USER MOD reduce.3.24.130724 H: found=0, std=0, add=516, rem=0, adj=10 USER MOD reduce.3.24.130724 removed 518 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 37 ASN : amide:sc= 1 K(o=1.9,f=0.18) USER MOD Set 1.2: A 42 THR OG1 : rot -148:sc= 0.905 USER MOD Single : A 2 THR OG1 : rot -21:sc= 0.519 USER MOD Single : A 4 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 19 ASN : amide:sc= -0.412 X(o=-0.41,f=-0.39) USER MOD Single : A 23 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 26 ASN : amide:sc= 0 X(o=0,f=-0.012) USER MOD Single : A 27 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 33 ASN : amide:sc= 1.17 K(o=1.2,f=-0.29) USER MOD Single : A 44 THR OG1 : rot 180:sc= 0 USER MOD Single : A 47 TYR OH : rot 180:sc= -0.188 USER MOD Single : A 48 ASN : amide:sc= -0.865 K(o=-0.86,f=-10!) USER MOD Single : A 50 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 53 SER OG : rot 180:sc= 0 USER MOD Single : A 55 SER OG : rot 180:sc= 0 USER MOD Single : A 58 LYS NZ :NH3+ 169:sc= 0.198 (180deg=-0.376) USER MOD Single : A 63 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 66 TYR OH : rot 30:sc= 0 USER MOD Single : A 67 LYS NZ :NH3+ 171:sc= 1.28 (180deg=1.07) USER MOD Single : A 69 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 71 LYS NZ :NH3+ -140:sc= 2.21 (180deg=0.122) USER MOD ----------------------------------------------------------------- ATOM 19 N THR A 2 -8.310 10.632 7.931 1.00 10.00 N ATOM 20 CA THR A 2 -7.452 9.815 7.081 1.00 10.00 C ATOM 21 C THR A 2 -7.660 10.197 5.612 1.00 10.00 C ATOM 22 O THR A 2 -8.726 10.697 5.254 1.00 10.00 O ATOM 23 CB THR A 2 -7.795 8.342 7.339 1.00 10.00 C ATOM 24 OG1 THR A 2 -9.201 8.192 7.429 1.00 10.00 O ATOM 25 CG2 THR A 2 -7.171 7.887 8.662 1.00 10.00 C ATOM 0 HA THR A 2 -6.400 9.982 7.312 1.00 10.00 H new ATOM 0 HB THR A 2 -7.404 7.740 6.519 1.00 10.00 H new ATOM 0 HG1 THR A 2 -9.610 9.058 7.640 1.00 10.00 H new ATOM 0 HG21 THR A 2 -7.418 6.840 8.840 1.00 10.00 H new ATOM 0 HG22 THR A 2 -6.088 8.001 8.612 1.00 10.00 H new ATOM 0 HG23 THR A 2 -7.562 8.496 9.477 1.00 10.00 H new ATOM 33 N GLU A 3 -6.639 9.957 4.787 1.00 10.00 N ATOM 34 CA GLU A 3 -6.523 10.363 3.395 1.00 10.00 C ATOM 35 C GLU A 3 -6.394 9.119 2.514 1.00 10.00 C ATOM 36 O GLU A 3 -5.745 8.146 2.901 1.00 10.00 O ATOM 37 CB GLU A 3 -5.295 11.275 3.263 1.00 10.00 C ATOM 38 CG GLU A 3 -5.703 12.749 3.187 1.00 10.00 C ATOM 39 CD GLU A 3 -4.557 13.646 3.628 