A 338 -6.254 4.535 1.272 1.00 0.15 H new ATOM 0 HE3 TRP A 338 -1.764 4.040 4.160 1.00 0.18 H new ATOM 0 HZ2 TRP A 338 -6.510 5.523 3.888 1.00 0.19 H new ATOM 0 HZ3 TRP A 338 -2.876 5.068 6.091 1.00 0.21 H new ATOM 0 HH2 TRP A 338 -5.223 5.801 5.959 1.00 0.21 H new ATOM 142 N ASP A 339 -2.951 1.231 3.672 1.00 0.14 N ATOM 143 CA ASP A 339 -3.099 1.061 5.118 1.00 0.17 C ATOM 144 C ASP A 339 -2.505 -0.279 5.512 1.00 0.16 C ATOM 145 O ASP A 339 -1.912 -0.447 6.578 1.00 0.23 O ATOM 146 CB ASP A 339 -4.576 1.107 5.525 1.00 0.23 C ATOM 147 CG ASP A 339 -4.772 1.596 6.947 1.00 0.34 C ATOM 148 OD1 ASP A 339 -4.280 0.939 7.885 1.00 0.86 O ATOM 149 OD2 ASP A 339 -5.429 2.640 7.129 1.00 1.15 O ATOM 0 H ASP A 339 -3.828 1.207 3.152 1.00 0.14 H new ATOM 0 HA ASP A 339 -2.580 1.873 5.628 1.00 0.17 H new ATOM 0 HB2 ASP A 339 -5.118 1.761 4.842 1.00 0.23 H new ATOM 0 HB3 ASP A 339 -5.009 0.112 5.424 1.00 0.23 H new ATOM 154 N TYR A 340 -2.668 -1.221 4.605 1.00 0.11 N ATOM 155 CA TYR A 340 -2.163 -2.566 4.756 1.00 0.10 C ATOM 156 C TYR A 340 -0.640 -2.572 4.715 1.00 0.08 C ATOM 157 O TYR A 340 0.000 -3.205 5.555 1.00 0.09 O ATOM 158 CB TYR A 340 -2.721 -3.425 3.629 1.00 0.11 C ATOM 159 CG TYR A 340 -2.507 -4.890 3.836 1.00 0.12 C ATOM 160 CD1 TYR A 340 -2.912 -5.491 5.011 1.00 0.15 C ATOM 161 CD2 TYR A 340 -1.908 -5.668 2.862 1.00 0.12 C ATOM 162 CE1 TYR A 340 -2.725 -6.831 5.220 1.00 0.18 C ATOM 163 CE2 TYR A 340 -1.718 -7.017 3.054 1.00 0.14 C ATOM 164 CZ TYR A 340 -2.128 -7.600 4.243 1.00 0.16 C ATOM 165 OH TYR A 340 -1.934 -8.945 4.457 1.00 0.20 O ATOM 0 H TYR A 340 -3.165 -1.068 3.727 1.00 0.11 H new ATOM 0 HA TYR A 340 -2.477 -2.967 5.720 1.00 0.10 H new ATOM 0 HB2 TYR A 340 -3.789 -3.232 3.530 1.00 0.11 H new ATOM 0 HB3 TYR A 340 -2.255 -3.127 2.690 1.00 0.11 H new ATOM 0 HD1 TYR A 340 -3.384 -4.894 5.778 1.00 0.15 H new ATOM 0 HD2 TYR A 340 -1.585 -5.211 1.938 1.00 0.12 H new ATOM 0 HE1 TYR A 340 -3.044 -7.284 6.147 1.00 0.18 H new ATOM 0 HE2 TYR A 340 -1.253 -7.617 2.285 1.00 0.14 H new ATOM 0 HH TYR A 340 -2.398 -9.457 3.762 1.00 0.20 H new ATOM 175 N VAL A 341 -0.053 -1.858 3.745 1.00 0.08 N ATOM 176 CA VAL A 341 1.403 -1.841 3.609 1.00 0.07 C ATOM 177 C VAL A 341 2.038 -1.270 4.865 1.00 0.08 C ATOM 178 O VAL A 341 3.109 -1.696 5.253 1.00 0.08 O ATOM 179 CB VAL A 341 1.925 -1.053 2.373 1.00 0.08 C ATOM 180 CG1 VAL A 341 1.144 -1.395 1.125 1.00 0.07 C ATOM 181 CG2 VAL A 341 1.938 0.450 2.596 1.00 0.09 C ATOM 0 H VAL A 341 -0.555 -1.296 3.057 1.00 0.08 H new ATOM 0 HA VAL A 341 1.692 -2.881 3.459 1.00 0.07 H new ATOM 0 HB VAL A 341 2.959 -1.367 2.232 1.00 0.08 H new ATOM 0 HG11 VAL A 341 1.537 -0.826 0.283 1.00 0.07 H new ATOM 0 HG12 VAL A 341 1.238 -2.461 0.918 1.00 0.07 H new ATOM 0 HG13 VAL A 341 0.093 -1.145 1.273 1.00 0.07 H new ATOM 0 HG21 VAL A 341 2.311 0.947 1.701 1.00 0.09 H new ATOM 0 HG22 VAL A 341 0.926 0.795 2.808 1.00 0.09 H new ATOM 0 HG23 VAL A 341 2.586 0.687 3.440 1.00 0.09 H new ATOM 191 N TYR A 342 1.368 -0.312 5.497 1.00 0.08 N ATOM 192 CA TYR A 342 1.841 0.239 6.771 1.00 0.10 C ATOM 193 C TYR A 342 2.051 -0.862 7.807 1.00 0.11 C ATOM 194 O TYR A 342 3.040 -0.851 8.539 1.00 0.14 O ATOM 195 CB TYR A 342 0.866 1.272 7.344 1.00 0.11 C ATOM 196 CG TYR A 342 1.106 2.689 6.881 1.00 0.11 C ATOM 197 CD1 TYR A 342 2.259 3.371 7.253 1.00 0.14 C ATOM 198 CD2 TYR A 342 0.176 3.357 6.097 1.00 0.16 C ATOM 199 CE1 TYR A 342 2.478 4.676 6.854 1.00 0.16 C ATOM 200 CE2 TYR A 342 0.393 4.657 5.693 1.00 0.19 C ATOM 201 CZ TYR A 342 1.544 5.312 6.071 1.00 0.17 C ATOM 202 OH TYR A 342 1.752 6.613 5.674 1.00 0.21 O ATOM 0 H TYR A 342 0.500 0.100 5.154 1.00 0.08 H new ATOM 0 HA TYR A 342 2.792 0.728 6.558 1.00 0.10 H new ATOM 0 HB2 TYR A 342 -0.149 0.983 7.073 1.00 0.11 H new ATOM 0 HB3 TYR A 342 0.926 1.244 8.432 1.00 0.11 H new ATOM 0 HD1 TYR A 342 2.996 2.872 7.864 1.00 0.14 H new ATOM 0 HD2 TYR A 342 -0.731 2.851 5.799 1.00 0.16 H new ATOM 0 HE1 TYR A 342 3.377 5.193 7.155 1.00 0.16 H new ATOM 0 HE2 TYR A 342 -0.339 5.162 5.080 1.00 0.19 H new ATOM 0 HH TYR A 342 1.757 6.660 4.695 1.00 0.21 H new ATOM 212 N GLN A 343 1.134 -1.824 7.852 1.00 0.12 N ATOM 213 CA GLN A 343 1.217 -2.899 8.822 1.00 0.18 C ATOM 214 C GLN A 343 2.356 -3.823 8.428 1.00 0.18 C ATOM 215 O GLN A 343 3.107 -4.310 9.274 1.00 0.25 O ATOM 216 CB GLN A 343 -0.125 -3.653 8.894 1.00 0.28 C ATOM 217 CG GLN A 343 -0.183 -4.971 8.136 1.00 0.55 C ATOM 218 CD GLN A 343 0.092 -6.187 9.008 1.00 0.99 C ATOM 219 OE1 GLN A 343 -0.419 -7.276 8.748 1.00 1.40 O ATOM 220 NE2 GLN A 343 0.896 -6.020 10.047 1.00 1.15 N ATOM 0 H GLN A 343 0.329 -1.877 7.228 1.00 0.12 H new ATOM 0 HA GLN A 343 1.418 -2.497 9.815 1.00 0.18 H new ATOM 0 HB2 GLN A 343 -0.356 -3.847 9.941 1.00 0.28 H new ATOM 0 HB3 GLN A 343 -0.909 -3.000 8.511 1.00 0.28 H new ATOM 0 HG2 GLN A 343 -1.168 -5.076 7.681 1.00 0.55 H new ATOM 0 HG3 GLN A 343 0.543 -4.945 7.323 1.00 0.55 H new ATOM 0 HE21 GLN A 343 1.303 -5.104 10.235 1.00 1.15 H new ATOM 0 HE22 GLN A 343 1.108 -6.808 10.660 1.00 1.15 H new ATOM 229 N LEU A 344 2.488 -4.021 7.127 1.00 0.15 N ATOM 230 CA LEU A 344 3.514 -4.879 6.579 1.00 0.16 C ATOM 231 C LEU A 344 4.887 -4.227 6.732 1.00 0.18 C ATOM 232 O LEU A 344 5.902 -4.896 6.890 1.00 0.27 O ATOM 233 CB LEU A 344 3.205 -5.131 5.106 1.00 0.13 C ATOM 234 CG LEU A 344 1.769 -5.572 4.814 1.00 0.12 C ATOM 235 CD1 LEU A 344 1.514 -5.583 3.329 1.00 0.10 C ATOM 236 CD2 LEU A 344 1.486 -6.944 5.387 1.00 0.18 C ATOM 0 H LEU A 344 1.886 -3.590 6.426 1.00 0.15 H new ATOM 0 HA LEU A 344 3.529 -5.827 7.117 1.00 0.16 H new ATOM 0 HB2 LEU A 344 3.410 -4.219 4.546 1.00 0.13 H new ATOM 0 HB3 LEU A 344 3.887 -5.895 4.732 1.00 0.13 H new ATOM 0 HG LEU A 344 1.101 -4.855 5.291 1.00 0.12 H new ATOM 0 HD11 LEU A 344 0.488 -5.899 3.138 1.00 0.10 H new ATOM 0 HD12 LEU A 344 1.666 -4.582 2.926 1.00 0.10 H new ATOM 0 HD13 LEU A 344 2.203 -6.277 2.847 1.00 0.10 H new ATOM 0 HD21 LEU A 344 0.458 -7.227 5.162 1.00 0.18 H new ATOM 0 HD22 LEU A 344 2.168 -7.671 4.945 1.00 0.18 H new ATOM 0 HD23 LEU A 344 1.629 -6.924 6.467 1.00 0.18 H new ATOM 248 N LEU A 345 4.873 -2.906 6.690 1.00 0.12 N ATOM 249 CA LEU A 345 6.064 -2.077 6.837 1.00 0.13 C ATOM 250 C LEU A 345 6.582 -2.120 8.272 1.00 0.19 C ATOM 251 O LEU A 345 7.786 -2.020 8.519 1.00 0.29 O ATOM 252 CB LEU A 345 5.719 -0.630 6.453 1.00 0.10 C ATOM 253 CG LEU A 345 6.149 -0.167 5.050 1.00 0.10 C ATOM 254 CD1 LEU A 345 6.453 -1.343 4.146 1.00 0.12 C ATOM 255 CD2 LEU A 345 5.080 0.719 4.418 1.00 0.10 C ATOM 0 H LEU A 345 4.019 -2.366 6.550 1.00 0.12 H new ATOM 0 HA LEU A 345 6.845 -2.461 6.181 1.00 0.13 H new ATOM 0 HB2 LEU A 345 4.640 -0.504 6.537 1.00 0.10 H new ATOM 0 HB3 LEU A 345 6.176 0.035 7.186 1.00 0.10 H new ATOM 0 HG LEU A 345 7.063 0.415 5.167 1.00 0.10 H new ATOM 0 HD11 LEU A 345 6.753 -0.979 3.164 1.00 0.12 H new ATOM 0 HD12 LEU A 345 7.262 -1.934 4.577 1.00 0.12 H new ATOM 0 HD13 LEU A 345 5.563 -1.965 4.046 1.00 0.12 H new ATOM 0 HD21 LEU A 345 5.407 1.033 3.427 1.00 0.10 H new ATOM 0 HD22 LEU A 345 4.148 0.160 4.332 1.00 0.10 H new ATOM 0 HD23 LEU A 345 4.920 1.598 5.043 1.00 0.10 H new ATOM 267 N SER A 346 5.663 -2.254 9.219 1.00 0.25 N ATOM 268 CA SER A 346 6.016 -2.249 10.628 1.00 0.33 C ATOM 269 C SER A 346 6.337 -3.653 11.141 1.00 0.30 C ATOM 270 O SER A 346 7.085 -3.809 12.107 1.00 0.53 O ATOM 271 CB SER A 346 4.881 -1.633 11.445 1.00 0.51 C ATOM 272 OG SER A 346 3.641 -2.259 11.152 1.00 1.43 O ATOM 0 H SER A 346 4.666 -2.368 9.034 1.00 0.25 H new ATOM 0 HA SER A 346 6.917 -1.647 10.744 1.00 0.33 H new ATOM 0 HB2 SER A 346 5.099 -1.732 12.508 1.00 0.51 H new ATOM 0 HB3 SER A 346 4.813 -0.566 11.231 1.00 0.51 H new ATOM 0 HG SER A 346 3.795 -3.036 10.575 1.00 1.43 H new ATOM 278 N ASP A 347 5.776 -4.670 10.499 1.00 0.32 N ATOM 279 CA ASP A 347 5.991 -6.042 10.938 1.00 0.32 C ATOM 280 C ASP A 347 7.047 -6.703 10.065 1.00 0.30 C ATOM 281 O ASP A 347 6.938 -6.713 8.841 1.00 0.30 O ATOM 282 CB ASP A 347 4.690 -6.842 10.898 1.00 0.35 C ATOM 283 CG ASP A 347 4.775 -8.110 11.726 1.00 0.49 C ATOM 284 OD1 ASP A 347 5.593 -8.990 11.398 1.00 0.58 O ATOM 285 OD2 ASP A 347 4.022 -8.228 12.718 1.00 0.67 O ATOM 0 H ASP A 347 5.175 -4.572 9.681 1.00 0.32 H new ATOM 0 HA ASP A 347 6.340 -6.024 11.970 1.00 0.32 H new ATOM 0 HB2 ASP A 347 3.872 -6.223 11.267 1.00 0.35 H new ATOM 0 HB3 ASP A 347 4.454 -7.099 9.865 1.00 0.35 H new ATOM 290 N SER A 348 8.053 -7.275 10.703 1.00 0.34 N ATOM 291 CA SER A 348 9.235 -7.753 10.004 1.00 0.35 C ATOM 292 C SER A 348 8.962 -9.039 9.228 1.00 0.31 C ATOM 293 O SER A 348 9.731 -9.405 8.343 1.00 0.32 O ATOM 294 CB SER A 348 10.368 -7.968 11.003 1.00 0.46 C ATOM 295 OG SER A 348 11.576 -8.331 10.361 1.00 1.53 O ATOM 0 H SER A 348 8.075 -7.421 11.712 1.00 0.34 H new ATOM 0 HA SER A 348 9.524 -6.994 9.277 1.00 0.35 H new ATOM 0 HB2 SER A 348 10.523 -7.055 11.578 1.00 0.46 H new ATOM 0 HB3 SER A 348 10.085 -8.747 11.711 1.00 0.46 H new ATOM 0 HG SER A 348 12.045 -7.523 10.066 1.00 1.53 H new ATOM 301 N ARG A 349 7.863 -9.721 9.529 1.00 0.33 N ATOM 302 CA ARG A 349 7.550 -10.949 8.807 1.00 0.35 C ATOM 303 C ARG A 349 7.188 -10.653 7.360 1.00 0.29 C ATOM 304 O ARG A 349 7.192 -11.544 6.512 1.00 0.34 O ATOM 305 CB ARG A 349 6.466 -11.767 9.479 1.00 0.42 C ATOM 306 CG ARG A 349 5.093 -11.155 9.512 1.00 0.55 C ATOM 307 CD ARG A 349 4.159 -12.169 10.112 1.00 0.59 C ATOM 308 NE ARG A 349 2.901 -11.600 10.585 1.00 1.23 N ATOM 309 CZ ARG A 349 1.753 -12.277 10.617 1.00 1.67 C ATOM 310 NH1 ARG A 349 1.693 -13.512 10.130 1.00 1.93 N ATOM 311 NH2 ARG A 349 0.663 -11.712 11.115 1.00 2.56 N ATOM 0 H ARG A 349 7.190 -9.455 10.248 1.00 0.33 H new ATOM 0 HA ARG A 349 8.454 -11.557 8.823 1.00 0.35 H new ATOM 0 HB2 ARG A 349 6.399 -12.729 8.971 1.00 0.42 H new ATOM 0 HB3 ARG A 349 6.776 -11.968 10.505 1.00 0.42 H new ATOM 0 HG2 ARG A 349 5.096 -10.239 10.103 1.00 0.55 H new ATOM 0 HG3 ARG A 349 4.770 -10.884 8.507 1.00 0.55 H new ATOM 0 HD2 ARG A 349 3.944 -12.936 9.368 1.00 0.59 H new ATOM 0 HD3 ARG A 349 4.660 -12.663 10.944 1.00 0.59 H new ATOM 0 HE ARG A 349 2.900 -10.633 10.908 1.00 1.23 H new ATOM 0 HH11 ARG A 349 2.526 -13.944 9.731 1.00 1.93 H new ATOM 0 HH12 ARG A 349 0.814 -14.028 10.156 1.00 1.93 H new ATOM 0 HH21 ARG A 349 0.702 -10.758 11.474 1.00 2.56 H new ATOM 0 HH22 ARG A 349 -0.215 -12.231 11.139 1.00 2.56 H new ATOM 325 N TYR A 350 6.874 -9.395 7.080 1.00 0.22 N ATOM 326 CA TYR A 350 6.539 -8.984 5.732 1.00 0.17 C ATOM 327 C TYR A 350 7.667 -8.193 5.103 1.00 0.16 C ATOM 328 O TYR A 350 7.579 -7.816 3.939 1.00 0.15 O ATOM 329 CB TYR A 350 5.300 -8.113 5.731 1.00 0.17 C ATOM 330 CG TYR A 350 4.171 -8.630 6.570 1.00 0.20 C ATOM 331 CD1 TYR A 350 3.479 -9.776 6.216 1.00 0.24 C ATOM 332 CD2 TYR A 350 3.765 -7.936 7.692 1.00 0.23 C ATOM 333 CE1 TYR A 350 2.408 -10.211 6.953 1.00 0.29 C ATOM 334 CE2 TYR A 350 2.705 -8.366 8.445 1.00 0.28 C ATOM 335 CZ TYR A 350 2.021 -9.504 8.073 1.00 0.31 C ATOM 336 OH TYR A 350 0.934 -9.917 8.806 1.00 0.39 O ATOM 0 H TYR A 350 6.846 -8.645 7.771 1.00 0.22 H new ATOM 0 HA TYR A 350 6.362 -9.893 5.157 1.00 0.17 H new ATOM 0 HB2 TYR A 350 5.571 -7.118 6.084 1.00 0.17 H new ATOM 0 HB3 TYR A 350 4.951 -8.002 4.704 1.00 0.17 H new ATOM 0 HD1 TYR A 350 3.788 -10.336 5.346 1.00 0.24 H new ATOM 0 HD2 TYR A 350 4.292 -7.039 7.981 1.00 0.23 H new ATOM 0 HE1 TYR A 350 1.871 -11.101 6.659 1.00 0.29 H new ATOM 0 HE2 TYR A 350 2.406 -7.817 9.326 1.00 0.28 H new ATOM 0 HH TYR A 350 0.314 -9.167 8.922 1.00 0.39 H new ATOM 346 N GLU A 351 8.730 -7.949 5.861 1.00 0.18 N ATOM 347 CA GLU A 351 9.811 -7.085 5.391 1.00 0.21 C ATOM 348 C GLU A 351 10.556 -7.719 4.210 1.00 0.21 C ATOM 349 O GLU A 351 11.421 -7.094 3.598 1.00 0.24 O ATOM 350 CB GLU A 351 10.772 -6.733 6.532 1.00 0.28 C ATOM 351 CG GLU A 351 11.790 -7.807 6.840 1.00 0.48 C ATOM 352 CD GLU A 351 12.931 -7.281 7.682 1.00 0.99 C ATOM 353 OE1 GLU