1.00 10.00 C ATOM 40 OE1 GLU A 3 -3.665 13.887 2.788 1.00 10.00 O ATOM 41 OE2 GLU A 3 -4.580 14.035 4.816 1.00 10.00 O ATOM 0 H GLU A 3 -5.818 9.438 5.100 1.00 10.00 H new ATOM 0 HA GLU A 3 -7.408 10.911 3.070 1.00 10.00 H new ATOM 0 HB2 GLU A 3 -4.632 11.122 4.115 1.00 10.00 H new ATOM 0 HB3 GLU A 3 -4.733 11.004 2.369 1.00 10.00 H new ATOM 0 HG2 GLU A 3 -5.995 12.999 2.167 1.00 10.00 H new ATOM 0 HG3 GLU A 3 -6.573 12.924 3.820 1.00 10.00 H new ATOM 48 N LYS A 4 -7.074 9.154 1.362 1.00 10.00 N ATOM 49 CA LYS A 4 -7.351 8.014 0.501 1.00 10.00 C ATOM 50 C LYS A 4 -6.455 8.045 -0.740 1.00 10.00 C ATOM 51 O LYS A 4 -6.810 8.624 -1.768 1.00 10.00 O ATOM 52 CB LYS A 4 -8.846 8.040 0.162 1.00 10.00 C ATOM 53 CG LYS A 4 -9.648 8.209 1.467 1.00 10.00 C ATOM 54 CD LYS A 4 -10.899 7.330 1.496 1.00 10.00 C ATOM 55 CE LYS A 4 -12.107 8.024 0.862 1.00 10.00 C ATOM 56 NZ LYS A 4 -12.820 8.878 1.829 1.00 10.00 N ATOM 0 H LYS A 4 -7.462 10.023 0.993 1.00 10.00 H new ATOM 0 HA LYS A 4 -7.123 7.075 1.005 1.00 10.00 H new ATOM 0 HB2 LYS A 4 -9.063 8.859 -0.523 1.00 10.00 H new ATOM 0 HB3 LYS A 4 -9.135 7.118 -0.342 1.00 10.00 H new ATOM 0 HG2 LYS A 4 -9.012 7.961 2.317 1.00 10.00 H new ATOM 0 HG3 LYS A 4 -9.938 9.254 1.580 1.00 10.00 H new ATOM 0 HD2 LYS A 4 -10.699 6.398 0.967 1.00 10.00 H new ATOM 0 HD3 LYS A 4 -11.133 7.067 2.528 1.00 10.00 H new ATOM 0 HE2 LYS A 4 -11.776 8.629 0.018 1.00 10.00 H new ATOM 0 HE3 LYS A 4 -12.791 7.273 0.467 1.00 10.00 H new ATOM 0 HZ1 LYS A 4 -13.631 9.330 1.361 1.00 10.00 H new ATOM 0 HZ2 LYS A 4 -13.158 8.297 2.622 1.00 10.00 H new ATOM 0 HZ3 LYS A 4 -12.175 9.611 2.187 1.00 10.00 H new ATOM 70 N ALA A 5 -5.276 7.435 -0.612 1.00 10.00 N ATOM 71 CA ALA A 5 -4.170 7.540 -1.549 1.00 10.00 C ATOM 72 C ALA A 5 -4.055 6.264 -2.388 1.00 10.00 C ATOM 73 O ALA A 5 -4.422 5.192 -1.905 1.00 10.00 O ATOM 74 CB ALA A 5 -2.898 7.807 -0.750 1.00 10.00 C ATOM 0 H ALA A 5 -5.063 6.831 0.182 1.00 10.00 H new ATOM 0 HA ALA A 5 -4.336 8.361 -2.246 1.00 10.00 H new ATOM 0 HB1 ALA A 5 -2.051 7.890 -1.431 1.00 10.00 H new ATOM 0 HB2 ALA A 5 -3.007 8.737 -0.192 1.00 10.00 H new ATOM 0 HB3 ALA A 5 -2.725 6.985 -0.055 1.00 10.00 H new ATOM 80 N GLU A 6 -3.524 6.362 -3.614 1.00 10.00 N ATOM 81 CA GLU A 6 -3.323 5.228 -4.501 1.00 10.00 C ATOM 82 C GLU A 6 -1.871 5.135 -4.908 1.00 10.00 C ATOM 83 O GLU A 6 -1.208 6.160 -5.063 1.00 10.00 O ATOM 84 CB GLU A 6 -4.131 5.369 -5.788 1.00 10.00 C