A 351 12.667 -6.603 8.694 1.00 1.78 O ATOM 354 OE2 GLU A 351 14.103 -7.533 7.332 1.00 1.05 O ATOM 0 H GLU A 351 8.868 -8.333 6.796 1.00 0.18 H new ATOM 0 HA GLU A 351 9.364 -6.156 5.036 1.00 0.21 H new ATOM 0 HB2 GLU A 351 11.298 -5.812 6.278 1.00 0.28 H new ATOM 0 HB3 GLU A 351 10.191 -6.531 7.432 1.00 0.28 H new ATOM 0 HG2 GLU A 351 11.302 -8.629 7.363 1.00 0.48 H new ATOM 0 HG3 GLU A 351 12.184 -8.211 5.908 1.00 0.48 H new ATOM 361 N ASN A 352 10.216 -8.966 3.896 1.00 0.19 N ATOM 362 CA ASN A 352 10.758 -9.640 2.719 1.00 0.21 C ATOM 363 C ASN A 352 9.870 -9.380 1.506 1.00 0.16 C ATOM 364 O ASN A 352 10.277 -9.580 0.371 1.00 0.18 O ATOM 365 CB ASN A 352 10.881 -11.144 2.973 1.00 0.27 C ATOM 366 CG ASN A 352 11.610 -11.882 1.860 1.00 1.03 C ATOM 367 OD1 ASN A 352 12.837 -11.965 1.862 1.00 1.83 O ATOM 368 ND2 ASN A 352 10.864 -12.438 0.916 1.00 1.62 N ATOM 0 H ASN A 352 9.566 -9.532 4.442 1.00 0.19 H new ATOM 0 HA ASN A 352 11.752 -9.240 2.518 1.00 0.21 H new ATOM 0 HB2 ASN A 352 11.408 -11.305 3.913 1.00 0.27 H new ATOM 0 HB3 ASN A 352 9.884 -11.569 3.090 1.00 0.27 H new ATOM 0 HD21 ASN A 352 11.305 -12.957 0.157 1.00 1.62 H new ATOM 0 HD22 ASN A 352 9.849 -12.347 0.949 1.00 1.62 H new ATOM 375 N PHE A 353 8.648 -8.932 1.760 1.00 0.13 N ATOM 376 CA PHE A 353 7.713 -8.600 0.697 1.00 0.10 C ATOM 377 C PHE A 353 7.654 -7.092 0.486 1.00 0.08 C ATOM 378 O PHE A 353 7.352 -6.619 -0.608 1.00 0.07 O ATOM 379 CB PHE A 353 6.313 -9.101 1.043 1.00 0.09 C ATOM 380 CG PHE A 353 6.239 -10.569 1.337 1.00 0.12 C ATOM 381 CD1 PHE A 353 6.948 -11.478 0.578 1.00 0.17 C ATOM 382 CD2 PHE A 353 5.470 -11.035 2.386 1.00 0.13 C ATOM 383 CE1 PHE A 353 6.892 -12.827 0.854 1.00 0.19 C ATOM 384 CE2 PHE A 353 5.412 -12.383 2.673 1.00 0.17 C ATOM 385 CZ PHE A 353 6.125 -13.281 1.904 1.00 0.18 C ATOM 0 H PHE A 353 8.280 -8.790 2.701 1.00 0.13 H new ATOM 0 HA PHE A 353 8.062 -9.083 -0.216 1.00 0.10 H new ATOM 0 HB2 PHE A 353 5.946 -8.550 1.909 1.00 0.09 H new ATOM 0 HB3 PHE A 353 5.643 -8.874 0.214 1.00 0.09 H new ATOM 0 HD1 PHE A 353 7.555 -11.127 -0.244 1.00 0.17 H new ATOM 0 HD2 PHE A 353 4.908 -10.336 2.988 1.00 0.13 H new ATOM 0 HE1 PHE A 353 7.448 -13.527 0.248 1.00 0.19 H new ATOM 0 HE2 PHE A 353 4.810 -12.735 3.498 1.00 0.17 H new ATOM 0 HZ PHE A 353 6.081 -14.337 2.125 1.00 0.18 H new ATOM 395 N ILE A 354 7.949 -6.347 1.536 1.00 0.08 N ATOM 396 CA ILE A 354 7.844 -4.894 1.517 1.00 0.07 C ATOM 397 C ILE A 354 8.546 -4.331 2.745 1.00 0.08 C ATOM 398 O ILE A 354 8.634 -5.007 3.764 1.00 0.10 O ATOM 399 CB ILE A 354 6.360 -4.468 1.514 1.00 0.07 C ATOM 400 CG1 ILE A 354 6.190 -3.002 1.127 1.00 0.07 C ATOM 401 CG2 ILE A 354 5.734 -4.737 2.871 1.00 0.08 C ATOM 402 CD1 ILE A 354 4.741 -2.555 1.103 1.00 0.07 C ATOM 0 H ILE A 354 8.268 -6.729 2.426 1.00 0.08 H new ATOM 0 HA ILE A 354 8.316 -4.506 0.615 1.00 0.07 H new ATOM 0 HB ILE A 354 5.846 -5.064 0.760 1.00 0.07 H new ATOM 0 HG12 ILE A 354 6.744 -2.381 1.831 1.00 0.07 H new ATOM 0 HG13 ILE A 354 6.630 -2.839 0.143 1.00 0.07 H new ATOM 0 HG21 ILE A 354 4.688 -4.432 2.856 1.00 0.08 H new ATOM 0 HG22 ILE A 354 5.799 -5.801 3.097 1.00 0.08 H new ATOM 0 HG23 ILE A 354 6.266 -4.171 3.636 1.00 0.08 H new ATOM 0 HD11 ILE A 354 4.689 -1.503 0.821 1.00 0.07 H new ATOM 0 HD12 ILE A 354 4.188 -3.153 0.379 1.00 0.07 H new ATOM 0 HD13 ILE A 354 4.303 -2.687 2.092 1.00 0.07 H new ATOM 414 N ARG A 355 9.062 -3.119 2.655 1.00 0.09 N ATOM 415 CA ARG A 355 9.791 -2.537 3.776 1.00 0.11 C ATOM 416 C ARG A 355 9.962 -1.038 3.596 1.00 0.10 C ATOM 417 O ARG A 355 9.953 -0.533 2.476 1.00 0.14 O ATOM 418 CB ARG A 355 11.171 -3.183 3.893 1.00 0.16 C ATOM 419 CG ARG A 355 12.124 -2.742 2.798 1.00 0.22 C ATOM 420 CD ARG A 355 13.494 -3.355 2.973 1.00 0.25 C ATOM 421 NE ARG A 355 14.505 -2.662 2.180 1.00 0.98 N ATOM 422 CZ ARG A 355 15.802 -2.952 2.202 1.00 1.40 C ATOM 423 NH1 ARG A 355 16.246 -3.990 2.901 1.00 1.43 N ATOM 424 NH2 ARG A 355 16.652 -2.202 1.511 1.00 2.08 N ATOM 0 H ARG A 355 8.994 -2.522 1.831 1.00 0.09 H new ATOM 0 HA ARG A 355 9.214 -2.721 4.682 1.00 0.11 H new ATOM 0 HB2 ARG A 355 11.601 -2.936 4.863 1.00 0.16 H new ATOM 0 HB3 ARG A 355 11.063 -4.267 3.859 1.00 0.16 H new ATOM 0 HG2 ARG A 355 11.719 -3.026 1.827 1.00 0.22 H new ATOM 0 HG3 ARG A 355 12.208 -1.655 2.803 1.00 0.22 H new ATOM 0 HD2 ARG A 355 13.774 -3.324 4.026 1.00 0.25 H new ATOM 0 HD3 ARG A 355 13.462 -4.405 2.683 1.00 0.25 H new ATOM 0 HE ARG A 355 14.196 -1.906 1.569 1.00 0.98 H new ATOM 0 HH11 ARG A 355 15.591 -4.570 3.425 1.00 1.43 H new ATOM 0 HH12 ARG A 355 17.242 -4.207 2.914 1.00 1.43 H new ATOM 0 HH21 ARG A 355 16.308 -1.410 0.968 1.00 2.08 H new ATOM 0 HH22 ARG A 355 17.649 -2.418 1.523 1.00 2.08 H new ATOM 438 N TRP A 356 10.113 -0.336 4.706 1.00 0.10 N ATOM 439 CA TRP A 356 10.453 1.075 4.681 1.00 0.09 C ATOM 440 C TRP A 356 11.874 1.268 4.170 1.00 0.09 C ATOM 441 O TRP A 356 12.797 0.583 4.612 1.00 0.14 O ATOM 442 CB TRP A 356 10.384 1.685 6.081 1.00 0.10 C ATOM 443 CG TRP A 356 9.013 1.850 6.657 1.00 0.10 C ATOM 444 CD1 TRP A 356 8.554 1.314 7.822 1.00 0.12 C ATOM 445 CD2 TRP A 356 7.938 2.623 6.118 1.00 0.10 C ATOM 446 NE1 TRP A 356 7.263 1.721 8.051 1.00 0.12 N ATOM 447 CE2 TRP A 356 6.862 2.520 7.016 1.00 0.12 C ATOM 448 CE3 TRP A 356 7.778 3.394 4.966 1.00 0.11 C ATOM 449 CZ2 TRP A 356 5.651 3.162 6.802 1.00 0.13 C ATOM 450 CZ3 TRP A 356 6.573 4.030 4.752 1.00 0.12 C ATOM 451 CH2 TRP A 356 5.524 3.915 5.664 1.00 0.13 C ATOM 0 H TRP A 356 10.004 -0.725 5.643 1.00 0.10 H new ATOM 0 HA TRP A 356 9.734 1.565 4.024 1.00 0.09 H new ATOM 0 HB2 TRP A 356 10.968 1.061 6.757 1.00 0.10 H new ATOM 0 HB3 TRP A 356 10.865 2.663 6.054 1.00 0.10 H new ATOM 0 HD1 TRP A 356 9.122 0.664 8.471 1.00 0.12 H new ATOM 0 HE1 TRP A 356 6.696 1.469 8.860 1.00 0.12 H new ATOM 0 HE3 TRP A 356 8.584 3.491 4.254 1.00 0.11 H new ATOM 0 HZ2 TRP A 356 4.838 3.072 7.507 1.00 0.13 H new ATOM 0 HZ3 TRP A 356 6.439 4.628 3.862 1.00 0.12 H new ATOM 0 HH2 TRP A 356 4.594 4.429 5.470 1.00 0.13 H new ATOM 462 N GLU A 357 12.047 2.191 3.243 1.00 0.10 N ATOM 463 CA GLU A 357 13.375 2.649 2.869 1.00 0.12 C ATOM 464 C GLU A 357 13.689 3.914 3.650 1.00 0.14 C ATOM 465 O GLU A 357 14.802 4.112 4.138 1.00 0.21 O ATOM 466 CB GLU A 357 13.472 2.904 1.371 1.00 0.16 C ATOM 467 CG GLU A 357 13.452 1.637 0.536 1.00 0.25 C ATOM 468 CD GLU A 357 14.566 0.668 0.885 1.00 0.36 C ATOM 469 OE1 GLU A 357 15.592 1.118 1.429 1.00 0.61 O ATOM 470 OE2 GLU A 357 14.421 -0.545 0.622 1.00 0.78 O ATOM 0 H GLU A 357 11.285 2.640 2.734 1.00 0.10 H new ATOM 0 HA GLU A 357 14.103 1.874 3.109 1.00 0.12 H new ATOM 0 HB2 GLU A 357 12.644 3.543 1.066 1.00 0.16 H new ATOM 0 HB3 GLU A 357 14.391 3.452 1.163 1.00 0.16 H new ATOM 0 HG2 GLU A 357 12.492 1.138 0.669 1.00 0.25 H new ATOM 0 HG3 GLU A 357 13.530 1.904 -0.518 1.00 0.25 H new ATOM 477 N ASP A 358 12.672 4.751 3.780 1.00 0.14 N ATOM 478 CA ASP A 358 12.732 5.944 4.612 1.00 0.16 C ATOM 479 C ASP A 358 11.429 6.075 5.378 1.00 0.16 C ATOM 480 O ASP A 358 10.499 6.740 4.931 1.00 0.20 O ATOM 481 CB ASP A 358 12.974 7.206 3.781 1.00 0.20 C ATOM 482 CG ASP A 358 14.387 7.302 3.242 1.00 0.92 C ATOM 483 OD1 ASP A 358 15.307 7.647 4.015 1.00 1.46 O ATOM 484 OD2 ASP A 358 14.590 7.016 2.043 1.00 1.33 O ATOM 0 H ASP A 358 11.777 4.622 3.309 1.00 0.14 H new ATOM 0 HA ASP A 358 13.570 5.841 5.301 1.00 0.16 H new ATOM 0 HB2 ASP A 358 12.272 7.225 2.948 1.00 0.20 H new ATOM 0 HB3 ASP A 358 12.765 8.083 4.394 1.00 0.20 H new ATOM 489 N LYS A 359 11.373 5.413 6.522 1.00 0.15 N ATOM 490 CA LYS A 359 10.174 5.357 7.350 1.00 0.17 C ATOM 491 C LYS A 359 9.630 6.743 7.668 1.00 0.19 C ATOM 492 O LYS A 359 8.421 6.980 7.617 1.00 0.23 O ATOM 493 CB LYS A 359 10.505 4.627 8.642 1.00 0.23 C ATOM 494 CG LYS A 359 9.317 4.433 9.564 1.00 0.29 C ATOM 495 CD LYS A 359 9.539 3.248 10.484 1.00 0.38 C ATOM 496 CE LYS A 359 8.311 2.928 11.312 1.00 0.91 C ATOM 497 NZ LYS A 359 8.521 1.722 12.153 1.00 1.50 N ATOM 0 H LYS A 359 12.163 4.895 6.907 1.00 0.15 H new ATOM 0 HA LYS A 359 9.401 4.826 6.794 1.00 0.17 H new ATOM 0 HB2 LYS A 359 10.925 3.651 8.398 1.00 0.23 H new ATOM 0 HB3 LYS A 359 11.277 5.183 9.174 1.00 0.23 H new ATOM 0 HG2 LYS A 359 9.159 5.334 10.156 1.00 0.29 H new ATOM 0 HG3 LYS A 359 8.414 4.277 8.974 1.00 0.29 H new ATOM 0 HD2 LYS A 359 9.812 2.376 9.890 1.00 0.38 H new ATOM 0 HD3 LYS A 359 10.378 3.458 11.148 1.00 0.38 H new ATOM 0 HE2 LYS A 359 8.068 3.779 11.948 1.00 0.91 H new ATOM 0 HE3 LYS A 359 7.458 2.769 10.653 1.00 0.91 H new ATOM 0 HZ1 LYS A 359 7.662 1.531 12.707 1.00 1.50 H new ATOM 0 HZ2 LYS A 359 8.729 0.905 11.543 1.00 1.50 H new ATOM 0 HZ3 LYS A 359 9.320 1.884 12.799 1.00 1.50 H new ATOM 511 N GLU A 360 10.531 7.654 7.981 1.00 0.21 N ATOM 512 CA GLU A 360 10.154 8.993 8.400 1.00 0.27 C ATOM 513 C GLU A 360 9.608 9.809 7.232 1.00 0.24 C ATOM 514 O GLU A 360 8.769 10.687 7.419 1.00 0.37 O ATOM 515 CB GLU A 360 11.356 9.670 9.036 1.00 0.41 C ATOM 516 CG GLU A 360 11.942 8.848 10.172 1.00 0.63 C ATOM 517 CD GLU A 360 13.356 9.251 10.522 1.00 1.75 C ATOM 518 OE1 GLU A 360 14.230 9.184 9.633 1.00 2.67 O ATOM 519 OE2 GLU A 360 13.601 9.625 11.688 1.00 1.97 O ATOM 0 H GLU A 360 11.537 7.491 7.953 1.00 0.21 H new ATOM 0 HA GLU A 360 9.352 8.925 9.135 1.00 0.27 H new ATOM 0 HB2 GLU A 360 12.121 9.836 8.278 1.00 0.41 H new ATOM 0 HB3 GLU A 360 11.062 10.650 9.412 1.00 0.41 H new ATOM 0 HG2 GLU A 360 11.310 8.955 11.054 1.00 0.63 H new ATOM 0 HG3 GLU A 360 11.928 7.794 9.895 1.00 0.63 H new ATOM 526 N SER A 361 10.062 9.497 6.026 1.00 0.19 N ATOM 527 CA SER A 361 9.554 10.154 4.830 1.00 0.21 C ATOM 528 C SER A 361 8.440 9.321 4.201 1.00 0.19 C ATOM 529 O SER A 361 7.962 9.625 3.107 1.00 0.24 O ATOM 530 CB SER A 361 10.684 10.364 3.821 1.00 0.26 C ATOM 531 OG SER A 361 11.734 11.139 4.374 1.00 0.31 O ATOM 0 H SER A 361 10.780 8.794 5.850 1.00 0.19 H new ATOM 0 HA SER A 361 9.149 11.126 5.113 1.00 0.21 H new ATOM 0 HB2 SER A 361 11.073 9.397 3.502 1.00 0.26 H new ATOM 0 HB3 SER A 361 10.293 10.860 2.932 1.00 0.26 H new ATOM 0 HG SER A 361 12.442 11.255 3.706 1.00 0.31 H new ATOM 537 N LYS A 362 8.037 8.271 4.919 1.00 0.15 N ATOM 538 CA LYS A 362 7.029 7.328 4.451 1.00 0.14 C ATOM 539 C LYS A 362 7.385 6.741 3.089 1.00 0.12 C ATOM 540 O LYS A 362 6.529 6.555 2.229 1.00 0.15 O ATOM 541 CB LYS A 362 5.645 7.973 4.426 1.00 0.20 C ATOM 542 CG LYS A 362 4.855 7.737 5.701 1.00 0.48 C ATOM 543 CD LYS A 362 5.482 8.432 6.893 1.00 0.48 C ATOM 544 CE LYS A 362 4.829 7.998 8.195 1.00 0.51 C ATOM 545 NZ LYS A 362 5.415 8.689 9.374 1.00 1.23 N ATOM 0 H LYS A 362 8.405 8.053 5.845 1.00 0.15 H new ATOM 0 HA LYS A 362 7.006 6.502 5.161 1.00 0.14 H new ATOM 0 HB2 LYS A 362 5.753 9.046 4.266 1.00 0.20 H new ATOM 0 HB3 LYS A 362 5.083 7.580 3.579 1.00 0.20 H new ATOM 0 HG2 LYS A 362 3.835 8.096 5.567 1.00 0.48 H new ATOM 0 HG3 LYS A 362 4.793 6.666 5.896 1.00 0.48 H new ATOM 0 HD2 LYS A 362 6.548 8.208 6.927 1.00 0.48 H new ATOM 0 HD3 LYS A 362 5.386 9.512 6.778 1.00 0.48 H new ATOM 0 HE2 LYS A 362 3.760 8.204 8.150 1.00 0.51 H new ATOM 0 HE3 LYS A 362 4.941 6.920 8.314 1.00 0.51 H new ATOM 0 HZ1 LYS A 362 4.940 8.362 10.239 1.00 1.23 H new ATOM 0 HZ2 LYS A 362 6.430 8.472 9.434 1.00 1.23 H new ATOM 0 HZ3 LYS A 362 5.285 9.716 9.274 1.00 1.23 H new ATOM 559 N ILE A 363 8.657 6.436 2.918 1.00 0.09 N ATOM 560 CA ILE A 363 9.144 5.806 1.708 1.00 0.09 C ATOM 561 C ILE A 363 9.346 4.321 1.941 1.00 0.08 C ATOM 562 O ILE A 363 10.001 3.928 2.906 1.00 0.10 O ATOM 563 CB ILE A 363 10.481 6.418 1.269 1.00 0.10 C ATOM 564 CG1 ILE A 363 10.295 7.879 0.860 1.00 0.16 C ATOM 565 CG2 ILE A 363 11.079 5.603 0.136 1.00 0.13 C ATOM 566 CD1 ILE A 363 11.590 8.651 0.768 1.00 0.46 C ATOM 0 H ILE A 363 9.380 6.618 3.614 1.00 0.09 H new ATOM 0 HA ILE A 363 8.401 5.968 0.927 1.00 0.09 H new ATOM 0 HB ILE A 363 11.174 6.395 2.110 1.00 0.10 H new ATOM 0 HG12 ILE A 363 