ATOM 85 CG GLU A 6 -5.536 4.807 -5.611 1.00 10.00 C ATOM 86 CD GLU A 6 -6.203 4.475 -6.941 1.00 10.00 C ATOM 87 OE1 GLU A 6 -5.471 4.420 -7.960 1.00 10.00 O ATOM 88 OE2 GLU A 6 -7.429 4.233 -6.903 1.00 10.00 O ATOM 0 H GLU A 6 -3.220 7.249 -4.016 1.00 10.00 H new ATOM 0 HA GLU A 6 -3.643 4.342 -3.952 1.00 10.00 H new ATOM 0 HB2 GLU A 6 -4.188 6.419 -6.073 1.00 10.00 H new ATOM 0 HB3 GLU A 6 -3.625 4.846 -6.599 1.00 10.00 H new ATOM 0 HG2 GLU A 6 -5.490 3.908 -4.997 1.00 10.00 H new ATOM 0 HG3 GLU A 6 -6.148 5.530 -5.072 1.00 10.00 H new ATOM 95 N PHE A 7 -1.427 3.899 -5.137 1.00 10.00 N ATOM 96 CA PHE A 7 -0.062 3.549 -5.451 1.00 10.00 C ATOM 97 C PHE A 7 -0.082 2.491 -6.546 1.00 10.00 C ATOM 98 O PHE A 7 -0.945 1.611 -6.524 1.00 10.00 O ATOM 99 CB PHE A 7 0.648 3.002 -4.204 1.00 10.00 C ATOM 100 CG PHE A 7 0.450 3.773 -2.920 1.00 10.00 C ATOM 101 CD1 PHE A 7 -0.792 3.721 -2.271 1.00 10.00 C ATOM 102 CD2 PHE A 7 1.514 4.476 -2.331 1.00 10.00 C ATOM 103 CE1 PHE A 7 -1.055 4.579 -1.194 1.00 10.00 C ATOM 104 CE2 PHE A 7 1.289 5.220 -1.159 1.00 10.00 C ATOM 105 CZ PHE A 7 -0.010 5.327 -0.630 1.00 10.00 C ATOM 0 H PHE A 7 -2.044 3.087 -5.105 1.00 10.00 H new ATOM 0 HA PHE A 7 0.480 4.432 -5.790 1.00 10.00 H new ATOM 0 HB2 PHE A 7 0.311 1.978 -4.042 1.00 10.00 H new ATOM 0 HB3 PHE A 7 1.717 2.957 -4.413 1.00 10.00 H new ATOM 0 HD1 PHE A 7 -1.545 3.021 -2.601 1.00 10.00 H new ATOM 0 HD2 PHE A 7 2.498 4.445 -2.775 1.00 10.00 H new ATOM 0 HE1 PHE A 7 -2.057 4.664 -0.800 1.00 10.00 H new ATOM 0 HE2 PHE A 7 2.115 5.710 -0.664 1.00 10.00 H new ATOM 0 HZ PHE A 7 -0.202 5.982 0.207 1.00 10.00 H new ATOM 115 N ASP A 8 0.868 2.569 -7.478 1.00 10.00 N ATOM 116 CA ASP A 8 0.917 1.736 -8.658 1.00 10.00 C ATOM 117 C ASP A 8 2.079 0.755 -8.487 1.00 10.00 C ATOM 118 O ASP A 8 3.117 1.116 -7.925 1.00 10.00 O ATOM 119 CB ASP A 8 1.073 2.668 -9.861 1.00 10.00 C ATOM 120 CG ASP A 8 -0.264 3.115 -10.452 1.00 10.00 C ATOM 121 OD1 ASP A 8 -1.270 3.163 -9.703 1.00 10.00 O ATOM 122 OD2 ASP A 8 -0.272 3.454 -11.652 1.00 10.00 O ATOM 0 H ASP A 8 1.640 3.233 -7.423 1.00 10.00 H new ATOM 0 HA ASP A 8 0.016 1.143 -8.812 1.00 10.00 H new ATOM 0 HB2 ASP A 8 1.642 3.547 -9.560 1.00 10.00 H new ATOM 0 HB3 ASP A 8 1.653 2.161 -10.632 1.00 10.00 H new ATOM 127 N ILE A 9 1.848 -0.511 -8.854 1.00 10.00 N ATOM 128 CA ILE A 9 2.620 -1.659 -8.393 1.00 10.00 C ATOM 129 C ILE A 9 3.460 -2.236 -9.529 1.00 10.00 C ATOM 130 O ILE A 9 