9.790 7.916 -0.105 1.00 0.16 H new ATOM 0 HG13 ILE A 363 9.640 8.369 1.581 1.00 0.16 H new ATOM 0 HG21 ILE A 363 12.028 6.045 -0.169 1.00 0.13 H new ATOM 0 HG22 ILE A 363 11.247 4.580 0.473 1.00 0.13 H new ATOM 0 HG23 ILE A 363 10.392 5.598 -0.711 1.00 0.13 H new ATOM 0 HD11 ILE A 363 11.380 9.679 0.473 1.00 0.46 H new ATOM 0 HD12 ILE A 363 12.086 8.646 1.738 1.00 0.46 H new ATOM 0 HD13 ILE A 363 12.239 8.186 0.026 1.00 0.46 H new ATOM 578 N PHE A 364 8.814 3.499 1.057 1.00 0.09 N ATOM 579 CA PHE A 364 8.919 2.065 1.214 1.00 0.09 C ATOM 580 C PHE A 364 9.236 1.403 -0.122 1.00 0.10 C ATOM 581 O PHE A 364 8.863 1.903 -1.185 1.00 0.13 O ATOM 582 CB PHE A 364 7.624 1.495 1.807 1.00 0.09 C ATOM 583 CG PHE A 364 6.462 1.480 0.863 1.00 0.08 C ATOM 584 CD1 PHE A 364 5.632 2.571 0.769 1.00 0.13 C ATOM 585 CD2 PHE A 364 6.201 0.371 0.080 1.00 0.12 C ATOM 586 CE1 PHE A 364 4.551 2.567 -0.095 1.00 0.14 C ATOM 587 CE2 PHE A 364 5.127 0.354 -0.785 1.00 0.12 C ATOM 588 CZ PHE A 364 4.299 1.452 -0.873 1.00 0.08 C ATOM 0 H PHE A 364 8.306 3.801 0.225 1.00 0.09 H new ATOM 0 HA PHE A 364 9.736 1.851 1.904 1.00 0.09 H new ATOM 0 HB2 PHE A 364 7.813 0.477 2.147 1.00 0.09 H new ATOM 0 HB3 PHE A 364 7.354 2.080 2.686 1.00 0.09 H new ATOM 0 HD1 PHE A 364 5.826 3.442 1.377 1.00 0.13 H new ATOM 0 HD2 PHE A 364 6.846 -0.493 0.146 1.00 0.12 H new ATOM 0 HE1 PHE A 364 3.907 3.431 -0.161 1.00 0.14 H new ATOM 0 HE2 PHE A 364 4.935 -0.518 -1.392 1.00 0.12 H new ATOM 0 HZ PHE A 364 3.456 1.442 -1.548 1.00 0.08 H new ATOM 598 N ARG A 365 9.946 0.296 -0.055 1.00 0.10 N ATOM 599 CA ARG A 365 10.251 -0.502 -1.224 1.00 0.12 C ATOM 600 C ARG A 365 9.479 -1.807 -1.137 1.00 0.11 C ATOM 601 O ARG A 365 9.542 -2.494 -0.117 1.00 0.18 O ATOM 602 CB ARG A 365 11.752 -0.804 -1.265 1.00 0.17 C ATOM 603 CG ARG A 365 12.181 -1.687 -2.425 1.00 0.17 C ATOM 604 CD ARG A 365 12.729 -0.871 -3.582 1.00 0.31 C ATOM 605 NE ARG A 365 14.159 -1.123 -3.798 1.00 0.77 N ATOM 606 CZ ARG A 365 15.146 -0.352 -3.328 1.00 0.63 C ATOM 607 NH1 ARG A 365 14.870 0.724 -2.602 1.00 1.48 N ATOM 608 NH2 ARG A 365 16.413 -0.669 -3.576 1.00 0.99 N ATOM 0 H ARG A 365 10.329 -0.077 0.814 1.00 0.10 H new ATOM 0 HA ARG A 365 9.970 0.042 -2.126 1.00 0.12 H new ATOM 0 HB2 ARG A 365 12.299 0.137 -1.319 1.00 0.17 H new ATOM 0 HB3 ARG A 365 12.039 -1.287 -0.331 1.00 0.17 H new ATOM 0 HG2 ARG A 365 12.941 -2.391 -2.085 1.00 0.17 H new ATOM 0 HG3 ARG A 365 11.330 -2.277 -2.767 1.00 0.17 H new ATOM 0 HD2 ARG A 365 12.176 -1.111 -4.490 1.00 0.31 H new ATOM 0 HD3 ARG A 365 12.573 0.190 -3.385 1.00 0.31 H new ATOM 0 HE ARG A 365 14.418 -1.944 -4.345 1.00 0.77 H new ATOM 0 HH11 ARG A 365 13.900 0.967 -2.399 1.00 1.48 H new ATOM 0 HH12 ARG A 365 15.627 1.308 -2.247 1.00 1.48 H new ATOM 0 HH21 ARG A 365 16.633 -1.500 -4.125 1.00 0.99 H new ATOM 0 HH22 ARG A 365 17.165 -0.081 -3.218 1.00 0.99 H new ATOM 622 N ILE A 366 8.726 -2.144 -2.170 1.00 0.07 N ATOM 623 CA ILE A 366 8.128 -3.447 -2.236 1.00 0.06 C ATOM 624 C ILE A 366 9.204 -4.451 -2.579 1.00 0.07 C ATOM 625 O ILE A 366 9.718 -4.497 -3.696 1.00 0.10 O ATOM 626 CB ILE A 366 6.965 -3.490 -3.235 1.00 0.06 C ATOM 627 CG1 ILE A 366 5.785 -2.712 -2.647 1.00 0.07 C ATOM 628 CG2 ILE A 366 6.576 -4.928 -3.561 1.00 0.07 C ATOM 629 CD1 ILE A 366 4.683 -2.444 -3.631 1.00 0.09 C ATOM 0 H ILE A 366 8.521 -1.534 -2.962 1.00 0.07 H new ATOM 0 HA ILE A 366 7.697 -3.698 -1.267 1.00 0.06 H new ATOM 0 HB ILE A 366 7.270 -3.026 -4.173 1.00 0.06 H new ATOM 0 HG12 ILE A 366 5.378 -3.270 -1.804 1.00 0.07 H new ATOM 0 HG13 ILE A 366 6.148 -1.762 -2.255 1.00 0.07 H new ATOM 0 HG21 ILE A 366 5.749 -4.929 -4.271 1.00 0.07 H new ATOM 0 HG22 ILE A 366 7.430 -5.446 -3.997 1.00 0.07 H new ATOM 0 HG23 ILE A 366 6.270 -5.438 -2.648 1.00 0.07 H new ATOM 0 HD11 ILE A 366 3.884 -1.889 -3.140 1.00 0.09 H new ATOM 0 HD12 ILE A 366 5.073 -1.858 -4.463 1.00 0.09 H new ATOM 0 HD13 ILE A 366 4.291 -3.390 -4.005 1.00 0.09 H new ATOM 641 N VAL A 367 9.552 -5.220 -1.582 1.00 0.07 N ATOM 642 CA VAL A 367 10.711 -6.090 -1.637 1.00 0.08 C ATOM 643 C VAL A 367 10.409 -7.352 -2.428 1.00 0.09 C ATOM 644 O VAL A 367 11.225 -7.811 -3.231 1.00 0.12 O ATOM 645 CB VAL A 367 11.168 -6.434 -0.215 1.00 0.09 C ATOM 646 CG1 VAL A 367 12.308 -7.424 -0.234 1.00 0.12 C ATOM 647 CG2 VAL A 367 11.566 -5.164 0.513 1.00 0.10 C ATOM 0 H VAL A 367 9.041 -5.265 -0.701 1.00 0.07 H new ATOM 0 HA VAL A 367 11.517 -5.566 -2.150 1.00 0.08 H new ATOM 0 HB VAL A 367 10.339 -6.902 0.316 1.00 0.09 H new ATOM 0 HG11 VAL A 367 12.611 -7.649 0.788 1.00 0.12 H new ATOM 0 HG12 VAL A 367 11.985 -8.341 -0.727 1.00 0.12 H new ATOM 0 HG13 VAL A 367 13.151 -6.997 -0.777 1.00 0.12 H new ATOM 0 HG21 VAL A 367 11.891 -5.411 1.524 1.00 0.10 H new ATOM 0 HG22 VAL A 367 12.382 -4.679 -0.022 1.00 0.10 H new ATOM 0 HG23 VAL A 367 10.711 -4.489 0.561 1.00 0.10 H new ATOM 657 N ASP A 368 9.238 -7.904 -2.192 1.00 0.08 N ATOM 658 CA ASP A 368 8.742 -9.009 -2.983 1.00 0.09 C ATOM 659 C ASP A 368 7.261 -8.829 -3.232 1.00 0.08 C ATOM 660 O ASP A 368 6.419 -9.248 -2.444 1.00 0.09 O ATOM 661 CB ASP A 368 9.016 -10.345 -2.315 1.00 0.12 C ATOM 662 CG ASP A 368 8.595 -11.514 -3.186 1.00 0.22 C ATOM 663 OD1 ASP A 368 8.999 -11.561 -4.365 1.00 0.78 O ATOM 664 OD2 ASP A 368 7.876 -12.402 -2.682 1.00 0.45 O ATOM 0 H ASP A 368 8.606 -7.601 -1.451 1.00 0.08 H new ATOM 0 HA ASP A 368 9.271 -9.013 -3.936 1.00 0.09 H new ATOM 0 HB2 ASP A 368 10.079 -10.426 -2.089 1.00 0.12 H new ATOM 0 HB3 ASP A 368 8.484 -10.391 -1.365 1.00 0.12 H new ATOM 669 N PRO A 369 6.948 -8.170 -4.340 1.00 0.09 N ATOM 670 CA PRO A 369 5.580 -7.836 -4.735 1.00 0.10 C ATOM 671 C PRO A 369 4.704 -9.068 -4.882 1.00 0.12 C ATOM 672 O PRO A 369 3.508 -9.026 -4.611 1.00 0.14 O ATOM 673 CB PRO A 369 5.765 -7.130 -6.083 1.00 0.12 C ATOM 674 CG PRO A 369 7.123 -7.509 -6.540 1.00 0.12 C ATOM 675 CD PRO A 369 7.931 -7.691 -5.302 1.00 0.10 C ATOM 0 HA PRO A 369 5.073 -7.224 -3.989 1.00 0.10 H new ATOM 0 HB2 PRO A 369 5.007 -7.445 -6.800 1.00 0.12 H new ATOM 0 HB3 PRO A 369 5.673 -6.049 -5.977 1.00 0.12 H new ATOM 0 HG2 PRO A 369 7.096 -8.426 -7.128 1.00 0.12 H new ATOM 0 HG3 PRO A 369 7.552 -6.735 -7.177 1.00 0.12 H new ATOM 0 HD2 PRO A 369 8.737 -8.410 -5.448 1.00 0.10 H new ATOM 0 HD3 PRO A 369 8.391 -6.757 -4.979 1.00 0.10 H new ATOM 683 N ASN A 370 5.313 -10.164 -5.298 1.00 0.13 N ATOM 684 CA ASN A 370 4.615 -11.432 -5.426 1.00 0.17 C ATOM 685 C ASN A 370 4.154 -11.899 -4.057 1.00 0.17 C ATOM 686 O ASN A 370 3.011 -12.320 -3.866 1.00 0.21 O ATOM 687 CB ASN A 370 5.560 -12.459 -6.022 1.00 0.21 C ATOM 688 CG ASN A 370 4.833 -13.612 -6.688 1.00 0.36 C ATOM 689 OD1 ASN A 370 4.506 -13.554 -7.873 1.00 0.62 O ATOM 690 ND2 ASN A 370 4.594 -14.673 -5.936 1.00 0.59 N ATOM 0 H ASN A 370 6.299 -10.201 -5.555 1.00 0.13 H new ATOM 0 HA ASN A 370 3.747 -11.311 -6.074 1.00 0.17 H new ATOM 0 HB2 ASN A 370 6.205 -11.971 -6.753 1.00 0.21 H new ATOM 0 HB3 ASN A 370 6.207 -12.849 -5.237 1.00 0.21 H new ATOM 0 HD21 ASN A 370 4.122 -15.485 -6.334 1.00 0.59 H new ATOM 0 HD22 ASN A 370 4.882 -14.680 -4.958 1.00 0.59 H new ATOM 697 N GLY A 371 5.070 -11.805 -3.110 1.00 0.16 N ATOM 698 CA GLY A 371 4.781 -12.146 -1.736 1.00 0.19 C ATOM 699 C GLY A 371 3.829 -11.164 -1.099 1.00 0.13 C ATOM 700 O GLY A 371 3.005 -11.533 -0.265 1.00 0.13 O ATOM 0 H GLY A 371 6.027 -11.492 -3.273 1.00 0.16 H new ATOM 0 HA2 GLY A 371 4.352 -13.147 -1.693 1.00 0.19 H new ATOM 0 HA3 GLY A 371 5.710 -12.173 -1.166 1.00 0.19 H new ATOM 704 N LEU A 372 3.932 -9.914 -1.515 1.00 0.10 N ATOM 705 CA LEU A 372 3.167 -8.840 -0.908 1.00 0.08 C ATOM 706 C LEU A 372 1.726 -8.922 -1.378 1.00 0.11 C ATOM 707 O LEU A 372 0.786 -8.750 -0.609 1.00 0.13 O ATOM 708 CB LEU A 372 3.771 -7.483 -1.287 1.00 0.08 C ATOM 709 CG LEU A 372 3.522 -6.340 -0.297 1.00 0.08 C ATOM 710 CD1 LEU A 372 2.068 -5.896 -0.305 1.00 0.10 C ATOM 711 CD2 LEU A 372 3.912 -6.774 1.101 1.00 0.09 C ATOM 0 H LEU A 372 4.543 -9.617 -2.276 1.00 0.10 H new ATOM 0 HA LEU A 372 3.198 -8.942 0.177 1.00 0.08 H new ATOM 0 HB2 LEU A 372 4.847 -7.607 -1.406 1.00 0.08 H new ATOM 0 HB3 LEU A 372 3.374 -7.189 -2.259 1.00 0.08 H new ATOM 0 HG LEU A 372 4.135 -5.494 -0.607 1.00 0.08 H new ATOM 0 HD11 LEU A 372 1.931 -5.084 0.410 1.00 0.10 H new ATOM 0 HD12 LEU A 372 1.799 -5.550 -1.303 1.00 0.10 H new ATOM 0 HD13 LEU A 372 1.430 -6.735 -0.027 1.00 0.10 H new ATOM 0 HD21 LEU A 372 3.732 -5.956 1.799 1.00 0.09 H new ATOM 0 HD22 LEU A 372 3.316 -7.638 1.393 1.00 0.09 H new ATOM 0 HD23 LEU A 372 4.969 -7.040 1.118 1.00 0.09 H new ATOM 723 N ALA A 373 1.576 -9.206 -2.656 1.00 0.12 N ATOM 724 CA ALA A 373 0.276 -9.345 -3.269 1.00 0.15 C ATOM 725 C ALA A 373 -0.501 -10.463 -2.606 1.00 0.14 C ATOM 726 O ALA A 373 -1.693 -10.325 -2.339 1.00 0.16 O ATOM 727 CB ALA A 373 0.446 -9.623 -4.743 1.00 0.20 C ATOM 0 H ALA A 373 2.356 -9.347 -3.298 1.00 0.12 H new ATOM 0 HA ALA A 373 -0.284 -8.419 -3.141 1.00 0.15 H new ATOM 0 HB1 ALA A 373 -0.534 -9.729 -5.209 1.00 0.20 H new ATOM 0 HB2 ALA A 373 0.983 -8.797 -5.210 1.00 0.20 H new ATOM 0 HB3 ALA A 373 1.012 -10.545 -4.876 1.00 0.20 H new ATOM 733 N ARG A 374 0.191 -11.564 -2.317 1.00 0.14 N ATOM 734 CA ARG A 374 -0.434 -12.699 -1.658 1.00 0.17 C ATOM 735 C ARG A 374 -0.980 -12.270 -0.299 1.00 0.14 C ATOM 736 O ARG A 374 -1.989 -12.789 0.162 1.00 0.16 O ATOM 737 CB ARG A 374 0.551 -13.872 -1.524 1.00 0.24 C ATOM 738 CG ARG A 374 1.121 -14.052 -0.137 1.00 0.28 C ATOM 739 CD ARG A 374 2.022 -15.273 -0.052 1.00 0.47 C ATOM 740 NE ARG A 374 3.209 -15.157 -0.902 1.00 1.44 N ATOM 741 CZ ARG A 374 4.104 -16.134 -1.058 1.00 2.04 C ATOM 742 NH1 ARG A 374 3.934 -17.291 -0.436 1.00 2.01 N ATOM 743 NH2 ARG A 374 5.163 -15.960 -1.839 1.00 3.03 N ATOM 0 H ARG A 374 1.181 -11.690 -2.530 1.00 0.14 H new ATOM 0 HA ARG A 374 -1.266 -13.048 -2.270 1.00 0.17 H new ATOM 0 HB2 ARG A 374 0.044 -14.791 -1.818 1.00 0.24 H new ATOM 0 HB3 ARG A 374 1.372 -13.723 -2.225 1.00 0.24 H new ATOM 0 HG2 ARG A 374 1.686 -13.163 0.142 1.00 0.28 H new ATOM 0 HG3 ARG A 374 0.307 -14.150 0.581 1.00 0.28 H new ATOM 0 HD2 ARG A 374 2.333 -15.419 0.982 1.00 0.47 H new ATOM 0 HD3 ARG A 374 1.456 -16.158 -0.343 1.00 0.47 H new ATOM 0 HE ARG A 374 3.360 -14.281 -1.402 1.00 1.44 H new ATOM 0 HH11 ARG A 374 3.120 -17.434 0.161 1.00 2.01 H new ATOM 0 HH12 ARG A 374 4.617 -18.039 -0.554 1.00 2.01 H new ATOM 0 HH21 ARG A 374 5.298 -15.074 -2.326 1.00 3.03 H new ATOM 0 HH22 ARG A 374 5.842 -16.712 -1.952 1.00 3.03 H new ATOM 757 N LEU A 375 -0.321 -11.293 0.320 1.00 0.13 N ATOM 758 CA LEU A 375 -0.803 -10.707 1.565 1.00 0.15 C ATOM 759 C LEU A 375 -2.110 -9.975 1.310 1.00 0.16 C ATOM 760 O LEU A 375 -3.069 -10.115 2.061 1.00 0.18 O ATOM 761 CB LEU A 375 0.225 -9.717 2.127 1.00 0.17 C ATOM 762 CG LEU A 375 1.297 -10.273 3.068 1.00 0.16 C ATOM 763 CD1 LEU A 375 1.703 -11.678 2.690 1.00 0.29 C ATOM 764 CD2 LEU A 375 2.513 -9.368 3.032 1.00 0.15 C ATOM 0 H LEU A 375 0.551 -10.890 -0.023 1.00 0.13 H new ATOM 0 HA LEU A 375 -0.958 -11.507 2.288 1.00 0.15 H new ATOM 0 HB2 LEU A 375 0.729 -9.241 1.286 1.00 0.17 H new ATOM 0 HB3 LEU A 375 -0.317 -8.934 2.658 1.00 0.17 H new ATOM 0 HG LEU A 375 0.878 -10.307 4.074 1.00 0.16 H new ATOM 0 HD11 LEU A 375 2.465 -12.035 3.382 1.00 0.29 H new ATOM 0 HD12 LEU A 375 0.833 -12.333 2.738 1.00 0.29 H new ATOM 0 HD13 LEU A 375 2.104 -11.681 1.676 1.00 0.29 H new ATOM 0 HD21 LEU A 375 3.279 -9.761 3.701 1.00 0.15 H new ATOM 0 HD22 LEU A 375 2.906 -9.326 2.016 1.00 0.15 H new ATOM 0 HD23 LEU A 375 2.230 -8.366 3.353 1.00 0.15 H new ATOM 776 N TRP A 376 -2.136 -9.203 0.232 1.00 0.16 N ATOM 777 CA TRP A 376 -3.320 -8.439 -0.136 1.00 0.18 C ATOM 778 C TRP A 376 -4.496 -9.384 -0.395 1.00 0.20 C ATOM 779 O TRP A 376 -5.627 -9.114 0.005 1.00 0.25 O ATOM 780 CB TRP A 376 -3.018 -7.592 -1.377 1.00 0.19 C ATOM 781 CG TRP A 376 -3.969 -6.448 -1.616 1.00 0.18 C ATOM 782 CD1 TRP A 376 -4.437 -6.008 -2.823 1.00 0.20 C ATOM 783 CD2 TRP A 376 -4.564 -5.596 -0.628 1.00 0.18 C ATOM 784 NE1 TRP A 376 -5.253 -4.916 -2.645 1.00 0.21 N ATOM 785 CE2 TRP A 376 -5.352 -4.648 -1.309 1.00 0.21 C ATOM 786 CE3 TRP A 376 -4.502 -5.538 0.763 1.00 0.19 C ATOM 787 CZ2 TRP A 376 -6.071 -3.657 -0.641 1.00 0.24 C ATOM 788 CZ3 TRP A 376 -5.213 -4.558 1.421 1.00 0.22 C ATOM 789 CH2 TRP A 376 -5.985 -3.630 0.718 1.00 0.24 C ATOM 0 H TRP A 376 -1.347 -9.089 -0.405 1.00 0.16 H new ATOM 0 HA TRP A 376 -3.593 -7.774 0.683 1.00 0.18 H new ATOM 0 HB2 TRP A 376 -2.008 -7.192 -1.288 1.00 0.19 H new ATOM 0 HB3 TRP A 376 -3.028 -8.241 -2.252 1.00 0.19 H new ATOM 0 HD1 TRP A 376 -4.200 -6.454 -3.778 1.00 0.20 H new ATOM 0 HE1 TRP A 376 -5.711 -4.391 -3.390 1.00 0.21 H new ATOM 0 HE3 TRP A 376 -3.907 -6.249 1.316 1.00 0.19 H new ATOM 0 HZ2 TRP A 376 -6.672 -2.940 -1.180 1.00 0.24 H new ATOM 0 HZ3 TRP A 376 -5.173 -4.506 2.499 1.00 0.22 H new ATOM 0 HH2 TRP A 376 -6.527 -2.873 1.265 1.00 0.24 H new ATOM 800 N GLY A 377 -4.214 -10.498 -1.061 1.00 0.21 N ATOM 801 CA GLY A 377 -5.231 -11.510 -1.283 1.00 0.27 C ATOM 802 C GLY A 377 -5.598 -12.241 -0.009 1.00 0.30 C ATOM 803 O GLY A 377 -6.730 -12.686 0.151 1.00 0.38 O ATOM 0 H GLY A 377 -3.298 -10.719 -1.452 1.00 0.21 H new ATOM 0 HA2 GLY A 377 -6.122 -11.042 -1.701 1.00 0.27 H new ATOM 0 HA3 GLY A 377 -4.872 -12.227 -2.021 1.00 0.27 H new ATOM 807 N ASN A 378 -4.632 -12.373 0.886 1.00 0.27 N ATOM 808 CA ASN A 378 -4.853 -12.981 2.193 1.00 0.30 C ATOM 809 C ASN A 378 -5.779 -12.118 3.044 1.00 0.30 C ATOM 810 O ASN A 378 -6.611 -12.627 3.795 1.00 0.35 O ATOM 811 CB ASN A 378 -3.519 -13.191 2.908 1.00 0.32 C ATOM 812 CG ASN A 378 -3.013 -14.614 2.810 1.00 0.38 C ATOM 813 OD1 ASN A 378 -3.369 -15.471 3.616 1.00 0.76 O ATOM 814 ND2 ASN A 378 -2.172 -14.864 1.829 1.00 0.42 N ATOM 0 H ASN A 378 -3.673 -12.063 0.729 1.00 0.27 H new ATOM 0 HA ASN A 378 -5.331 -13.949 2.045 1.00 0.30 H new ATOM 0 HB2 ASN A 378 -2.775 -12.517 2.483 1.00 0.32 H new ATOM 0 HB3 ASN A 378 -3.630 -12.922 3.959 1.00 0.32 H new ATOM 0 HD21 ASN A 378 -1.787 -15.801 1.714 1.00 0.42 H new ATOM 0 HD22 ASN A 378 -1.905 -14.120 1.184 1.00 0.42 H new ATOM 821 N HIS A 379 -5.622 -10.810 2.913 1.00 0.28 N ATOM 822 CA HIS A 379 -6.439 -9.844 3.641 1.00 0.30 C ATOM 823 C HIS A 379 -7.829 -9.719 3.011 1.00 0.32 C ATOM 824 O HIS A 379 -8.829 -9.585 3.714 1.00 0.38 O ATOM 825 CB HIS A 379 -5.713 -8.488 3.654 1.00 0.28 C ATOM 826 CG HIS A 379 -6.489 -7.333 4.228 1.00 0.32 C ATOM 827 ND1 HIS A 379 -6.455 -7.031 5.569 1.00 0.43 N ATOM 828 CD2 HIS A 379 -7.253 -6.411 3.589 1.00 0.31 C ATOM 829 CE1 HIS A 379 -7.191 -5.939 5.712 1.00 0.46 C ATOM 830 NE2 HIS A 379 -7.695 -5.529 4.541 1.00 0.38 N ATOM 0 H HIS A 379 -4.926 -10.386 2.300 1.00 0.28 H new ATOM 0 HA HIS A 379 -6.580 -10.187 4.666 1.00 0.30 H new ATOM 0 HB2 HIS A 379 -4.789 -8.598 4.222 1.00 0.28 H new ATOM 0 HB3 HIS A 379 -5.431 -8.239 2.631 1.00 0.28 H new ATOM 0 HD2 HIS A 379 -7.471 -6.378 2.532 1.00 0.31 H new ATOM 0 HE1 HIS A 379 -7.363 -5.442 6.655 1.00 0.46 H new ATOM 0 HE2 HIS A 379 -8.293 -4.717 4.387 1.00 0.38 H new ATOM 838 N LYS A 380 -7.892 -9.786 1.685 1.00 0.32 N ATOM 839 CA LYS A 380 -9.149 -9.571 0.975 1.00 0.36 C ATOM 840 C LYS A 380 -9.861 -10.869 0.612 1.00 0.41 C ATOM 841 O LYS A 380 -10.955 -10.841 0.055 1.00 0.45 O ATOM 842 CB LYS A 380 -8.900 -8.766 -0.292 1.00 0.36 C ATOM 843 CG LYS A 380 -8.575 -7.318 -0.012 1.00 0.38 C ATOM 844 CD LYS A 380 -7.565 -6.770 -0.992 1.00 0.63 C ATOM 845 CE LYS A 380 -8.038 -6.792 -2.437 1.00 0.33 C ATOM 846 NZ LYS A 380 -9.386 -6.182 -2.598 1.00 0.77 N ATOM 0 H LYS A 380 -7.093 -9.986 1.083 1.00 0.32 H new ATOM 0 HA LYS A 380 -9.800 -9.023 1.657 1.00 0.36 H new ATOM 0 HB2 LYS A 380 -8.078 -9.217 -0.848 1.00 0.36 H new ATOM 0 HB3 LYS A 380 -9.783 -8.819 -0.930 1.00 0.36 H new ATOM 0 HG2 LYS A 380 -9.488 -6.725 -0.061 1.00 0.38 H new ATOM 0 HG3 LYS A 380 -8.187 -7.222 1.002 1.00 0.38 H new ATOM 0 HD2 LYS A 380 -7.323 -5.744 -0.714 1.00 0.63 H new ATOM 0 HD3 LYS A 380 -6.644 -7.348 -0.912 1.00 0.63 H new ATOM 0 HE2 LYS A 380 -7.322 -6.256 -3.060 1.00 0.33 H new ATOM 0 HE3 LYS A 380 -8.062 -7.822 -2.794 1.00 0.33 H new ATOM 0 HZ1 LYS A 380 -9.574 -6.018 -3.608 1.00 0.77 H new ATOM 0 HZ2 LYS A 380 -10.106 -6.825 -2.211 1.00 0.77 H new ATOM 0 HZ3 LYS A 380 -9.420 -5.277 -2.088 1.00 0.77 H new ATOM 860 N ASN A 381 -9.241 -11.997 0.952 1.00 0.44 N ATOM 861 CA ASN A 381 -9.759 -13.322 0.603 1.00 0.52 C ATOM 862 C ASN A 381 -10.079 -13.418 -0.892 1.00 0.53 C ATOM 863 O ASN A 381 -11.214 -13.690 -1.280 1.00 0.60 O ATOM 864 CB ASN A 381 -11.007 -13.660 1.431 1.00 0.58 C ATOM 865 CG ASN A 381 -10.753 -13.677 2.929 1.00 1.20 C ATOM 866 OD1 ASN A 381 -11.648 -13.373 3.722 1.00 1.87 O ATOM 867 ND2 ASN A 381 -9.544 -14.043 3.334 1.00 2.01 N ATOM 0 H ASN A 381 -8.366 -12.021 1.476 1.00 0.44 H new ATOM 0 HA ASN A 381 -8.979 -14.048 0.835 1.00 0.52 H new ATOM 0 HB2 ASN A 381 -11.788 -12.932 1.211 1.00 0.58 H new ATOM 0 HB3 ASN A 381 -11.385 -14.635 1.123 1.00 0.58 H new ATOM 0 HD21 ASN A 381 -9.329 -14.080 4.330 1.00 2.01 H new ATOM 0 HD22 ASN A 381 -8.829 -14.287 2.649 1.00 2.01 H new ATOM 874 N ARG A 382 -9.073 -13.196 -1.733 1.00 0.50 N ATOM 875 CA ARG A 382 -9.285 -13.178 -3.181 1.00 0.55 C ATOM 876 C ARG A 382 -8.386 -14.178 -3.896 1.00 0.68 C ATOM 877 O ARG A 382 -7.213 -14.333 -3.556 1.00 0.78 O ATOM 878 CB ARG A 382 -9.032 -11.777 -3.747 1.00 0.49 C ATOM 879 CG ARG A 382 -9.952 -10.712 -3.178 1.00 0.48 C ATOM 880 CD ARG A 382 -11.405 -11.068 -3.413 1.00 0.57 C ATOM 881 NE ARG A 382 -12.312 -10.168 -2.706 1.00 0.65 N ATOM 882 CZ ARG A 382 -13.369 -10.580 -2.010 1.00 1.11 C ATOM 883 NH1 ARG A 382 -13.617 -11.877 -1.881 1.00 1.69 N ATOM 884 NH2 ARG A 382 -14.156 -9.693 -1.415 1.00 1.27 N ATOM 0 H ARG A 382 -8.110 -13.027 -1.442 1.00 0.50 H new ATOM 0 HA ARG A 382 -10.323 -13.461 -3.355 1.00 0.55 H new ATOM 0 HB2 ARG A 382 -7.998 -11.496 -3.547 1.00 0.49 H new ATOM 0 HB3 ARG A 382 -9.151 -11.806 -4.830 1.00 0.49 H new ATOM 0 HG2 ARG A 382 -9.769 -10.602 -2.109 1.00 0.48 H new ATOM 0 HG3 ARG A 382 -9.730 -9.750 -3.640 1.00 0.48 H new ATOM 0 HD2 ARG A 382 -11.619 -11.032 -4.481 1.00 0.57 H new ATOM 0 HD3 ARG A 382 -11.584 -12.092 -3.087 1.00 0.57 H new ATOM 0 HE ARG A 382 -12.125 -9.166 -2.748 1.00 0.65 H new ATOM 0 HH11 ARG A 382 -12.997 -12.560 -2.316 1.00 1.69 H new ATOM 0 HH12 ARG A 382 -14.428 -12.191 -1.347 1.00 1.69 H new ATOM 0 HH21 ARG A 382 -13.951 -8.697 -1.491 1.00 1.27 H new ATOM 0 HH22 ARG A 382 -14.966 -10.007 -0.881 1.00 1.27 H new ATOM 898 N THR A 383 -8.957 -14.837 -4.899 1.00 0.76 N ATOM 899 CA THR A 383 -8.231 -15.777 -5.742 1.00 0.95 C ATOM 900 C THR A 383 -7.540 -15.041 -6.886 1.00 0.94 C ATOM 901 O THR A 383 -6.373 -15.291 -7.198 1.00 1.22 O ATOM 902 CB THR A 383 -9.194 -16.825 -6.338 1.00 1.17 C ATOM 903 OG1 THR A 383 -9.698 -17.686 -5.307 1.00 1.24 O ATOM 904 CG2 THR A 383 -8.513 -17.647 -7.421 1.00 1.37 C ATOM 0 H THR A 383 -9.940 -14.733 -5.150 1.00 0.76 H new ATOM 0 HA THR A 383 -7.486 -16.276 -5.122 1.00 0.95 H new ATOM 0 HB THR A 383 -10.028 -16.291 -6.793 1.00 1.17 H new ATOM 0 HG1 THR A 383 -10.309 -18.344 -5.700 1.00 1.24 H new ATOM 0 HG21 THR A 383 -9.217 -18.376 -7.821 1.00 1.37 H new ATOM 0 HG22 THR A 383 -8.179 -16.988 -8.222 1.00 1.37 H new ATOM 0 HG23 THR A 383 -7.654 -18.167 -6.997 1.00 1.37 H new ATOM 912 N ASN A 384 -8.275 -14.115 -7.485 1.00 0.84 N ATOM 913 CA ASN A 384 -7.816 -13.363 -8.645 1.00 0.81 C ATOM 914 C ASN A 384 -6.731 -12.359 -8.286 1.00 0.64 C ATOM 915 O ASN A 384 -6.233 -11.637 -9.148 1.00 0.77 O ATOM 916 CB ASN A 384 -8.994 -12.611 -9.241 1.00 0.89 C ATOM 917 CG ASN A 384 -9.870 -13.478 -10.127 1.00 1.40 C ATOM 918 OD1 ASN A 384 -10.791 -14.145 -9.653 1.00 2.21 O ATOM 919 ND2 ASN A 384 -9.606 -13.458 -11.424 1.00 1.70 N ATOM 0 H ASN A 384 -9.214 -13.862 -7.178 1.00 0.84 H new ATOM 0 HA ASN A 384 -7.396 -14.074 -9.357 1.00 0.81 H new ATOM 0 HB2 ASN A 384 -9.600 -12.199 -8.434 1.00 0.89 H new ATOM 0 HB3 ASN A 384 -8.622 -11.768 -9.823 1.00 0.89 H new ATOM 0 HD21 ASN A 384 -10.174 -14.008 -12.069 1.00 1.70 H new ATOM 0 HD22 ASN A 384 -8.834 -12.893 -11.779 1.00 1.70 H new ATOM 926 N MET A 385 -6.380 -12.310 -7.015 1.00 0.55 N ATOM 927 CA MET A 385 -5.430 -11.331 -6.524 1.00 0.42 C ATOM 928 C MET A 385 -4.055 -11.515 -7.144 1.00 0.53 C ATOM 929 O MET A 385 -3.548 -12.632 -7.264 1.00 0.94 O ATOM 930 CB MET A 385 -5.368 -11.390 -4.995 1.00 0.47 C ATOM 931 CG MET A 385 -4.050 -10.913 -4.389 1.00 0.92 C ATOM 932 SD MET A 385 -2.756 -12.176 -4.435 1.00 2.54 S ATOM 933 CE MET A 385 -3.549 -13.532 -3.571 1.00 3.18 C ATOM 0 H MET A 385 -6.741 -12.941 -6.300 1.00 0.55 H new ATOM 0 HA MET A 385 -5.774 -10.341 -6.823 1.00 0.42 H new ATOM 0 HB2 MET A 385 -6.179 -10.785 -4.589 1.00 0.47 H new ATOM 0 HB3 MET A 385 -5.547 -12.417 -4.677 1.00 0.47 H new ATOM 0 HG2 MET A 385 -3.707 -10.029 -4.927 1.00 0.92 H new ATOM 0 HG3 MET A 385 -4.219 -10.611 -3.355 1.00 0.92 H new ATOM 0 HE1 MET A 385 -3.180 -14.479 -3.964 1.00 3.18 H new ATOM 0 HE2 MET A 385 -3.322 -13.468 -2.507 1.00 3.18 H new ATOM 0 HE3 MET A 385 -4.628 -13.475 -3.716 1.00 3.18 H new ATOM 943 N THR A 386 -3.486 -10.398 -7.565 1.00 0.23 N ATOM 944 CA THR A 386 -2.144 -10.358 -8.103 1.00 0.24 C ATOM 945 C THR A 386 -1.451 -9.097 -7.604 1.00 0.16 C ATOM 946 O THR A 386 -2.069 -8.303 -6.890 1.00 0.18 O ATOM 947 CB THR A 386 -2.167 -10.346 -9.643 1.00 0.33 C ATOM 948 OG1 THR A 386 -2.836 -9.165 -10.101 1.00 0.34 O ATOM 949 CG2 THR A 386 -2.887 -11.567 -10.181 1.00 0.44 C ATOM 0 H THR A 386 -3.949 -9.489 -7.541 1.00 0.23 H new ATOM 0 HA THR A 386 -1.607 -11.247 -7.773 1.00 0.24 H new ATOM 0 HB THR A 386 -1.139 -10.359 -10.004 1.00 0.33 H new ATOM 0 HG1 THR A 386 -3.412 -9.389 -10.862 1.00 0.34 H new ATOM 0 HG21 THR A 386 -2.891 -11.537 -11.271 1.00 0.44 H new ATOM 0 HG22 THR A 386 -2.375 -12.469 -9.845 1.00 0.44 H new ATOM 0 HG23 THR A 386 -3.914 -11.575 -9.815 1.00 0.44 H new ATOM 957 N TYR A 387 -0.195 -8.891 -7.971 1.00 0.16 N ATOM 958 CA TYR A 387 0.457 -7.621 -7.667 1.00 0.13 C ATOM 959 C TYR A 387 -0.180 -6.532 -8.519 1.00 0.14 C ATOM 960 O TYR A 387 -0.197 -5.364 -8.145 1.00 0.17 O ATOM 961 CB TYR A 387 1.967 -7.663 -7.907 1.00 0.15 C ATOM 962 CG TYR A 387 2.594 -6.322 -7.626 1.00 0.13 C ATOM 963 CD1 TYR A 387 2.565 -5.791 -6.344 1.00 0.12 C ATOM 964 CD2 TYR A 387 3.149 -5.557 -8.644 1.00 0.14 C ATOM 965 CE1 TYR A 387 3.075 -4.551 -6.084 1.00 0.12 C ATOM 966 CE2 TYR A 387 3.657 -4.299 -8.388 1.00 0.14 C ATOM 967 CZ TYR A 387 3.617 -3.799 -7.105 1.00 0.12 C ATOM 968 OH TYR A 387 4.111 -2.543 -6.846 1.00 0.13 O ATOM 0 H TYR A 387 0.384 -9.568 -8.468 1.00 0.16 H new ATOM 0 HA TYR A 387 0.317 -7.412 -6.606 1.00 0.13 H new ATOM 0 HB2 TYR A 387 2.420 -8.421 -7.268 1.00 0.15 H new ATOM 0 HB3 TYR A 387 2.167 -7.954 -8.938 1.00 0.15 H new ATOM 0 HD1 TYR A 387 2.132 -6.367 -5.540 1.00 0.12 H new ATOM 0 HD2 TYR A 387 3.184 -5.951 -9.649 1.00 0.14 H new ATOM 0 HE1 TYR A 387 3.054 -4.159 -5.078 1.00 0.12 H new ATOM 0 HE2 TYR A 387 4.083 -3.711 -9.188 1.00 0.14 H new ATOM 0 HH TYR A 387 4.457 -2.150 -7.675 1.00 0.13 H new ATOM 978 N GLU A 388 -0.723 -6.938 -9.657 1.00 0.17 N ATOM 979 CA GLU A 388 -1.478 -6.041 -10.517 1.00 0.24 C ATOM 980 C GLU A 388 -2.649 -5.420 -9.747 1.00 0.25 C ATOM 981 O GLU A 388 -2.930 -4.230 -9.882 1.00 0.31 O ATOM 982 CB GLU A 388 -1.957 -6.804 -11.761 1.00 0.30 C ATOM 983 CG GLU A 388 -3.102 -6.155 -12.508 1.00 0.44 C ATOM 984 CD GLU A 388 -4.426 -6.857 -12.274 1.00 1.53 C ATOM 985 OE1 GLU A 388 -4.543 -8.057 -12.615 1.00 1.96 O ATOM 986 OE2 GLU A 388 -5.351 -6.218 -11.738 1.00 2.21 O ATOM 0 H GLU A 388 -0.653 -7.893 -10.008 1.00 0.17 H new ATOM 0 HA GLU A 388 -0.836 -5.223 -10.845 1.00 0.24 H new ATOM 0 HB2 GLU A 388 -1.116 -6.919 -12.445 1.00 0.30 H new ATOM 0 HB3 GLU A 388 -2.262 -7.806 -11.459 