2.908 -2.608 -10.561 1.00 10.00 O ATOM 131 CB ILE A 9 1.654 -2.732 -7.835 1.00 10.00 C ATOM 132 CG1 ILE A 9 0.449 -2.151 -7.077 1.00 10.00 C ATOM 133 CG2 ILE A 9 2.401 -3.680 -6.897 1.00 10.00 C ATOM 134 CD1 ILE A 9 0.883 -1.217 -5.958 1.00 10.00 C ATOM 0 H ILE A 9 1.098 -0.766 -9.497 1.00 10.00 H new ATOM 0 HA ILE A 9 3.300 -1.339 -7.604 1.00 10.00 H new ATOM 0 HB ILE A 9 1.269 -3.259 -8.708 1.00 10.00 H new ATOM 0 HG12 ILE A 9 -0.192 -1.611 -7.773 1.00 10.00 H new ATOM 0 HG13 ILE A 9 -0.146 -2.964 -6.661 1.00 10.00 H new ATOM 0 HG21 ILE A 9 1.710 -4.430 -6.512 1.00 10.00 H new ATOM 0 HG22 ILE A 9 3.205 -4.174 -7.443 1.00 10.00 H new ATOM 0 HG23 ILE A 9 2.822 -3.113 -6.066 1.00 10.00 H new ATOM 0 HD11 ILE A 9 0.002 -0.828 -5.447 1.00 10.00 H new ATOM 0 HD12 ILE A 9 1.503 -1.764 -5.247 1.00 10.00 H new ATOM 0 HD13 ILE A 9 1.455 -0.389 -6.377 1.00 10.00 H new ATOM 146 N GLU A 10 4.777 -2.352 -9.326 1.00 10.00 N ATOM 147 CA GLU A 10 5.676 -2.998 -10.263 1.00 10.00 C ATOM 148 C GLU A 10 6.310 -4.214 -9.585 1.00 10.00 C ATOM 149 O GLU A 10 7.235 -4.076 -8.779 1.00 10.00 O ATOM 150 CB GLU A 10 6.722 -1.986 -10.732 1.00 10.00 C ATOM 151 CG GLU A 10 6.116 -0.968 -11.709 1.00 10.00 C ATOM 152 CD GLU A 10 7.191 -0.043 -12.262 1.00 10.00 C ATOM 153 OE1 GLU A 10 7.976 -0.532 -13.101 1.00 10.00 O ATOM 154 OE2 GLU A 10 7.225 1.124 -11.817 1.00 10.00 O ATOM 0 H GLU A 10 5.245 -1.993 -8.494 1.00 10.00 H new ATOM 0 HA GLU A 10 5.138 -3.349 -11.143 1.00 10.00 H new ATOM 0 HB2 GLU A 10 7.137 -1.463 -9.870 1.00 10.00 H new ATOM 0 HB3 GLU A 10 7.547 -2.510 -11.215 1.00 10.00 H new ATOM 0 HG2 GLU A 10 5.624 -1.492 -12.528 1.00 10.00 H new ATOM 0 HG3 GLU A 10 5.351 -0.381 -11.201 1.00 10.00 H new ATOM 251 N ASN A 19 -2.044 -10.131 -0.520 1.00 10.00 N ATOM 252 CA ASN A 19 -2.605 -10.137 0.825 1.00 10.00 C ATOM 253 C ASN A 19 -1.578 -9.702 1.874 1.00 10.00 C ATOM 254 O ASN A 19 -1.942 -9.114 2.894 1.00 10.00 O ATOM 255 CB ASN A 19 -3.182 -11.517 1.188 1.00 10.00 C ATOM 256 CG ASN A 19 -4.386 -11.403 2.114 1.00 10.00 C ATOM 257 OD1 ASN A 19 -5.337 -12.168 1.997 1.00 10.00 O ATOM 258 ND2 ASN A 19 -4.377 -10.427 3.009 1.00 10.00 N ATOM 0 HA ASN A 19 -3.418 -9.411 0.827 1.00 10.00 H new ATOM 0 HB2 ASN A 19 -3.473 -12.040 0.277 1.00 10.00 H new ATOM 0 HB3 ASN A 19 -2.410 -12.118 1.668 1.00 10.00 H new ATOM 0 HD21 ASN A 19 -5.178 -10.294 3.627 1.00 10.00 H new ATOM 0 HD22 ASN A 19 -3.570 -9.808 3.080 1.00 10.00 H