1.00 0.30 H new ATOM 0 HG2 GLU A 388 -3.188 -5.113 -12.199 1.00 0.44 H new ATOM 0 HG3 GLU A 388 -2.880 -6.153 -13.575 1.00 0.44 H new ATOM 993 N LYS A 389 -3.314 -6.232 -8.924 1.00 0.23 N ATOM 994 CA LYS A 389 -4.373 -5.738 -8.044 1.00 0.28 C ATOM 995 C LYS A 389 -3.832 -4.700 -7.065 1.00 0.28 C ATOM 996 O LYS A 389 -4.496 -3.712 -6.761 1.00 0.40 O ATOM 997 CB LYS A 389 -5.015 -6.886 -7.261 1.00 0.32 C ATOM 998 CG LYS A 389 -6.129 -7.601 -8.001 1.00 0.45 C ATOM 999 CD LYS A 389 -5.633 -8.292 -9.255 1.00 0.33 C ATOM 1000 CE LYS A 389 -6.789 -8.819 -10.083 1.00 0.46 C ATOM 1001 NZ LYS A 389 -6.315 -9.541 -11.291 1.00 1.39 N ATOM 0 H LYS A 389 -3.138 -7.234 -8.849 1.00 0.23 H new ATOM 0 HA LYS A 389 -5.128 -5.271 -8.676 1.00 0.28 H new ATOM 0 HB2 LYS A 389 -4.243 -7.611 -7.003 1.00 0.32 H new ATOM 0 HB3 LYS A 389 -5.410 -6.494 -6.324 1.00 0.32 H new ATOM 0 HG2 LYS A 389 -6.588 -8.337 -7.340 1.00 0.45 H new ATOM 0 HG3 LYS A 389 -6.905 -6.883 -8.267 1.00 0.45 H new ATOM 0 HD2 LYS A 389 -5.044 -7.594 -9.850 1.00 0.33 H new ATOM 0 HD3 LYS A 389 -4.972 -9.115 -8.983 1.00 0.33 H new ATOM 0 HE2 LYS A 389 -7.397 -9.488 -9.474 1.00 0.46 H new ATOM 0 HE3 LYS A 389 -7.430 -7.990 -10.383 1.00 0.46 H new ATOM 0 HZ1 LYS A 389 -7.072 -9.560 -12.004 1.00 1.39 H new ATOM 0 HZ2 LYS A 389 -5.483 -9.054 -11.682 1.00 1.39 H new ATOM 0 HZ3 LYS A 389 -6.057 -10.515 -11.034 1.00 1.39 H new ATOM 1015 N MET A 390 -2.627 -4.935 -6.569 1.00 0.19 N ATOM 1016 CA MET A 390 -1.995 -4.001 -5.649 1.00 0.17 C ATOM 1017 C MET A 390 -1.574 -2.737 -6.388 1.00 0.16 C ATOM 1018 O MET A 390 -1.780 -1.624 -5.908 1.00 0.17 O ATOM 1019 CB MET A 390 -0.770 -4.627 -4.987 1.00 0.15 C ATOM 1020 CG MET A 390 -0.164 -3.720 -3.934 1.00 0.14 C ATOM 1021 SD MET A 390 1.361 -4.358 -3.228 1.00 0.18 S ATOM 1022 CE MET A 390 1.749 -3.036 -2.084 1.00 1.57 C ATOM 0 H MET A 390 -2.069 -5.761 -6.787 1.00 0.19 H new ATOM 0 HA MET A 390 -2.723 -3.750 -4.877 1.00 0.17 H new ATOM 0 HB2 MET A 390 -1.051 -5.576 -4.529 1.00 0.15 H new ATOM 0 HB3 MET A 390 -0.021 -4.849 -5.748 1.00 0.15 H new ATOM 0 HG2 MET A 390 0.031 -2.743 -4.376 1.00 0.14 H new ATOM 0 HG3 MET A 390 -0.890 -3.569 -3.135 1.00 0.14 H new ATOM 0 HE1 MET A 390 2.733 -3.209 -1.649 1.00 1.57 H new ATOM 0 HE2 MET A 390 1.749 -2.084 -2.615 1.00 1.57 H new ATOM 0 HE3 MET A 390 1.001 -3.010 -1.291 1.00 1.57 H new ATOM 1032 N SER A 391 -0.979 -2.922 -7.558 1.00 0.15 N ATOM 1033 CA SER A 391 -0.505 -1.810 -8.359 1.00 0.17 C ATOM 1034 C SER A 391 -1.669 -0.911 -8.756 1.00 0.19 C ATOM 1035 O SER A 391 -1.569 0.305 -8.657 1.00 0.21 O ATOM 1036 CB SER A 391 0.228 -2.315 -9.607 1.00 0.23 C ATOM 1037 OG SER A 391 0.870 -1.250 -10.295 1.00 1.02 O ATOM 0 H SER A 391 -0.814 -3.839 -7.973 1.00 0.15 H new ATOM 0 HA SER A 391 0.197 -1.230 -7.760 1.00 0.17 H new ATOM 0 HB2 SER A 391 0.967 -3.063 -9.320 1.00 0.23 H new ATOM 0 HB3 SER A 391 -0.481 -2.807 -10.274 1.00 0.23 H new ATOM 0 HG SER A 391 1.042 -0.514 -9.671 1.00 1.02 H new ATOM 1043 N ARG A 392 -2.780 -1.516 -9.173 1.00 0.21 N ATOM 1044 CA ARG A 392 -3.963 -0.759 -9.567 1.00 0.26 C ATOM 1045 C ARG A 392 -4.451 0.107 -8.415 1.00 0.22 C ATOM 1046 O ARG A 392 -4.923 1.226 -8.619 1.00 0.30 O ATOM 1047 CB ARG A 392 -5.050 -1.690 -10.104 1.00 0.38 C ATOM 1048 CG ARG A 392 -5.910 -2.361 -9.067 1.00 1.12 C ATOM 1049 CD ARG A 392 -6.970 -1.417 -8.542 1.00 2.05 C ATOM 1050 NE ARG A 392 -8.023 -1.154 -9.519 1.00 2.61 N ATOM 1051 CZ ARG A 392 -8.335 0.065 -9.962 1.00 3.35 C ATOM 1052 NH1 ARG A 392 -7.625 1.120 -9.570 1.00 3.75 N ATOM 1053 NH2 ARG A 392 -9.345 0.224 -10.806 1.00 4.06 N ATOM 0 H ARG A 392 -2.884 -2.528 -9.246 1.00 0.21 H new ATOM 0 HA ARG A 392 -3.697 -0.085 -10.382 1.00 0.26 H new ATOM 0 HB2 ARG A 392 -5.696 -1.117 -10.769 1.00 0.38 H new ATOM 0 HB3 ARG A 392 -4.574 -2.462 -10.709 1.00 0.38 H new ATOM 0 HG2 ARG A 392 -6.385 -3.242 -9.499 1.00 1.12 H new ATOM 0 HG3 ARG A 392 -5.287 -2.707 -8.242 1.00 1.12 H new ATOM 0 HD2 ARG A 392 -7.414 -1.840 -7.641 1.00 2.05 H new ATOM 0 HD3 ARG A 392 -6.502 -0.475 -8.255 1.00 2.05 H new ATOM 0 HE ARG A 392 -8.550 -1.948 -9.883 1.00 2.61 H new ATOM 0 HH11 ARG A 392 -6.841 0.997 -8.930 1.00 3.75 H new ATOM 0 HH12 ARG A 392 -7.865 2.051 -9.910 1.00 3.75 H new ATOM 0 HH21 ARG A 392 -9.883 -0.585 -11.116 1.00 4.06 H new ATOM 0 HH22 ARG A 392 -9.584 1.156 -11.145 1.00 4.06 H new ATOM 1067 N ALA A 393 -4.337 -0.420 -7.209 1.00 0.19 N ATOM 1068 CA ALA A 393 -4.667 0.337 -6.013 1.00 0.17 C ATOM 1069 C ALA A 393 -3.692 1.494 -5.851 1.00 0.12 C ATOM 1070 O ALA A 393 -4.093 2.638 -5.647 1.00 0.14 O ATOM 1071 CB ALA A 393 -4.639 -0.568 -4.795 1.00 0.20 C ATOM 0 H ALA A 393 -4.017 -1.372 -7.031 1.00 0.19 H new ATOM 0 HA ALA A 393 -5.674 0.742 -6.111 1.00 0.17 H new ATOM 0 HB1 ALA A 393 -4.888 0.011 -3.906 1.00 0.20 H new ATOM 0 HB2 ALA A 393 -5.366 -1.370 -4.921 1.00 0.20 H new ATOM 0 HB3 ALA A 393 -3.643 -0.996 -4.682 1.00 0.20 H new ATOM 1077 N LEU A 394 -2.405 1.181 -5.977 1.00 0.13 N ATOM 1078 CA LEU A 394 -1.346 2.181 -5.911 1.00 0.10 C ATOM 1079 C LEU A 394 -1.572 3.289 -6.936 1.00 0.11 C ATOM 1080 O LEU A 394 -1.451 4.465 -6.611 1.00 0.12 O ATOM 1081 CB LEU A 394 0.014 1.519 -6.148 1.00 0.11 C ATOM 1082 CG LEU A 394 0.435 0.499 -5.095 1.00 0.12 C ATOM 1083 CD1 LEU A 394 1.618 -0.319 -5.589 1.00 0.13 C ATOM 1084 CD2 LEU A 394 0.788 1.206 -3.802 1.00 0.13 C ATOM 0 H LEU A 394 -2.069 0.230 -6.127 1.00 0.13 H new ATOM 0 HA LEU A 394 -1.362 2.628 -4.917 1.00 0.10 H new ATOM 0 HB2 LEU A 394 -0.005 1.026 -7.120 1.00 0.11 H new ATOM 0 HB3 LEU A 394 0.775 2.298 -6.200 1.00 0.11 H new ATOM 0 HG LEU A 394 -0.399 -0.179 -4.911 1.00 0.12 H new ATOM 0 HD11 LEU A 394 1.905 -1.042 -4.825 1.00 0.13 H new ATOM 0 HD12 LEU A 394 1.340 -0.847 -6.501 1.00 0.13 H new ATOM 0 HD13 LEU A 394 2.458 0.344 -5.795 1.00 0.13 H new ATOM 0 HD21 LEU A 394 1.088 0.471 -3.055 1.00 0.13 H new ATOM 0 HD22 LEU A 394 1.610 1.899 -3.979 1.00 0.13 H new ATOM 0 HD23 LEU A 394 -0.080 1.758 -3.440 1.00 0.13 H new ATOM 1096 N ARG A 395 -1.916 2.906 -8.165 1.00 0.12 N ATOM 1097 CA ARG A 395 -2.156 3.872 -9.239 1.00 0.14 C ATOM 1098 C ARG A 395 -3.212 4.881 -8.815 1.00 0.14 C ATOM 1099 O ARG A 395 -3.071 6.082 -9.041 1.00 0.19 O ATOM 1100 CB ARG A 395 -2.624 3.179 -10.521 1.00 0.18 C ATOM 1101 CG ARG A 395 -1.742 2.031 -10.965 1.00 0.33 C ATOM 1102 CD ARG A 395 -0.336 2.482 -11.303 1.00 0.52 C ATOM 1103 NE ARG A 395 0.529 1.344 -11.606 1.00 1.30 N ATOM 1104 CZ ARG A 395 1.591 1.406 -12.400 1.00 1.72 C ATOM 1105 NH1 ARG A 395 1.934 2.556 -12.965 1.00 1.66 N ATOM 1106 NH2 ARG A 395 2.312 0.317 -12.624 1.00 2.64 N ATOM 0 H ARG A 395 -2.035 1.932 -8.443 1.00 0.12 H new ATOM 0 HA ARG A 395 -1.212 4.379 -9.436 1.00 0.14 H new ATOM 0 HB2 ARG A 395 -3.637 2.806 -10.370 1.00 0.18 H new ATOM 0 HB3 ARG A 395 -2.672 3.916 -11.322 1.00 0.18 H new ATOM 0 HG2 ARG A 395 -1.700 1.281 -10.175 1.00 0.33 H new ATOM 0 HG3 ARG A 395 -2.186 1.551 -11.837 1.00 0.33 H new ATOM 0 HD2 ARG A 395 -0.364 3.158 -12.158 1.00 0.52 H new ATOM 0 HD3 ARG A 395 0.079 3.044 -10.466 1.00 0.52 H new ATOM 0 HE ARG A 395 0.302 0.445 -11.180 1.00 1.30 H new ATOM 0 HH11 ARG A 395 1.381 3.395 -12.790 1.00 1.66 H new ATOM 0 HH12 ARG A 395 2.750 2.601 -13.575 1.00 1.66 H new ATOM 0 HH21 ARG A 395 2.051 -0.567 -12.187 1.00 2.64 H new ATOM 0 HH22 ARG A 395 3.128 0.362 -13.234 1.00 2.64 H new ATOM 1120 N HIS A 396 -4.263 4.379 -8.180 1.00 0.12 N ATOM 1121 CA HIS A 396 -5.369 5.213 -7.745 1.00 0.13 C ATOM 1122 C HIS A 396 -4.937 6.092 -6.577 1.00 0.11 C ATOM 1123 O HIS A 396 -5.379 7.233 -6.444 1.00 0.13 O ATOM 1124 CB HIS A 396 -6.560 4.334 -7.366 1.00 0.14 C ATOM 1125 CG HIS A 396 -7.883 5.005 -7.560 1.00 0.18 C ATOM 1126 ND1 HIS A 396 -8.121 5.811 -8.649 1.00 0.31 N ATOM 1127 CD2 HIS A 396 -9.003 4.946 -6.802 1.00 0.20 C ATOM 1128 CE1 HIS A 396 -9.371 6.221 -8.529 1.00 0.34 C ATOM 1129 NE2 HIS A 396 -9.944 5.721 -7.426 1.00 0.26 N ATOM 0 H HIS A 396 -4.370 3.390 -7.955 1.00 0.12 H new ATOM 0 HA HIS A 396 -5.673 5.868 -8.562 1.00 0.13 H new ATOM 0 HB2 HIS A 396 -6.533 3.422 -7.963 1.00 0.14 H new ATOM 0 HB3 HIS A 396 -6.463 4.035 -6.322 1.00 0.14 H new ATOM 0 HD2 HIS A 396 -9.130 4.394 -5.882 1.00 0.20 H new ATOM 0 HE1 HIS A 396 -9.867 6.875 -9.230 1.00 0.34 H new ATOM 0 HE2 HIS A 396 -10.900 5.886 -7.111 1.00 0.26 H new ATOM 1137 N TYR A 397 -4.032 5.565 -5.762 1.00 0.10 N ATOM 1138 CA TYR A 397 -3.521 6.286 -4.601 1.00 0.10 C ATOM 1139 C TYR A 397 -2.764 7.537 -5.010 1.00 0.09 C ATOM 1140 O TYR A 397 -2.773 8.537 -4.295 1.00 0.11 O ATOM 1141 CB TYR A 397 -2.605 5.390 -3.769 1.00 0.12 C ATOM 1142 CG TYR A 397 -3.338 4.262 -3.104 1.00 0.16 C ATOM 1143 CD1 TYR A 397 -4.716 4.286 -3.016 1.00 0.17 C ATOM 1144 CD2 TYR A 397 -2.659 3.184 -2.564 1.00 0.19 C ATOM 1145 CE1 TYR A 397 -5.410 3.272 -2.413 1.00 0.21 C ATOM 1146 CE2 TYR A 397 -3.346 2.157 -1.949 1.00 0.24 C ATOM 1147 CZ TYR A 397 -4.725 2.207 -1.877 1.00 0.24 C ATOM 1148 OH TYR A 397 -5.413 1.202 -1.246 1.00 0.30 O ATOM 0 H TYR A 397 -3.634 4.634 -5.884 1.00 0.10 H new ATOM 0 HA TYR A 397 -4.382 6.582 -4.002 1.00 0.10 H new ATOM 0 HB2 TYR A 397 -1.825 4.981 -4.411 1.00 0.12 H new ATOM 0 HB3 TYR A 397 -2.109 5.993 -3.008 1.00 0.12 H new ATOM 0 HD1 TYR A 397 -5.258 5.123 -3.432 1.00 0.17 H new ATOM 0 HD2 TYR A 397 -1.581 3.146 -2.624 1.00 0.19 H new ATOM 0 HE1 TYR A 397 -6.488 3.308 -2.359 1.00 0.21 H new ATOM 0 HE2 TYR A 397 -2.809 1.320 -1.527 1.00 0.24 H new ATOM 0 HH TYR A 397 -6.018 0.769 -1.884 1.00 0.30 H new ATOM 1158 N TYR A 398 -2.110 7.478 -6.158 1.00 0.10 N ATOM 1159 CA TYR A 398 -1.303 8.595 -6.623 1.00 0.12 C ATOM 1160 C TYR A 398 -2.187 9.818 -6.862 1.00 0.14 C ATOM 1161 O TYR A 398 -1.880 10.923 -6.409 1.00 0.17 O ATOM 1162 CB TYR A 398 -0.570 8.242 -7.919 1.00 0.14 C ATOM 1163 CG TYR A 398 0.238 6.957 -7.880 1.00 0.12 C ATOM 1164 CD1 TYR A 398 0.809 6.473 -6.701 1.00 0.11 C ATOM 1165 CD2 TYR A 398 0.431 6.223 -9.043 1.00 0.15 C ATOM 1166 CE1 TYR A 398 1.542 5.301 -6.692 1.00 0.12 C ATOM 1167 CE2 TYR A 398 1.162 5.057 -9.040 1.00 0.16 C ATOM 1168 CZ TYR A 398 1.713 4.599 -7.867 1.00 0.14 C ATOM 1169 OH TYR A 398 2.440 3.433 -7.871 1.00 0.18 O ATOM 0 H TYR A 398 -2.121 6.672 -6.783 1.00 0.10 H new ATOM 0 HA TYR A 398 -0.565 8.818 -5.852 1.00 0.12 H new ATOM 0 HB2 TYR A 398 -1.303 8.166 -8.722 1.00 0.14 H new ATOM 0 HB3 TYR A 398 0.099 9.064 -8.174 1.00 0.14 H new ATOM 0 HD1 TYR A 398 0.676 7.023 -5.781 1.00 0.11 H new ATOM 0 HD2 TYR A 398 -0.001 6.574 -9.968 1.00 0.15 H new ATOM 0 HE1 TYR A 398 1.977 4.938 -5.773 1.00 0.12 H new ATOM 0 HE2 TYR A 398 1.302 4.503 -9.957 1.00 0.16 H new ATOM 0 HH TYR A 398 3.083 3.446 -7.132 1.00 0.18 H new ATOM 1179 N LYS A 399 -3.293 9.604 -7.567 1.00 0.15 N ATOM 1180 CA LYS A 399 -4.238 10.675 -7.866 1.00 0.19 C ATOM 1181 C LYS A 399 -4.883 11.195 -6.598 1.00 0.19 C ATOM 1182 O LYS A 399 -5.061 12.401 -6.424 1.00 0.23 O ATOM 1183 CB LYS A 399 -5.339 10.196 -8.809 1.00 0.20 C ATOM 1184 CG LYS A 399 -4.883 9.925 -10.236 1.00 0.23 C ATOM 1185 CD LYS A 399 -4.533 8.462 -10.444 1.00 0.27 C ATOM 1186 CE LYS A 399 -5.743 7.562 -10.232 1.00 0.32 C ATOM 1187 NZ LYS A 399 -6.778 7.738 -11.291 1.00 0.71 N ATOM 0 H LYS A 399 -3.558 8.694 -7.944 1.00 0.15 H new ATOM 0 HA LYS A 399 -3.672 11.473 -8.347 1.00 0.19 H new ATOM 0 HB2 LYS A 399 -5.775 9.284 -8.402 1.00 0.20 H new ATOM 0 HB3 LYS A 399 -6.130 10.945 -8.831 1.00 0.20 H new ATOM 0 HG2 LYS A 399 -5.671 10.213 -10.931 1.00 0.23 H new ATOM 0 HG3 LYS A 399 -4.015 10.543 -10.465 1.00 0.23 H new ATOM 0 HD2 LYS A 399 -4.145 8.320 -11.453 1.00 0.27 H new ATOM 0 HD3 LYS A 399 -3.740 8.175 -9.754 1.00 0.27 H new ATOM 0 HE2 LYS A 399 -5.419 6.521 -10.214 1.00 0.32 H new ATOM 0 HE3 LYS A 399 -6.184 7.775 -9.258 1.00 0.32 H new ATOM 0 HZ1 LYS A 399 -7.532 7.034 -11.160 1.00 0.71 H new ATOM 0 HZ2 LYS A 399 -7.182 8.694 -11.226 1.00 0.71 H new ATOM 0 HZ3 LYS A 399 -6.343 7.608 -12.227 1.00 0.71 H new ATOM 1201 N LEU A 400 -5.225 10.280 -5.709 1.00 0.17 N ATOM 1202 CA LEU A 400 -5.927 10.630 -4.493 1.00 0.18 C ATOM 1203 C LEU A 400 -4.964 11.116 -3.418 1.00 0.18 C ATOM 1204 O LEU A 400 -5.294 11.128 -2.234 1.00 0.21 O ATOM 1205 CB LEU A 400 -6.736 9.428 -4.025 1.00 0.18 C ATOM 1206 CG LEU A 400 -7.621 8.830 -5.115 1.00 0.19 C ATOM 1207 CD1 LEU A 400 -8.293 7.568 -4.623 1.00 0.20 C ATOM 1208 CD2 LEU A 400 -8.647 9.848 -5.587 1.00 0.21 C ATOM 0 H LEU A 400 -5.026 9.285 -5.810 1.00 0.17 H new ATOM 0 HA LEU A 400 -6.608 11.457 -4.694 1.00 0.18 H new ATOM 0 HB2 LEU A 400 -6.054 8.660 -3.660 1.00 0.18 H new ATOM 0 HB3 LEU A 400 -7.361 9.726 -3.183 1.00 0.18 H new ATOM 0 HG LEU A 400 -6.992 8.566 -5.965 1.00 0.19 H new ATOM 0 HD11 LEU A 400 -8.919 7.157 -5.415 1.00 0.20 H new ATOM 0 HD12 LEU A 400 -7.534 6.837 -4.344 1.00 0.20 H new ATOM 0 HD13 LEU A 400 -8.910 7.799 -3.755 1.00 0.20 H new ATOM 0 HD21 LEU A 400 -9.269 9.404 -6.364 1.00 0.21 H new ATOM 0 HD22 LEU A 400 -9.274 10.149 -4.748 1.00 0.21 H new ATOM 0 HD23 LEU A 400 -8.134 10.722 -5.988 1.00 0.21 H new ATOM 1220 N ASN A 401 -3.768 11.513 -3.855 1.00 0.18 N ATOM 1221 CA ASN A 401 -2.795 12.173 -2.985 1.00 0.20 C ATOM 1222 C ASN A 401 -2.385 11.295 -1.816 1.00 0.17 C ATOM 1223 O ASN A 401 -2.236 11.765 -0.689 1.00 0.22 O ATOM 1224 CB ASN A 401 -3.374 13.486 -2.488 1.00 0.27 C ATOM 1225 CG ASN A 401 -2.999 14.646 -3.379 1.00 0.60 C ATOM 1226 OD1 ASN A 401 -1.896 14.698 -3.921 1.00 1.08 O ATOM 1227 ND2 ASN A 401 -3.921 15.569 -3.561 1.00 1.21 N ATOM 0 H ASN A 401 -3.448 11.387 -4.815 1.00 0.18 H new ATOM 0 HA ASN A 401 -1.894 12.364 -3.568 1.00 0.20 H new ATOM 0 HB2 ASN A 401 -4.460 13.406 -2.436 1.00 0.27 H new ATOM 0 HB3 ASN A 401 -3.019 13.678 -1.475 1.00 0.27 H new ATOM 0 HD21 ASN A 401 -3.733 16.365 -4.171 1.00 1.21 H new ATOM 0 HD22 ASN A 401 -4.823 15.488 -3.092 1.00 1.21 H new ATOM 1234 N ILE A 402 -2.204 10.021 -2.097 1.00 0.11 N ATOM 1235 CA ILE A 402 -1.892 9.044 -1.080 1.00 0.10 C ATOM 1236 C ILE A 402 -0.446 8.595 -1.157 1.00 0.09 C ATOM 1237 O ILE A 402 0.345 8.859 -0.255 1.00 0.13 O ATOM 1238 CB ILE A 402 -2.832 7.851 -1.259 1.00 0.10 C ATOM 1239 CG1 ILE A 402 -4.252 8.322 -1.017 1.00 0.14 C ATOM 1240 CG2 ILE A 402 -2.475 6.704 -0.331 1.00 0.15 C ATOM 1241 CD1 ILE A 402 -5.285 7.394 -1.566 1.00 0.13 C ATOM 0 H ILE A 402 -2.270 9.635 -3.039 1.00 0.11 H new ATOM 0 HA ILE A 402 -2.031 9.495 -0.097 1.00 0.10 H new ATOM 0 HB ILE A 402 -2.732 7.468 -2.274 1.00 0.10 H new ATOM 0 HG12 ILE A 402 -4.411 8.438 0.055 1.00 0.14 H new ATOM 0 HG13 ILE A 402 -4.382 9.306 -1.467 1.00 0.14 H new ATOM 0 HG21 ILE A 402 -3.167 5.878 -0.491 1.00 0.15 H new ATOM 0 HG22 ILE A 402 -1.458 6.371 -0.539 1.00 0.15 H new ATOM 0 HG23 ILE A 402 -2.543 7.039 0.704 1.00 0.15 H new ATOM 0 HD11 ILE A 402 -6.278 7.791 -1.358 1.00 0.13 H new ATOM 0 HD12 ILE A 402 -5.151 7.297 -2.643 1.00 0.13 H new ATOM 0 HD13 ILE A 402 -5.180 6.415 -1.098 1.00 0.13 H new ATOM 1253 N ILE A 403 -0.106 7.918 -2.233 1.00 0.07 N ATOM 1254 CA ILE A 403 1.243 7.454 -2.439 1.00 0.07 C ATOM 1255 C ILE A 403 1.758 8.032 -3.744 1.00 0.08 C ATOM 1256 O ILE A 403 0.974 8.469 -4.580 1.00 0.10 O ATOM 1257 CB ILE A 403 1.322 5.909 -2.482 1.00 0.09 C ATOM 1258 CG1 ILE A 403 0.668 5.284 -1.253 1.00 0.09 C ATOM 1259 CG2 ILE A 403 2.764 5.443 -2.586 1.00 0.14 C ATOM 1260 CD1 ILE A 403 0.749 3.776 -1.257 1.00 0.11 C ATOM 0 H ILE A 403 -0.754 7.677 -2.983 1.00 0.07 H new ATOM 0 HA ILE A 403 1.856 7.786 -1.601 1.00 0.07 H new ATOM 0 HB ILE A 403 0.778 5.582 -3.368 1.00 0.09 H new ATOM 0 HG12 ILE A 403 1.151 5.668 -0.354 1.00 0.09 H new ATOM 0 HG13 ILE A 403 -0.378 5.588 -1.208 1.00 0.09 H new ATOM 0 HG21 ILE A 403 2.793 4.354 -2.615 1.00 0.14 H new ATOM 0 HG22 ILE A 403 3.211 5.842 -3.497 1.00 0.14 H new ATOM 0 HG23 ILE A 403 3.324 5.798 -1.721 1.00 0.14 H new ATOM 0 HD11 ILE A 403 0.269 3.383 -0.361 1.00 0.11 H new ATOM 0 HD12 ILE A 403 0.242 3.387 -2.140 1.00 0.11 H new ATOM 0 HD13 ILE A 403 1.794 3.468 -1.273 1.00 0.11 H new ATOM 1272 N ARG A 404 3.063 8.079 -3.896 1.00 0.10 N ATOM 1273 CA ARG A 404 3.660 8.522 -5.136 1.00 0.13 C ATOM 1274 C ARG A 404 4.669 7.495 -5.618 1.00 0.14 C ATOM 1275 O ARG A 404 5.042 6.577 -4.885 1.00 0.16 O ATOM 1276 CB ARG A 404 4.348 9.869 -4.948 1.00 0.17 C ATOM 1277 CG ARG A 404 5.789 9.736 -4.525 1.00 0.25 C ATOM 1278 CD ARG A 404 6.488 11.073 -4.449 1.00 0.36 C ATOM 1279 NE ARG A 404 7.935 10.911 -4.541 1.00 1.14 N ATOM 1280 CZ ARG A 404 8.740 11.739 -5.201 1.00 1.56 C ATOM 1281 NH1 ARG A 404 8.239 12.769 -5.871 1.00 1.63 N ATOM 1282 NH2 ARG A 404 10.047 11.509 -5.218 1.00 2.39 N ATOM 0 H ARG A 404 3.733 7.815 -3.174 1.00 0.10 H new ATOM 0 HA ARG A 404 2.871 8.633 -5.880 1.00 0.13 H new ATOM 0 HB2 ARG A 404 4.299 10.430 -5.881 1.00 0.17 H new ATOM 0 HB3 ARG A 404 3.806 10.447 -4.199 1.00 0.17 H new ATOM 0 HG2 ARG A 404 5.836 9.248 -3.552 1.00 0.25 H new ATOM 0 HG3 ARG A 404 6.315 9.093 -5.230 1.00 0.25 H new ATOM 0 HD2 ARG A 404 6.138 11.717 -5.256 1.00 0.36 H new ATOM 0 HD3 ARG A 404 6.233 11.569 -3.512 1.00 0.36 H new ATOM 0 HE ARG A 404 8.357 10.111 -4.069 1.00 1.14 H new ATOM 0 HH11 ARG A 404 7.232 12.929 -5.882 1.00 1.63 H new ATOM 0 HH12 ARG A 404 8.861 13.401 -6.375 1.00 1.63 H new ATOM 0 HH21 ARG A 404 10.429 10.701 -4.727 1.00 2.39 H new ATOM 0 HH22 ARG A 404 10.669 12.140 -5.722 1.00 2.39 H new ATOM 1296 N LYS A 405 5.117 7.673 -6.840 1.00 0.17 N ATOM 1297 CA LYS A 405 6.086 6.785 -7.439 1.00 0.19 C ATOM 1298 C LYS A 405 7.406 7.516 -7.625 1.00 0.22 C ATOM 1299 O LYS A 405 7.431 8.671 -8.056 1.00 0.27 O ATOM 1300 CB LYS A 405 5.559 6.298 -8.781 1.00 0.22 C ATOM 1301 CG LYS A 405 6.335 5.122 -9.336 1.00 0.34 C ATOM 1302 CD LYS A 405 6.196 3.906 -8.451 1.00 0.29 C ATOM 1303 CE LYS A 405 7.012 2.743 -8.980 1.00 0.23 C ATOM 1304 NZ LYS A 405 6.621 2.370 -10.366 1.00 1.08 N ATOM 0 H LYS A 405 4.820 8.437 -7.446 1.00 0.17 H new ATOM 0 HA LYS A 405 6.251 5.927 -6.787 1.00 0.19 H new ATOM 0 HB2 LYS A 405 4.512 6.015 -8.672 1.00 0.22 H new ATOM 0 HB3 LYS A 405 5.594 7.119 -9.497 1.00 0.22 H new ATOM 0 HG2 LYS A 405 5.977 4.888 -10.338 1.00 0.34 H new ATOM 0 HG3 LYS A 405 7.388 5.389 -9.428 1.00 0.34 H new ATOM 0 HD2 LYS A 405 6.521 4.151 -7.440 1.00 0.29 H new ATOM 0 HD3 LYS A 405 5.147 3.618 -8.388 1.00 0.29 H new ATOM 0 HE2 LYS A 405 8.070 3.004 -8.960 1.00 0.23 H new ATOM 0 HE3 LYS A 405 6.884 1.882 -8.324 1.00 0.23 H new ATOM 0 HZ1 LYS A 405 7.023 1.440 -10.602 1.00 1.08 H new ATOM 0 HZ2 LYS A 405 5.584 2.326 -10.434 1.00 1.08 H new ATOM 0 HZ3 LYS A 405 6.982 3.082 -11.032 1.00 1.08 H new ATOM 1318 N GLU A 406 8.493 6.847 -7.288 1.00 0.23 N ATOM 1319 CA GLU A 406 9.807 7.433 -7.398 1.00 0.28 C ATOM 1320 C GLU A 406 10.311 7.365 -8.832 1.00 0.34 C ATOM 1321 O GLU A 406 10.026 6.414 -9.562 1.00 0.43 O ATOM 1322 CB GLU A 406 10.779 6.702 -6.496 1.00 0.29 C ATOM 1323 CG GLU A 406 10.349 6.637 -5.047 1.00 0.63 C ATOM 1324 CD GLU A 406 10.363 7.997 -4.365 1.00 1.77 C ATOM 1325 OE1 GLU A 406 11.465 8.516 -4.093 1.00 2.42 O ATOM 1326 OE2 GLU A 406 9.280 8.557 -4.098 1.00 2.32 O ATOM 0 H GLU A 406 8.486 5.891 -6.934 1.00 0.23 H new ATOM 0 HA GLU A 406 9.737 8.478 -7.095 1.00 0.28 H new ATOM 0 HB2 GLU A 406 10.912 5.687 -6.870 1.00 0.29 H new ATOM 0 HB3 GLU A 406 11.751 7.193 -6.554 1.00 0.29 H new ATOM 0 HG2 GLU A 406 9.345 6.217 -4.990 1.00 0.63 H new ATOM 0 HG3 GLU A 406 11.009 5.958 -4.507 1.00 0.63 H new ATOM 1333 N PRO A 407 11.072 8.380 -9.227 1.00 0.41 N ATOM 1334 CA PRO A 407 11.630 8.487 -10.563 1.00 0.51 C ATOM 1335 C PRO A 407 12.706 7.438 -10.819 1.00 0.52 C ATOM 1336 O PRO A 407 13.772 7.468 -10.203 1.00 0.54 O ATOM 1337 CB PRO A 407 12.216 9.897 -10.625 1.00 0.61 C ATOM 1338 CG PRO A 407 12.244 10.422 -9.228 1.00 0.58 C ATOM 1339 CD PRO A 407 11.488 9.464 -8.347 1.00 0.45 C ATOM 0 HA PRO A 407 10.873 8.314 -11.328 1.00 0.51 H new ATOM 0 HB2 PRO A 407 13.220 9.879 -11.050 1.00 0.61 H new ATOM 0 HB3 PRO A 407 11.610 10.538 -11.265 1.00 0.61 H new ATOM 0 HG2 PRO A 407 13.272 10.525 -8.882 1.00 0.58 H new ATOM 0 HG3 PRO A 407 11.793 11.413 -9.186 1.00 0.58 H new ATOM 0 HD2 PRO A 407 12.117 9.094 -7.537 1.00 0.45 H new ATOM 0 HD3 PRO A 407 10.627 9.949 -7.886 1.00 0.45 H new ATOM 1347 N GLY A 408 12.419 6.505 -11.712 1.00 0.54 N ATOM 1348 CA GLY A 408 13.385 5.480 -12.050 1.00 0.58 C ATOM 1349 C GLY A 408 13.192 4.215 -11.240 1.00 0.58 C ATOM 1350 O GLY A 408 13.607 3.131 -11.660 1.00 0.86 O ATOM 0 H GLY A 408 11.532 6.438 -12.211 1.00 0.54 H new ATOM 0 HA2 GLY A 408 13.304 5.244 -13.111 1.00 0.58 H new ATOM 0 HA3 GLY A 408 14.391 5.864 -11.884 1.00 0.58 H new ATOM 1354 N GLN A 409 12.552 4.346 -10.084 1.00 0.47 N ATOM 1355 CA GLN A 409 12.309 3.206 -9.211 1.00 0.51 C ATOM 1356 C GLN A 409 11.207 2.324 -9.763 1.00 0.48 C ATOM 1357 O GLN A 409 10.403 2.741 -10.596 1.00 0.61 O ATOM 1358 CB GLN A 409 11.945 3.663 -7.802 1.00 0.63 C ATOM 1359 CG GLN A 409 13.147 4.006 -6.935 1.00 0.45 C ATOM 1360 CD GLN A 409 13.785 2.763 -6.332 1.00 0.71 C ATOM 1361 OE1 GLN A 409 13.717 1.675 -6.905 1.00 1.64 O ATOM 1362 NE2 GLN A 409 14.397 2.913 -5.168 1.00 0.45 N ATOM 0 H GLN A 409 12.192 5.232 -9.730 1.00 0.47 H new ATOM 0 HA GLN A 409 13.232 2.628 -9.165 1.00 0.51 H new ATOM 0 HB2 GLN A 409 11.297 4.537 -7.870 1.00 0.63 H new ATOM 0 HB3 GLN A 409 11.369 2.877 -7.313 1.00 0.63 H new ATOM 0 HG2 GLN A 409 13.886 4.539 -7.533 1.00 0.45 H new ATOM 0 HG3 GLN A 409 12.838 4.679 -6.136 1.00 0.45 H new ATOM 0 HE21 GLN A 409 14.432 3.831 -4.725 1.00 0.45 H new ATOM 0 HE22 GLN A 409 14.834 2.111 -4.714 1.00 0.45 H new ATOM 1371 N ARG A 410 11.171 1.106 -9.260 1.00 0.41 N ATOM 1372 CA ARG A 410 10.282 0.083 -9.763 1.00 0.39 C ATOM 1373 C ARG A 410 9.236 -0.277 -8.727 1.00 0.31 C ATOM 1374 O ARG A 410 8.040 -0.263 -9.004 1.00 0.42 O ATOM 1375 CB ARG A 410 11.086 -1.153 -10.169 1.00 0.47 C ATOM 1376 CG ARG A 410 12.117 -1.602 -9.140 1.00 0.86 C ATOM 1377 CD ARG A 410 13.433 -0.861 -9.323 1.00 1.11 C ATOM 1378 NE ARG A 410 14.388 -1.132 -8.248 1.00 1.27 N ATOM 1379 CZ ARG A 410 15.709 -1.147 -8.427 1.00 2.04 C ATOM 1380 NH1 ARG A 410 16.225 -0.787 -9.595 1.00 2.65 N ATOM 1381 NH2 ARG A 410 16.513 -1.491 -7.430 1.00 2.43 N ATOM 0 H ARG A 410 11.761 0.799 -8.487 1.00 0.41 H new ATOM 0 HA ARG A 410 9.766 0.471 -10.641 1.00 0.39 H new ATOM 0 HB2 ARG A 410 10.395 -1.975 -10.355 1.00 0.47 H new ATOM 0 HB3 ARG A 410 11.596 -0.946 -11.110 1.00 0.47 H new ATOM 0 HG2 ARG A 410 11.733 -1.425 -8.135 1.00 0.86 H new ATOM 0 HG3 ARG A 410 12.284 -2.675 -9.233 1.00 0.86 H new ATOM 0 HD2 ARG A 410 13.876 -1.146 -10.277 1.00 1.11 H new ATOM 0 HD3 ARG A 410 13.239 0.211 -9.369 1.00 1.11 H new ATOM 0 HE ARG A 410 14.024 -1.319 -7.314 1.00 1.27 H new ATOM 0 HH11 ARG A 410 15.611 -0.499 -10.357 1.00 2.65 H new ATOM 0 HH12 ARG A 410 17.236 -0.799 -9.731 1.00 2.65 H new ATOM 0 HH21 ARG A 410 16.121 -1.745 -6.523 1.00 2.43 H new ATOM 0 HH22 ARG A 410 17.523 -1.502 -7.570 1.00 2.43 H new ATOM 1395 N LEU A 411 9.696 -0.583 -7.529 1.00 0.21 N ATOM 1396 CA LEU A 411 8.811 -0.939 -6.447 1.00 0.14 C ATOM 1397 C LEU A 411 9.036 -0.023 -5.270 1.00 0.11 C ATOM 1398 O LEU A 411 8.821 -0.390 -4.124 1.00 0.12 O ATOM 1399 CB LEU A 411 9.040 -2.389 -6.058 1.00 0.11 C ATOM 1400 CG LEU A 411 8.656 -3.382 -7.144 1.00 0.11 C ATOM 1401 CD1 LEU A 411 9.147 -4.767 -6.798 1.00 0.15 C ATOM 1402 CD2 LEU A 411 7.153 -3.369 -7.338 1.00 0.16 C ATOM 0 H LEU A 411 10.686 -0.591 -7.284 1.00 0.21 H new ATOM 0 HA LEU A 411 7.777 -0.825 -6.771 1.00 0.14 H new ATOM 0 HB2 LEU A 411 10.092 -2.527 -5.808 1.00 0.11 H new ATOM 0 HB3 LEU A 411 8.467 -2.609 -5.158 1.00 0.11 H new ATOM 0 HG LEU A 411 9.131 -3.088 -8.080 1.00 0.11 H new ATOM 0 HD11 LEU A 411 8.862 -5.462 -7.588 1.00 0.15 H new ATOM 0 HD12 LEU A 411 10.233 -4.754 -6.700 1.00 0.15 H new ATOM 0 HD13 LEU A 411 8.702 -5.086 -5.856 1.00 0.15 H new ATOM 0 HD21 