new ATOM 265 N ARG A 20 -0.290 -9.981 1.657 1.00 10.00 N ATOM 266 CA ARG A 20 0.731 -9.573 2.596 1.00 10.00 C ATOM 267 C ARG A 20 0.774 -8.046 2.698 1.00 10.00 C ATOM 268 O ARG A 20 0.938 -7.533 3.804 1.00 10.00 O ATOM 269 CB ARG A 20 2.086 -10.177 2.213 1.00 10.00 C ATOM 270 CG ARG A 20 2.985 -10.306 3.453 1.00 10.00 C ATOM 271 CD ARG A 20 3.274 -11.776 3.782 1.00 10.00 C ATOM 272 NE ARG A 20 4.039 -11.919 5.033 1.00 10.00 N ATOM 273 CZ ARG A 20 3.510 -11.886 6.268 1.00 10.00 C ATOM 274 NH1 ARG A 20 2.205 -11.635 6.422 1.00 10.00 N ATOM 275 NH2 ARG A 20 4.283 -12.098 7.339 1.00 10.00 N ATOM 0 H ARG A 20 0.058 -10.485 0.842 1.00 10.00 H new ATOM 0 HA ARG A 20 0.485 -9.955 3.587 1.00 10.00 H new ATOM 0 HB2 ARG A 20 1.939 -11.157 1.759 1.00 10.00 H new ATOM 0 HB3 ARG A 20 2.573 -9.550 1.467 1.00 10.00 H new ATOM 0 HG2 ARG A 20 3.923 -9.778 3.281 1.00 10.00 H new ATOM 0 HG3 ARG A 20 2.503 -9.828 4.306 1.00 10.00 H new ATOM 0 HD2 ARG A 20 2.334 -12.321 3.867 1.00 10.00 H new ATOM 0 HD3 ARG A 20 3.831 -12.229 2.962 1.00 10.00 H new ATOM 0 HE ARG A 20 5.047 -12.053 4.956 1.00 10.00 H new ATOM 0 HH11 ARG A 20 1.617 -11.470 5.605 1.00 10.00 H new ATOM 0 HH12 ARG A 20 1.798 -11.609 7.357 1.00 10.00 H new ATOM 0 HH21 ARG A 20 5.279 -12.286 7.220 1.00 10.00 H new ATOM 0 HH22 ARG A 20 3.877 -12.072 8.274 1.00 10.00 H new ATOM 289 N ILE A 21 0.593 -7.332 1.575 1.00 10.00 N ATOM 290 CA ILE A 21 0.409 -5.882 1.540 1.00 10.00 C ATOM 291 C ILE A 21 -0.508 -5.408 2.662 1.00 10.00 C ATOM 292 O ILE A 21 -0.108 -4.533 3.424 1.00 10.00 O ATOM 293 CB ILE A 21 -0.149 -5.411 0.183 1.00 10.00 C ATOM 294 CG1 ILE A 21 0.704 -5.825 -1.017 1.00 10.00 C ATOM 295 CG2 ILE A 21 -0.313 -3.899 0.121 1.00 10.00 C ATOM 296 CD1 ILE A 21 2.004 -5.015 -1.074 1.00 10.00 C ATOM 0 H ILE A 21 0.571 -7.761 0.650 1.00 10.00 H new ATOM 0 HA ILE A 21 1.395 -5.440 1.682 1.00 10.00 H new ATOM 0 HB ILE A 21 -1.117 -5.908 0.117 1.00 10.00 H new ATOM 0 HG12 ILE A 21 0.936 -6.888 -0.953 1.00 10.00 H new ATOM 0 HG13 ILE A 21 0.139 -5.677 -1.937 1.00 10.00 H new ATOM 0 HG21 ILE A 21 -0.709 -3.616 -0.854 1.00 10.00 H new ATOM 0 HG22 ILE A 21 -1.003 -3.576 0.901 1.00 10.00 H new ATOM 0 HG23 ILE A 21 0.655 -3.422 0.272 1.00 10.00 H new ATOM 0 HD11 ILE A 21 2.591 -5.330 -1.937 1.00 10.00 H new ATOM 0 HD12 ILE A 21 1.768 -3.954 -1.163 1.00 10.00 H new ATOM 0 HD13 ILE A 21 2.578 -5.184 -0.163 1.00 10.00 H new ATOM 308 N GLU A 22 -1.717 -5.973 2.777 1.00 10.00 N ATOM 309 CA GLU A 22 -2.685 -5.538 3.777 1.00 10.00 C ATOM 310 C GLU A 22 -2.032 -5.465 5.157 1.00 10.00 C ATOM 311 O GLU A 22 -2.118 -4.455 5.844 1.00 10.00 O ATOM 312 CB GLU A 22 -3.895 -6.480 3.822 1.00 10.00 C ATOM 313 CG GLU A 22 -4.668 -6.551 2.500 1.00 10.00 C ATOM 314 CD GLU A 22 -5.980 -7.313 2.679 1.00 10.00 C ATOM 315 OE1 GLU A 22 -5.940 -8.374 3.346 1.00 10.00 O ATOM 316 OE2 GLU A 22 -6.999 -6.816 2.159 1.00 10.00 O ATOM 0 H GLU A 22 -2.044 -6.736 2.184 1.00 10.00 H new ATOM 0 HA GLU A 22 -3.032 -4.544 3.494 1.00 10.00 H new ATOM 0 HB2 GLU A 22 -3.556 -7.481 4.089 1.00 10.00 H new ATOM 0 HB3 GLU A 22 -4.571 -6.152 4.611 1.00 10.00 H new ATOM 0 HG2 GLU A 22 -4.874 -5.543 2.139 1.00 10.00 H new ATOM 0 HG3 GLU A 22 -4.057 -7.042 1.742 1.00 10.00 H new ATOM 323 N LYS A 23 -1.344 -6.534 5.562 1.00 10.00 N ATOM 324 CA LYS A 23 -0.695 -6.600 6.861 1.00 10.00 C ATOM 325 C LYS A 23 0.501 -5.639 6.905 1.00 10.00 C ATOM 326 O LYS A 23 0.665 -4.884 7.863 1.00 10.00 O ATOM 327 CB LYS A 23 -0.332 -8.061 7.179 1.00 10.00 C ATOM 328 CG LYS A 23 -1.362 -8.708 8.126 1.00 10.00 C ATOM 329 CD LYS A 23 -2.790 -8.799 7.551 1.00 10.00 C ATOM 330 CE LYS A 23 -3.044 -10.052 6.698 1.00 10.00 C ATOM 331 NZ LYS A 23 -3.339 -11.243 7.525 1.00 10.00 N ATOM 0 H LYS A 23 -1.225 -7.374 4.996 1.00 10.00 H new ATOM 0 HA LYS A 23 -1.374 -6.268 7.647 1.00 10.00 H new ATOM 0 HB2 LYS A 23 -0.279 -8.633 6.253 1.00 10.00 H new ATOM 0 HB3 LYS A 23 0.657 -8.100 7.635 1.00 10.00 H new ATOM 0 HG2 LYS A 23 -1.022 -9.712 8.381 1.00 10.00 H new ATOM 0 HG3 LYS A 23 -1.393 -8.137 9.054 1.00 10.00 H new ATOM 0 HD2 LYS A 23 -3.504 -8.783 8.375 1.00 10.00 H new ATOM 0 HD3 LYS A 23 -2.983 -7.914 6.944 1.00 10.00 H new ATOM 0 HE2 LYS A 23 -3.879 -9.866 6.022 1.00 10.00 H new ATOM 0 HE3 LYS A 23 -2.170 -10.250 6.078 1.00 10.00 H new ATOM 0 HZ1 LYS A 23 -3.503 -12.063 6.907 1.00 10.00 H new ATOM 0 HZ2 LYS A 23 -2.533 -11.438 8.152 1.00 10.00 H new ATOM 0 HZ3 LYS A 23 -4.189 -11.066 8.098 1.00 10.00 H new ATOM 345 N ARG A 24 1.328 -5.658 5.859 1.00 10.00 N ATOM 346 CA ARG A 24 2.481 -4.773 5.721 1.00 10.00 C ATOM 347 C ARG A 24 2.120 -3.290 5.819 1.00 10.00 C ATOM 348 O ARG A 24 2.932 -2.507 6.301 1.00 10.00 O ATOM 349 CB ARG A 24 3.219 -5.087 4.413 1.00 10.00 C ATOM 350 CG ARG A 24 4.271 -6.168 4.672 1.00 10.00 C ATOM 351 CD ARG A 24 5.563 -5.503 5.160 1.00 10.00 C ATOM 352 NE ARG A 24 6.413 -6.434 5.912 1.00 10.00 