LEU A 411 6.880 -4.081 -8.117 1.00 0.16 H new ATOM 0 HD22 LEU A 411 6.663 -3.647 -6.405 1.00 0.16 H new ATOM 0 HD23 LEU A 411 6.833 -2.370 -7.632 1.00 0.16 H new ATOM 1414 N LEU A 412 9.488 1.175 -5.567 1.00 0.13 N ATOM 1415 CA LEU A 412 9.652 2.181 -4.543 1.00 0.11 C ATOM 1416 C LEU A 412 8.453 3.100 -4.579 1.00 0.10 C ATOM 1417 O LEU A 412 8.079 3.601 -5.642 1.00 0.11 O ATOM 1418 CB LEU A 412 10.911 2.994 -4.785 1.00 0.13 C ATOM 1419 CG LEU A 412 11.578 3.612 -3.552 1.00 0.13 C ATOM 1420 CD1 LEU A 412 10.593 4.393 -2.718 1.00 0.13 C ATOM 1421 CD2 LEU A 412 12.224 2.544 -2.715 1.00 0.16 C ATOM 0 H LEU A 412 9.748 1.475 -6.507 1.00 0.13 H new ATOM 0 HA LEU A 412 9.737 1.694 -3.572 1.00 0.11 H new ATOM 0 HB2 LEU A 412 11.640 2.353 -5.281 1.00 0.13 H new ATOM 0 HB3 LEU A 412 10.669 3.798 -5.480 1.00 0.13 H new ATOM 0 HG LEU A 412 12.342 4.304 -3.906 1.00 0.13 H new ATOM 0 HD11 LEU A 412 11.104 4.816 -1.853 1.00 0.13 H new ATOM 0 HD12 LEU A 412 10.167 5.198 -3.317 1.00 0.13 H new ATOM 0 HD13 LEU A 412 9.796 3.730 -2.381 1.00 0.13 H new ATOM 0 HD21 LEU A 412 12.693 2.999 -1.843 1.00 0.16 H new ATOM 0 HD22 LEU A 412 11.468 1.830 -2.389 1.00 0.16 H new ATOM 0 HD23 LEU A 412 12.980 2.027 -3.305 1.00 0.16 H new ATOM 1433 N PHE A 413 7.860 3.326 -3.430 1.00 0.10 N ATOM 1434 CA PHE A 413 6.711 4.183 -3.343 1.00 0.11 C ATOM 1435 C PHE A 413 6.833 5.032 -2.098 1.00 0.12 C ATOM 1436 O PHE A 413 7.281 4.555 -1.055 1.00 0.19 O ATOM 1437 CB PHE A 413 5.422 3.367 -3.315 1.00 0.12 C ATOM 1438 CG PHE A 413 5.319 2.374 -4.434 1.00 0.10 C ATOM 1439 CD1 PHE A 413 5.836 1.104 -4.281 1.00 0.11 C ATOM 1440 CD2 PHE A 413 4.722 2.709 -5.634 1.00 0.10 C ATOM 1441 CE1 PHE A 413 5.761 0.179 -5.301 1.00 0.11 C ATOM 1442 CE2 PHE A 413 4.643 1.788 -6.658 1.00 0.11 C ATOM 1443 CZ PHE A 413 5.164 0.523 -6.494 1.00 0.11 C ATOM 0 H PHE A 413 8.159 2.924 -2.541 1.00 0.10 H new ATOM 0 HA PHE A 413 6.670 4.825 -4.223 1.00 0.11 H new ATOM 0 HB2 PHE A 413 5.356 2.839 -2.364 1.00 0.12 H new ATOM 0 HB3 PHE A 413 4.570 4.046 -3.362 1.00 0.12 H new ATOM 0 HD1 PHE A 413 6.307 0.830 -3.348 1.00 0.11 H new ATOM 0 HD2 PHE A 413 4.314 3.699 -5.771 1.00 0.10 H new ATOM 0 HE1 PHE A 413 6.169 -0.812 -5.165 1.00 0.11 H new ATOM 0 HE2 PHE A 413 4.171 2.059 -7.591 1.00 0.11 H new ATOM 0 HZ PHE A 413 5.105 -0.196 -7.298 1.00 0.11 H new ATOM 1453 N ARG A 414 6.473 6.287 -2.209 1.00 0.10 N ATOM 1454 CA ARG A 414 6.568 7.189 -1.096 1.00 0.12 C ATOM 1455 C ARG A 414 5.203 7.767 -0.793 1.00 0.11 C ATOM 1456 O ARG A 414 4.526 8.289 -1.678 1.00 0.15 O ATOM 1457 CB ARG A 414 7.605 8.271 -1.395 1.00 0.20 C ATOM 1458 CG ARG A 414 7.175 9.673 -1.038 1.00 0.35 C ATOM 1459 CD ARG A 414 8.370 10.578 -0.814 1.00 0.37 C ATOM 1460 NE ARG A 414 9.466 10.302 -1.751 1.00 1.21 N ATOM 1461 CZ ARG A 414 10.542 11.080 -1.881 1.00 1.46 C ATOM 1462 NH1 ARG A 414 10.589 12.256 -1.274 1.00 1.06 N ATOM 1463 NH2 ARG A 414 11.552 10.704 -2.652 1.00 2.58 N ATOM 0 H ARG A 414 6.110 6.705 -3.065 1.00 0.10 H new ATOM 0 HA ARG A 414 6.903 6.656 -0.206 1.00 0.12 H new ATOM 0 HB2 ARG A 414 8.521 8.037 -0.852 1.00 0.20 H new ATOM 0 HB3 ARG A 414 7.847 8.239 -2.457 1.00 0.20 H new ATOM 0 HG2 ARG A 414 6.554 10.079 -1.836 1.00 0.35 H new ATOM 0 HG3 ARG A 414 6.561 9.649 -0.138 1.00 0.35 H new ATOM 0 HD2 ARG A 414 8.059 11.618 -0.919 1.00 0.37 H new ATOM 0 HD3 ARG A 414 8.729 10.454 0.208 1.00 0.37 H new ATOM 0 HE ARG A 414 9.401 9.469 -2.335 1.00 1.21 H new ATOM 0 HH11 ARG A 414 9.802 12.568 -0.706 1.00 1.06 H new ATOM 0 HH12 ARG A 414 11.413 12.849 -1.375 1.00 1.06 H new ATOM 0 HH21 ARG A 414 11.510 9.815 -3.150 1.00 2.58 H new ATOM 0 HH22 ARG A 414 12.372 11.304 -2.747 1.00 2.58 H new ATOM 1477 N PHE A 415 4.788 7.622 0.448 1.00 0.10 N ATOM 1478 CA PHE A 415 3.507 8.130 0.883 1.00 0.09 C ATOM 1479 C PHE A 415 3.494 9.652 0.817 1.00 0.11 C ATOM 1480 O PHE A 415 4.215 10.329 1.551 1.00 0.14 O ATOM 1481 CB PHE A 415 3.203 7.665 2.310 1.00 0.10 C ATOM 1482 CG PHE A 415 2.538 6.328 2.418 1.00 0.10 C ATOM 1483 CD1 PHE A 415 1.155 6.234 2.409 1.00 0.11 C ATOM 1484 CD2 PHE A 415 3.287 5.174 2.562 1.00 0.10 C ATOM 1485 CE1 PHE A 415 0.534 5.012 2.536 1.00 0.13 C ATOM 1486 CE2 PHE A 415 2.677 3.951 2.686 1.00 0.11 C ATOM 1487 CZ PHE A 415 1.296 3.867 2.672 1.00 0.12 C ATOM 0 H PHE A 415 5.325 7.153 1.177 1.00 0.10 H new ATOM 0 HA PHE A 415 2.737 7.740 0.217 1.00 0.09 H new ATOM 0 HB2 PHE A 415 4.137 7.635 2.872 1.00 0.10 H new ATOM 0 HB3 PHE A 415 2.567 8.409 2.789 1.00 0.10 H new ATOM 0 HD1 PHE A 415 0.559 7.128 2.301 1.00 0.11 H new ATOM 0 HD2 PHE A 415 4.365 5.236 2.577 1.00 0.10 H new ATOM 0 HE1 PHE A 415 -0.544 4.948 2.529 1.00 0.13 H new ATOM 0 HE2 PHE A 415 3.273 3.057 2.794 1.00 0.11 H new ATOM 0 HZ PHE A 415 0.813 2.906 2.767 1.00 0.12 H new ATOM 1497 N MET A 416 2.690 10.168 -0.099 1.00 0.11 N ATOM 1498 CA MET A 416 2.489 11.601 -0.251 1.00 0.15 C ATOM 1499 C MET A 416 1.880 12.191 1.014 1.00 0.17 C ATOM 1500 O MET A 416 2.148 13.341 1.373 1.00 0.23 O ATOM 1501 CB MET A 416 1.566 11.869 -1.438 1.00 0.15 C ATOM 1502 CG MET A 416 2.191 11.588 -2.784 1.00 0.24 C ATOM 1503 SD MET A 416 3.620 12.640 -3.117 1.00 1.41 S ATOM 1504 CE MET A 416 2.889 14.271 -2.981 1.00 1.47 C ATOM 0 H MET A 416 2.157 9.603 -0.760 1.00 0.11 H new ATOM 0 HA MET A 416 3.456 12.072 -0.427 1.00 0.15 H new ATOM 0 HB2 MET A 416 0.669 11.258 -1.332 1.00 0.15 H new ATOM 0 HB3 MET A 416 1.248 12.911 -1.408 1.00 0.15 H new ATOM 0 HG2 MET A 416 2.496 10.542 -2.828 1.00 0.24 H new ATOM 0 HG3 MET A 416 1.445 11.736 -3.565 1.00 0.24 H new ATOM 0 HE1 MET A 416 3.539 15.002 -3.462 1.00 1.47 H new ATOM 0 HE2 MET A 416 1.915 14.275 -3.469 1.00 1.47 H new ATOM 0 HE3 MET A 416 2.768 14.529 -1.929 1.00 1.47 H new ATOM 1514 N LYS A 417 1.056 11.396 1.680 1.00 0.16 N ATOM 1515 CA LYS A 417 0.414 11.811 2.912 1.00 0.21 C ATOM 1516 C LYS A 417 0.467 10.692 3.926 1.00 0.21 C ATOM 1517 O LYS A 417 0.858 9.570 3.613 1.00 0.22 O ATOM 1518 CB LYS A 417 -1.051 12.179 2.686 1.00 0.29 C ATOM 1519 CG LYS A 417 -1.276 13.449 1.895 1.00 0.57 C ATOM 1520 CD LYS A 417 -2.745 13.823 1.899 1.00 0.54 C ATOM 1521 CE LYS A 417 -3.014 15.048 1.046 1.00 0.84 C ATOM 1522 NZ LYS A 417 -2.352 16.269 1.585 1.00 1.36 N ATOM 0 H LYS A 417 0.816 10.451 1.381 1.00 0.16 H new ATOM 0 HA LYS A 417 0.951 12.687 3.276 1.00 0.21 H new ATOM 0 HB2 LYS A 417 -1.542 11.355 2.168 1.00 0.29 H new ATOM 0 HB3 LYS A 417 -1.538 12.282 3.656 1.00 0.29 H new ATOM 0 HG2 LYS A 417 -0.687 14.260 2.323 1.00 0.57 H new ATOM 0 HG3 LYS A 417 -0.932 13.312 0.870 1.00 0.57 H new ATOM 0 HD2 LYS A 417 -3.335 12.985 1.528 1.00 0.54 H new ATOM 0 HD3 LYS A 417 -3.069 14.013 2.922 1.00 0.54 H new ATOM 0 HE2 LYS A 417 -2.663 14.865 0.031 1.00 0.84 H new ATOM 0 HE3 LYS A 417 -4.089 15.217 0.986 1.00 0.84 H new ATOM 0 HZ1 LYS A 417 -2.914 17.108 1.336 1.00 1.36 H new ATOM 0 HZ2 LYS A 417 -2.279 16.196 2.620 1.00 1.36 H new ATOM 0 HZ3 LYS A 417 -1.400 16.357 1.176 1.00 1.36 H new ATOM 1536 N THR A 418 0.070 11.014 5.138 1.00 0.24 N ATOM 1537 CA THR A 418 -0.073 10.028 6.176 1.00 0.24 C ATOM 1538 C THR A 418 -1.544 9.691 6.374 1.00 0.26 C ATOM 1539 O THR A 418 -2.414 10.499 6.044 1.00 0.28 O ATOM 1540 CB THR A 418 0.549 10.535 7.479 1.00 0.26 C ATOM 1541 OG1 THR A 418 0.125 11.885 7.729 1.00 0.35 O ATOM 1542 CG2 THR A 418 2.061 10.474 7.366 1.00 0.22 C ATOM 0 H THR A 418 -0.161 11.965 5.427 1.00 0.24 H new ATOM 0 HA THR A 418 0.453 9.120 5.879 1.00 0.24 H new ATOM 0 HB THR A 418 0.223 9.908 8.309 1.00 0.26 H new ATOM 0 HG1 THR A 418 0.525 12.204 8.565 1.00 0.35 H new ATOM 0 HG21 THR A 418 2.510 10.834 8.292 1.00 0.22 H new ATOM 0 HG22 THR A 418 2.371 9.444 7.189 1.00 0.22 H new ATOM 0 HG23 THR A 418 2.389 11.100 6.536 1.00 0.22 H new ATOM 1550 N PRO A 419 -1.834 8.493 6.893 1.00 0.25 N ATOM 1551 CA PRO A 419 -3.197 7.953 6.993 1.00 0.28 C ATOM 1552 C PRO A 419 -4.249 8.952 7.468 1.00 0.31 C ATOM 1553 O PRO A 419 -5.362 8.974 6.946 1.00 0.33 O ATOM 1554 CB PRO A 419 -3.022 6.815 7.989 1.00 0.29 C ATOM 1555 CG PRO A 419 -1.660 6.307 7.675 1.00 0.27 C ATOM 1556 CD PRO A 419 -0.841 7.537 7.422 1.00 0.25 C ATOM 0 HA PRO A 419 -3.581 7.655 6.018 1.00 0.28 H new ATOM 0 HB2 PRO A 419 -3.096 7.164 9.019 1.00 0.29 H new ATOM 0 HB3 PRO A 419 -3.781 6.044 7.859 1.00 0.29 H new ATOM 0 HG2 PRO A 419 -1.254 5.725 8.503 1.00 0.27 H new ATOM 0 HG3 PRO A 419 -1.673 5.654 6.802 1.00 0.27 H new ATOM 0 HD2 PRO A 419 -0.373 7.905 8.335 1.00 0.25 H new ATOM 0 HD3 PRO A 419 -0.041 7.349 6.706 1.00 0.25 H new ATOM 1564 N ASP A 420 -3.896 9.783 8.433 1.00 0.35 N ATOM 1565 CA ASP A 420 -4.821 10.796 8.944 1.00 0.42 C ATOM 1566 C ASP A 420 -5.269 11.751 7.842 1.00 0.43 C ATOM 1567 O ASP A 420 -6.461 12.012 7.679 1.00 0.48 O ATOM 1568 CB ASP A 420 -4.179 11.596 10.074 1.00 0.49 C ATOM 1569 CG ASP A 420 -5.041 12.768 10.504 1.00 0.62 C ATOM 1570 OD1 ASP A 420 -6.096 12.540 11.124 1.00 0.74 O ATOM 1571 OD2 ASP A 420 -4.663 13.926 10.216 1.00 0.72 O ATOM 0 H ASP A 420 -2.980 9.782 8.881 1.00 0.35 H new ATOM 0 HA ASP A 420 -5.695 10.268 9.325 1.00 0.42 H new ATOM 0 HB2 ASP A 420 -4.006 10.941 10.928 1.00 0.49 H new ATOM 0 HB3 ASP A 420 -3.205 11.962 9.750 1.00 0.49 H new ATOM 1576 N GLU A 421 -4.311 12.267 7.084 1.00 0.42 N ATOM 1577 CA GLU A 421 -4.620 13.174 5.988 1.00 0.45 C ATOM 1578 C GLU A 421 -5.304 12.438 4.848 1.00 0.42 C ATOM 1579 O GLU A 421 -6.161 12.987 4.156 1.00 0.49 O ATOM 1580 CB GLU A 421 -3.359 13.847 5.463 1.00 0.49 C ATOM 1581 CG GLU A 421 -3.073 15.190 6.102 1.00 0.81 C ATOM 1582 CD GLU A 421 -2.408 16.135 5.130 1.00 1.60 C ATOM 1583 OE1 GLU A 421 -3.051 16.538 4.139 1.00 2.17 O ATOM 1584 OE2 GLU A 421 -1.235 16.498 5.367 1.00 2.21 O ATOM 0 H GLU A 421 -3.317 12.074 7.207 1.00 0.42 H new ATOM 0 HA GLU A 421 -5.295 13.935 6.379 1.00 0.45 H new ATOM 0 HB2 GLU A 421 -2.509 13.186 5.631 1.00 0.49 H new ATOM 0 HB3 GLU A 421 -3.451 13.980 4.385 1.00 0.49 H new ATOM 0 HG2 GLU A 421 -4.004 15.630 6.459 1.00 0.81 H new ATOM 0 HG3 GLU A 421 -2.432 15.051 6.972 1.00 0.81 H new ATOM 1591 N ILE A 422 -4.921 11.191 4.663 1.00 0.34 N ATOM 1592 CA ILE A 422 -5.451 10.385 3.583 1.00 0.33 C ATOM 1593 C ILE A 422 -6.914 10.023 3.829 1.00 0.36 C ATOM 1594 O ILE A 422 -7.747 10.095 2.927 1.00 0.39 O ATOM 1595 CB ILE A 422 -4.624 9.105 3.403 1.00 0.29 C ATOM 1596 CG1 ILE A 422 -3.152 9.448 3.168 1.00 0.27 C ATOM 1597 CG2 ILE A 422 -5.169 8.292 2.253 1.00 0.32 C ATOM 1598 CD1 ILE A 422 -2.283 8.235 2.914 1.00 0.27 C ATOM 0 H ILE A 422 -4.240 10.711 5.251 1.00 0.34 H new ATOM 0 HA ILE A 422 -5.390 10.979 2.671 1.00 0.33 H new ATOM 0 HB ILE A 422 -4.695 8.511 4.314 1.00 0.29 H new ATOM 0 HG12 ILE A 422 -3.076 10.124 2.317 1.00 0.27 H new ATOM 0 HG13 ILE A 422 -2.769 9.984 4.036 1.00 0.27 H new ATOM 0 HG21 ILE A 422 -4.575 7.386 2.134 1.00 0.32 H new ATOM 0 HG22 ILE A 422 -6.205 8.022 2.457 1.00 0.32 H new ATOM 0 HG23 ILE A 422 -5.121 8.880 1.337 1.00 0.32 H new ATOM 0 HD11 ILE A 422 -1.252 8.552 2.756 1.00 0.27 H new ATOM 0 HD12 ILE A 422 -2.329 7.568 3.775 1.00 0.27 H new ATOM 0 HD13 ILE A 422 -2.641 7.710 2.028 1.00 0.27 H new ATOM 1610 N MET A 423 -7.233 9.667 5.063 1.00 0.42 N ATOM 1611 CA MET A 423 -8.593 9.296 5.418 1.00 0.51 C ATOM 1612 C MET A 423 -9.473 10.526 5.580 1.00 0.58 C ATOM 1613 O MET A 423 -10.630 10.438 5.987 1.00 0.71 O ATOM 1614 CB MET A 423 -8.597 8.463 6.692 1.00 0.58 C ATOM 1615 CG MET A 423 -7.886 7.141 6.516 1.00 0.58 C ATOM 1616 SD MET A 423 -8.334 5.929 7.775 1.00 0.90 S ATOM 1617 CE MET A 423 -10.062 5.657 7.378 1.00 2.01 C ATOM 0 H MET A 423 -6.568 9.627 5.836 1.00 0.42 H new ATOM 0 HA MET A 423 -9.004 8.696 4.606 1.00 0.51 H new ATOM 0 HB2 MET A 423 -8.119 9.026 7.493 1.00 0.58 H new ATOM 0 HB3 MET A 423 -9.626 8.281 7.001 1.00 0.58 H new ATOM 0 HG2 MET A 423 -8.119 6.737 5.531 1.00 0.58 H new ATOM 0 HG3 MET A 423 -6.809 7.307 6.546 1.00 0.58 H new ATOM 0 HE1 MET A 423 -10.360 4.664 7.713 