N ATOM 353 CZ ARG A 24 7.449 -6.038 6.669 1.00 10.00 C ATOM 354 NH1 ARG A 24 7.895 -4.780 6.573 1.00 10.00 N ATOM 355 NH2 ARG A 24 8.018 -6.895 7.524 1.00 10.00 N ATOM 0 H ARG A 24 1.212 -6.298 5.074 1.00 10.00 H new ATOM 0 HA ARG A 24 3.143 -4.966 6.565 1.00 10.00 H new ATOM 0 HB2 ARG A 24 2.512 -5.426 3.656 1.00 10.00 H new ATOM 0 HB3 ARG A 24 3.695 -4.186 4.025 1.00 10.00 H new ATOM 0 HG2 ARG A 24 3.908 -6.876 5.417 1.00 10.00 H new ATOM 0 HG3 ARG A 24 4.461 -6.734 3.760 1.00 10.00 H new ATOM 0 HD2 ARG A 24 6.117 -5.117 4.304 1.00 10.00 H new ATOM 0 HD3 ARG A 24 5.315 -4.649 5.790 1.00 10.00 H new ATOM 0 HE ARG A 24 6.206 -7.431 5.857 1.00 10.00 H new ATOM 0 HH11 ARG A 24 7.448 -4.128 5.928 1.00 10.00 H new ATOM 0 HH12 ARG A 24 8.682 -4.473 7.145 1.00 10.00 H new ATOM 0 HH21 ARG A 24 7.665 -7.849 7.601 1.00 10.00 H new ATOM 0 HH22 ARG A 24 8.805 -6.595 8.099 1.00 10.00 H new ATOM 369 N LEU A 25 0.929 -2.901 5.369 1.00 10.00 N ATOM 370 CA LEU A 25 0.405 -1.557 5.549 1.00 10.00 C ATOM 371 C LEU A 25 -0.280 -1.409 6.902 1.00 10.00 C ATOM 372 O LEU A 25 -0.081 -0.413 7.577 1.00 10.00 O ATOM 373 CB LEU A 25 -0.558 -1.222 4.416 1.00 10.00 C ATOM 374 CG LEU A 25 0.201 -0.600 3.229 1.00 10.00 C ATOM 375 CD1 LEU A 25 -0.291 -1.247 1.946 1.00 10.00 C ATOM 376 CD2 LEU A 25 -0.114 0.885 3.156 1.00 10.00 C ATOM 0 H LEU A 25 0.296 -3.521 4.863 1.00 10.00 H new ATOM 0 HA LEU A 25 1.238 -0.855 5.525 1.00 10.00 H new ATOM 0 HB2 LEU A 25 -1.075 -2.125 4.092 1.00 10.00 H new ATOM 0 HB3 LEU A 25 -1.320 -0.528 4.772 1.00 10.00 H new ATOM 0 HG LEU A 25 1.272 -0.754 3.357 1.00 10.00 H new ATOM 0 HD11 LEU A 25 0.238 -0.817 1.095 1.00 10.00 H new ATOM 0 HD12 LEU A 25 -0.104 -2.320 1.985 1.00 10.00 H new ATOM 0 HD13 LEU A 25 -1.361 -1.069 1.836 1.00 10.00 H new ATOM 0 HD21 LEU A 25 0.421 1.330 2.317 1.00 10.00 H new ATOM 0 HD22 LEU A 25 -1.186 1.023 3.017 1.00 10.00 H new ATOM 0 HD23 LEU A 25 0.197 1.369 4.082 1.00 10.00 H new ATOM 388 N ASN A 26 -1.072 -2.384 7.339 1.00 10.00 N ATOM 389 CA ASN A 26 -1.759 -2.303 8.629 1.00 10.00 C ATOM 390 C ASN A 26 -0.763 -2.178 9.784 1.00 10.00 C ATOM 391 O ASN A 26 -1.131 -1.775 10.883 1.00 10.00 O ATOM 392 CB ASN A 26 -2.722 -3.476 8.849 1.00 10.00 C ATOM 393 CG ASN A 26 -4.113 -3.188 8.286 1.00 10.00 C ATOM 394 OD1 ASN A 26 -4.265 -2.747 7.152 1.00 10.00 O ATOM 395 ND2 ASN A 26 -5.152 -3.418 9.084 1.00 10.00 N ATOM 0 H ASN A 26 -1.256 -3.242 6.819 1.00 10.00 H new