1.00 2.01 H new ATOM 0 HE2 MET A 423 -10.673 6.408 7.879 1.00 2.01 H new ATOM 0 HE3 MET A 423 -10.204 5.734 6.300 1.00 2.01 H new ATOM 1627 N SER A 424 -8.913 11.664 5.230 1.00 0.59 N ATOM 1628 CA SER A 424 -9.603 12.941 5.341 1.00 0.72 C ATOM 1629 C SER A 424 -10.273 13.317 4.015 1.00 0.67 C ATOM 1630 O SER A 424 -10.280 14.482 3.614 1.00 1.09 O ATOM 1631 CB SER A 424 -8.618 14.032 5.783 1.00 0.92 C ATOM 1632 OG SER A 424 -9.279 15.262 6.025 1.00 1.57 O ATOM 0 H SER A 424 -7.965 11.735 4.859 1.00 0.59 H new ATOM 0 HA SER A 424 -10.385 12.850 6.095 1.00 0.72 H new ATOM 0 HB2 SER A 424 -8.101 13.712 6.687 1.00 0.92 H new ATOM 0 HB3 SER A 424 -7.858 14.171 5.014 1.00 0.92 H new ATOM 0 HG SER A 424 -9.938 15.424 5.318 1.00 1.57 H new ATOM 1638 N GLY A 425 -10.824 12.320 3.327 1.00 0.43 N ATOM 1639 CA GLY A 425 -11.576 12.592 2.116 1.00 0.42 C ATOM 1640 C GLY A 425 -10.938 12.023 0.863 1.00 0.37 C ATOM 1641 O GLY A 425 -11.535 12.066 -0.212 1.00 0.50 O ATOM 0 H GLY A 425 -10.763 11.335 3.585 1.00 0.43 H new ATOM 0 HA2 GLY A 425 -12.580 12.180 2.222 1.00 0.42 H new ATOM 0 HA3 GLY A 425 -11.685 13.670 2.000 1.00 0.42 H new ATOM 1645 N ARG A 426 -9.734 11.479 0.990 1.00 0.38 N ATOM 1646 CA ARG A 426 -9.038 10.911 -0.160 1.00 0.36 C ATOM 1647 C ARG A 426 -9.510 9.478 -0.378 1.00 0.33 C ATOM 1648 O ARG A 426 -9.915 9.089 -1.472 1.00 0.34 O ATOM 1649 CB ARG A 426 -7.523 10.929 0.080 1.00 0.39 C ATOM 1650 CG ARG A 426 -6.988 12.239 0.611 1.00 0.56 C ATOM 1651 CD ARG A 426 -6.749 13.240 -0.495 1.00 0.92 C ATOM 1652 NE ARG A 426 -7.989 13.765 -1.063 1.00 1.37 N ATOM 1653 CZ ARG A 426 -8.521 14.939 -0.729 1.00 2.06 C ATOM 1654 NH1 ARG A 426 -7.957 15.681 0.218 1.00 2.63 N ATOM 1655 NH2 ARG A 426 -9.625 15.358 -1.331 1.00 2.67 N ATOM 0 H ARG A 426 -9.222 11.419 1.870 1.00 0.38 H new ATOM 0 HA ARG A 426 -9.260 11.507 -1.045 1.00 0.36 H new ATOM 0 HB2 ARG A 426 -7.270 10.136 0.784 1.00 0.39 H new ATOM 0 HB3 ARG A 426 -7.017 10.697 -0.857 1.00 0.39 H new ATOM 0 HG2 ARG A 426 -7.694 12.654 1.330 1.00 0.56 H new ATOM 0 HG3 ARG A 426 -6.056 12.060 1.146 1.00 0.56 H new ATOM 0 HD2 ARG A 426 -6.154 14.067 -0.108 1.00 0.92 H new ATOM 0 HD3 ARG A 426 -6.164 12.769 -1.285 1.00 0.92 H new ATOM 0 HE ARG A 426 -8.476 13.198 -1.757 1.00 1.37 H new ATOM 0 HH11 ARG A 426 -7.115 15.352 0.690 1.00 2.63 H new ATOM 0 HH12 ARG A 426 -8.366 16.580 0.473 1.00 2.63 H new ATOM 0 HH21 ARG A 426 -10.065 14.781 -2.048 1.00 2.67 H new ATOM 0 HH22 ARG A 426 -10.035 16.257 -1.077 1.00 2.67 H new ATOM 1669 N THR A 427 -9.472 8.715 0.700 1.00 0.33 N ATOM 1670 CA THR A 427 -9.876 7.314 0.697 1.00 0.37 C ATOM 1671 C THR A 427 -11.380 7.143 0.689 1.00 0.43 C ATOM 1672 O THR A 427 -11.880 6.025 0.600 1.00 0.58 O ATOM 1673 CB THR A 427 -9.303 6.610 1.926 1.00 0.63 C ATOM 1674 OG1 THR A 427 -9.601 7.365 3.112 1.00 1.24 O ATOM 1675 CG2 THR A 427 -7.815 6.495 1.782 1.00 0.41 C ATOM 0 H THR A 427 -9.158 9.050 1.611 1.00 0.33 H new ATOM 0 HA THR A 427 -9.485 6.871 -0.219 1.00 0.37 H new ATOM 0 HB THR A 427 -9.750 5.619 2.008 1.00 0.63 H new ATOM 0 HG1 THR A 427 -9.685 6.756 3.875 1.00 1.24 H new ATOM 0 HG21 THR A 427 -7.402 5.993 2.657 1.00 0.41 H new ATOM 0 HG22 THR A 427 -7.580 5.918 0.888 1.00 0.41 H new ATOM 0 HG23 THR A 427 -7.380 7.491 1.696 1.00 0.41 H new ATOM 1683 N ASP A 428 -12.085 8.257 0.765 1.00 0.45 N ATOM 1684 CA ASP A 428 -13.549 8.259 0.794 1.00 0.62 C ATOM 1685 C ASP A 428 -14.125 7.414 -0.338 1.00 0.61 C ATOM 1686 O ASP A 428 -15.112 6.702 -0.167 1.00 0.78 O ATOM 1687 CB ASP A 428 -14.068 9.696 0.681 1.00 0.74 C ATOM 1688 CG ASP A 428 -15.581 9.770 0.606 1.00 1.27 C ATOM 1689 OD1 ASP A 428 -16.244 9.685 1.665 1.00 1.63 O ATOM 1690 OD2 ASP A 428 -16.114 9.907 -0.514 1.00 1.75 O ATOM 0 H ASP A 428 -11.667 9.187 0.809 1.00 0.45 H new ATOM 0 HA ASP A 428 -13.870 7.825 1.741 1.00 0.62 H new ATOM 0 HB2 ASP A 428 -13.723 10.271 1.540 1.00 0.74 H new ATOM 0 HB3 ASP A 428 -13.641 10.163 -0.207 1.00 0.74 H new ATOM 1695 N ARG A 429 -13.492 7.501 -1.493 1.00 0.54 N ATOM 1696 CA ARG A 429 -13.908 6.744 -2.663 1.00 0.65 C ATOM 1697 C ARG A 429 -13.348 5.327 -2.604 1.00 0.55 C ATOM 1698 O ARG A 429 -14.011 4.351 -2.961 1.00 0.66 O ATOM 1699 CB ARG A 429 -13.410 7.453 -3.915 1.00 0.81 C ATOM 1700 CG ARG A 429 -13.392 8.959 -3.750 1.00 0.98 C ATOM 1701 CD ARG A 429 -12.926 9.676 -5.004 1.00 1.12 C ATOM 1702 NE ARG A 429 -13.914 9.631 -6.078 1.00 1.64 N ATOM 1703 CZ ARG A 429 -14.778 10.614 -6.325 1.00 2.03 C ATOM 1704 NH1 ARG A 429 -14.885 11.629 -5.476 1.00 2.00 N ATOM 1705 NH2 ARG A 429 -15.558 10.562 -7.398 1.00 3.05 N ATOM 0 H ARG A 429 -12.678 8.095 -1.648 1.00 0.54 H new ATOM 0 HA ARG A 429 -14.996 6.681 -2.686 1.00 0.65 H new ATOM 0 HB2 ARG A 429 -12.406 7.103 -4.154 1.00 0.81 H new ATOM 0 HB3 ARG A 429 -14.048 7.189 -4.758 1.00 0.81 H new ATOM 0 HG2 ARG A 429 -14.392 9.304 -3.488 1.00 0.98 H new ATOM 0 HG3 ARG A 429 -12.736 9.222 -2.920 1.00 0.98 H new ATOM 0 HD2 ARG A 429 -12.705 10.716 -4.762 1.00 1.12 H new ATOM 0 HD3 ARG A 429 -11.997 9.225 -5.352 1.00 1.12 H new ATOM 0 HE ARG A 429 -13.944 8.802 -6.671 1.00 1.64 H new ATOM 0 HH11 ARG A 429 -14.306 11.655 -4.637 1.00 2.00 H new ATOM 0 HH12 ARG A 429 -15.546 12.383 -5.663 1.00 2.00 H new ATOM 0 HH21 ARG A 429 -15.496 9.768 -8.035 1.00 3.05 H new ATOM 0 HH22 ARG A 429 -16.219 11.316 -7.585 1.00 3.05 H new ATOM 1719 N LEU A 430 -12.129 5.245 -2.103 1.00 0.42 N ATOM 1720 CA LEU A 430 -11.333 4.026 -2.096 1.00 0.36 C ATOM 1721 C LEU A 430 -11.948 2.907 -1.278 1.00 0.39 C ATOM 1722 O LEU A 430 -11.959 1.753 -1.705 1.00 0.45 O ATOM 1723 CB LEU A 430 -9.973 4.347 -1.534 1.00 0.31 C ATOM 1724 CG LEU A 430 -9.035 5.050 -2.484 1.00 0.28 C ATOM 1725 CD1 LEU A 430 -7.821 5.499 -1.724 1.00 0.64 C ATOM 1726 CD2 LEU A 430 -8.636 4.126 -3.619 1.00 0.56 C ATOM 0 H LEU A 430 -11.652 6.041 -1.679 1.00 0.42 H new ATOM 0 HA LEU A 430 -11.277 3.672 -3.125 1.00 0.36 H new ATOM 0 HB2 LEU A 430 -10.101 4.969 -0.648 1.00 0.31 H new ATOM 0 HB3 LEU A 430 -9.505 3.419 -1.206 1.00 0.31 H new ATOM 0 HG LEU A 430 -9.537 5.915 -2.916 1.00 0.28 H new ATOM 0 HD11 LEU A 430 -7.136 6.009 -2.401 1.00 0.64 H new ATOM 0 HD12 LEU A 430 -8.121 6.182 -0.930 1.00 0.64 H new ATOM 0 HD13 LEU A 430 -7.323 4.633 -1.289 1.00 0.64 H new ATOM 0 HD21 LEU A 430 -7.959 4.650 -4.294 1.00 0.56 H new ATOM 0 HD22 LEU A 430 -8.135 3.247 -3.214 1.00 0.56 H new ATOM 0 HD23 LEU A 430 -9.526 3.816 -4.166 1.00 0.56 H new ATOM 1738 N GLU A 431 -12.440 3.263 -0.103 1.00 0.42 N ATOM 1739 CA GLU A 431 -13.018 2.303 0.847 1.00 0.53 C ATOM 1740 C GLU A 431 -14.025 1.354 0.182 1.00 0.59 C ATOM 1741 O GLU A 431 -14.273 0.258 0.674 1.00 0.72 O ATOM 1742 CB GLU A 431 -13.734 3.049 1.976 1.00 0.61 C ATOM 1743 CG GLU A 431 -12.897 4.104 2.671 1.00 0.73 C ATOM 1744 CD GLU A 431 -13.724 4.969 3.598 1.00 0.97 C ATOM 1745 OE1 GLU A 431 -13.876 4.600 4.782 1.00 1.31 O ATOM 1746 OE2 GLU A 431 -14.221 6.023 3.158 1.00 1.25 O ATOM 0 H GLU A 431 -12.454 4.228 0.228 1.00 0.42 H new ATOM 0 HA GLU A 431 -12.190 1.710 1.235 1.00 0.53 H new ATOM 0 HB2 GLU A 431 -14.627 3.523 1.570 1.00 0.61 H new ATOM 0 HB3 GLU A 431 -14.068 2.323 2.718 1.00 0.61 H new ATOM 0 HG2 GLU A 431 -12.104 3.619 3.240 1.00 0.73 H new ATOM 0 HG3 GLU A 431 -12.414 4.733 1.923 1.00 0.73 H new ATOM 1753 N HIS A 432 -14.585 1.778 -0.944 1.00 0.58 N ATOM 1754 CA HIS A 432 -15.662 1.041 -1.589 1.00 0.66 C ATOM 1755 C HIS A 432 -15.125 0.009 -2.580 1.00 0.60 C ATOM 1756 O HIS A 432 -15.710 -1.061 -2.746 1.00 0.72 O ATOM 1757 CB HIS A 432 -16.606 2.017 -2.296 1.00 0.76 C ATOM 1758 CG HIS A 432 -17.185 3.046 -1.380 1.00 1.72 C ATOM 1759 ND1 HIS A 432 -18.490 3.039 -0.948 1.00 2.60 N ATOM 1760 CD2 HIS A 432 -16.606 4.112 -0.796 1.00 2.20 C ATOM 1761 CE1 HIS A 432 -18.685 4.058 -0.134 1.00 3.59 C ATOM 1762 NE2 HIS A 432 -17.555 4.728 -0.022 1.00 3.38 N ATOM 0 H HIS A 432 -14.309 2.631 -1.430 1.00 0.58 H new ATOM 0 HA HIS A 432 -16.210 0.500 -0.818 1.00 0.66 H new ATOM 0 HB2 HIS A 432 -16.065 2.518 -3.099 1.00 0.76 H new ATOM 0 HB3 HIS A 432 -17.417 1.456 -2.760 1.00 0.76 H new ATOM 0 HD2 HIS A 432 -15.579 4.425 -0.916 1.00 2.20 H new ATOM 0 HE1 HIS A 432 -19.615 4.303 0.358 1.00 3.59 H new ATOM 0 HE2 HIS A 432 -17.411 5.564 0.545 1.00 3.38 H new ATOM 1771 N LEU A 433 -14.013 0.325 -3.233 1.00 0.50 N ATOM 1772 CA LEU A 433 -13.408 -0.596 -4.193 1.00 0.53 C ATOM 1773 C LEU A 433 -12.372 -1.481 -3.512 1.00 0.54 C ATOM 1774 O LEU A 433 -12.237 -2.662 -3.826 1.00 0.67 O ATOM 1775 CB LEU A 433 -12.758 0.156 -5.359 1.00 0.60 C ATOM 1776 CG LEU A 433 -11.635 1.111 -4.979 1.00 0.57 C ATOM 1777 CD1 LEU A 433 -10.510 1.038 -5.998 1.00 0.65 C ATOM 1778 CD2 LEU A 433 -12.166 2.527 -4.884 1.00 0.88 C ATOM 0 H LEU A 433 -13.513 1.206 -3.118 1.00 0.50 H new ATOM 0 HA LEU A 433 -14.208 -1.221 -4.590 1.00 0.53 H new ATOM 0 HB2 LEU A 433 -12.366 -0.575 -6.066 1.00 0.60 H new ATOM 0 HB3 LEU A 433 -13.531 0.721 -5.880 1.00 0.60 H new ATOM 0 HG LEU A 433 -11.240 0.817 -4.006 1.00 0.57 H new ATOM 0 HD11 LEU A 433 -9.715 1.727 -5.712 1.00 0.65 H new ATOM 0 HD12 LEU A 433 -10.116 0.022 -6.032 1.00 0.65 H new ATOM 0 HD13 LEU A 433 -10.891 1.313 -6.981 1.00 0.65 H new ATOM 0 HD21 LEU A 433 -11.355 3.202 -4.612 1.00 0.88 H new ATOM 0 HD22 LEU A 433 -12.579 2.826 -5.847 1.00 0.88 H new ATOM 0 HD23 LEU A 433 -12.947 2.573 -4.125 1.00 0.88 H new ATOM 1790 N GLU A 434 -11.660 -0.904 -2.555 1.00 0.49 N ATOM 1791 CA GLU A 434 -10.628 -1.622 -1.810 1.00 0.60 C ATOM 1792 C GLU A 434 -11.242 -2.613 -0.824 1.00 0.76 C ATOM 1793 O GLU A 434 -10.536 -3.316 -0.103 1.00 1.02 O ATOM 1794 CB GLU A 434 -9.733 -0.632 -1.086 1.00 0.54 C ATOM 1795 CG GLU A 434 -8.899 0.192 -2.042 1.00 0.63 C ATOM 1796 CD GLU A 434 -7.917 -0.651 -2.833 1.00 1.10 C ATOM 1797 OE1 GLU A 434 -8.357 -1.340 -3.769 1.00 1.90 O ATOM 1798 OE2 GLU A 434 -6.707 -0.623 -2.522 1.00 1.36 O ATOM 0 H GLU A 434 -11.778 0.069 -2.272 1.00 0.49 H new ATOM 0 HA GLU A 434 -10.028 -2.193 -2.518 1.00 0.60 H new ATOM 0 HB2 GLU A 434 -10.347 0.032 -0.477 1.00 0.54 H new ATOM 0 HB3 GLU A 434 -9.075 -1.171 -0.405 1.00 0.54 H new ATOM 0 HG2 GLU A 434 -9.558 0.719 -2.732 1.00 0.63 H new ATOM 0 HG3 GLU A 434 -8.352 0.950 -1.481 1.00 0.63 H new ATOM 1805 N SER A 435 -12.564 -2.683 -0.827 1.00 0.72 N ATOM 1806 CA SER A 435 -13.292 -3.583 0.043 1.00 0.89 C ATOM 1807 C SER A 435 -13.546 -4.879 -0.708 1.00 1.03 C ATOM 1808 O SER A 435 -13.949 -5.894 -0.139 1.00 1.20 O ATOM 1809 CB SER A 435 -14.611 -2.936 0.466 1.00 0.97 C ATOM 1810 OG SER A 435 -15.314 -3.736 1.400 1.00 1.47 O ATOM 0 H SER A 435 -13.158 -2.117 -1.433 1.00 0.72 H new ATOM 0 HA SER A 435 -12.713 -3.794 0.942 1.00 0.89 H new ATOM 0 HB2 SER A 435 -14.412 -1.957 0.903 1.00 0.97 H new ATOM 0 HB3 SER A 435 -15.234 -2.772 -0.413 1.00 0.97 H new ATOM 0 HG SER A 435 -16.151 -3.290 1.648 1.00 1.47 H new ATOM 1816 N GLN A 436 -13.289 -4.821 -2.003 1.00 1.04 N ATOM 1817 CA GLN A 436 -13.543 -5.924 -2.894 1.00 1.24 C ATOM 1818 C GLN A 436 -12.233 -6.601 -3.271 1.00 1.47 C ATOM 1819 O GLN A 436 -11.824 -7.544 -2.564 1.00 1.78 O ATOM 1820 CB GLN A 436 -14.245 -5.397 -4.138 1.00 1.17 C ATOM 1821 CG GLN A 436 -15.445 -4.521 -3.825 1.00 1.30 C ATOM 1822 CD GLN A 436 -16.129 -3.998 -5.069 1.00 2.00 C ATOM 1823 OE1 GLN A 436 -16.150 -4.661 -6.107 1.00 2.65 O ATOM 1824 NE2 GLN A 436 -16.682 -2.800 -4.979 1.00 2.60 N ATOM 1825 OXT GLN A 436 -11.591 -6.157 -4.245 1.00 2.10 O ATOM 0 H GLN A 436 -12.896 -3.999 -2.462 1.00 1.04 H new ATOM 0 HA GLN A 436 -14.179 -6.660 -2.402 1.00 1.24 H new ATOM 0 HB2 GLN A 436 -13.533 -4.826 -4.734 1.00 1.17 H new ATOM 0 HB3 GLN A 436 -14.569 -6.240 -4.749 1.00 1.17 H new ATOM 0 HG2 GLN A 436 -16.162 -5.092 -3.234 1.00 1.30 H new ATOM 0 HG3 GLN A 436 -15.125 -3.679 -3.211 1.00 1.30 H new ATOM 0 HE21 GLN A 436 -16.642 -2.284 -4.100 1.00 2.60 H new ATOM 0 HE22 GLN A 436 -17.149 -2.392 -5.789 1.00 2.60 H new TER 1834 GLN A 436