ATOM 0 HA ASN A 26 -2.363 -1.396 8.608 1.00 10.00 H new ATOM 0 HB2 ASN A 26 -2.318 -4.371 8.376 1.00 10.00 H new ATOM 0 HB3 ASN A 26 -2.799 -3.687 9.916 1.00 10.00 H new ATOM 0 HD21 ASN A 26 -6.099 -3.227 8.756 1.00 10.00 H new ATOM 0 HD22 ASN A 26 -5.002 -3.785 10.024 1.00 10.00 H new ATOM 402 N LYS A 27 0.498 -2.537 9.542 1.00 10.00 N ATOM 403 CA LYS A 27 1.606 -2.184 10.408 1.00 10.00 C ATOM 404 C LYS A 27 1.679 -0.690 10.744 1.00 10.00 C ATOM 405 O LYS A 27 1.988 -0.373 11.888 1.00 10.00 O ATOM 406 CB LYS A 27 2.912 -2.671 9.773 1.00 10.00 C ATOM 407 CG LYS A 27 3.263 -4.122 10.124 1.00 10.00 C ATOM 408 CD LYS A 27 3.461 -4.282 11.641 1.00 10.00 C ATOM 409 CE LYS A 27 2.271 -5.003 12.299 1.00 10.00 C ATOM 410 NZ LYS A 27 2.118 -4.614 13.718 1.00 10.00 N ATOM 0 H LYS A 27 0.774 -3.087 8.729 1.00 10.00 H new ATOM 0 HA LYS A 27 1.442 -2.682 11.364 1.00 10.00 H new ATOM 0 HB2 LYS A 27 2.837 -2.576 8.690 1.00 10.00 H new ATOM 0 HB3 LYS A 27 3.726 -2.021 10.094 1.00 10.00 H new ATOM 0 HG2 LYS A 27 2.468 -4.786 9.784 1.00 10.00 H new ATOM 0 HG3 LYS A 27 4.172 -4.418 9.600 1.00 10.00 H new ATOM 0 HD2 LYS A 27 4.376 -4.843 11.831 1.00 10.00 H new ATOM 0 HD3 LYS A 27 3.588 -3.300 12.097 1.00 10.00 H new ATOM 0 HE2 LYS A 27 1.356 -4.767 11.756 1.00 10.00 H new ATOM 0 HE3 LYS A 27 2.414 -6.081 12.230 1.00 10.00 H new ATOM 0 HZ1 LYS A 27 1.307 -5.118 14.131 1.00 10.00 H new ATOM 0 HZ2 LYS A 27 2.982 -4.861 14.241 1.00 10.00 H new ATOM 0 HZ3 LYS A 27 1.957 -3.589 13.781 1.00 10.00 H new ATOM 424 N ILE A 28 1.436 0.207 9.784 1.00 10.00 N ATOM 425 CA ILE A 28 1.400 1.643 10.038 1.00 10.00 C ATOM 426 C ILE A 28 0.404 1.922 11.161 1.00 10.00 C ATOM 427 O ILE A 28 -0.744 1.489 11.088 1.00 10.00 O ATOM 428 CB ILE A 28 0.949 2.361 8.757 1.00 10.00 C ATOM 429 CG1 ILE A 28 1.996 2.233 7.630 1.00 10.00 C ATOM 430 CG2 ILE A 28 0.539 3.816 8.996 1.00 10.00 C ATOM 431 CD1 ILE A 28 1.287 2.112 6.291 1.00 10.00 C ATOM 0 H ILE A 28 1.259 -0.045 8.812 1.00 10.00 H new ATOM 0 HA ILE A 28 2.387 2.001 10.330 1.00 10.00 H new ATOM 0 HB ILE A 28 0.047 1.848 8.424 1.00 10.00 H new ATOM 0 HG12 ILE A 28 2.653 3.103 7.629 1.00 10.00 H new ATOM 0 HG13 ILE A 28 2.625 1.359 7.801 1.00 10.00 H new ATOM 0 HG21 ILE A 28 0.231 4.267 8.053 1.00 10.00 H new ATOM 0 HG22 ILE A 28 -0.291 3.849 9.702 1.00 10.00 H new ATOM 0 HG23 ILE A 28 1.384 4.370 9.404 1.00 10.00 H new ATOM 0 HD11 ILE A 28 2.026 2.022 5.495 1.00 10.00 H new ATOM 0 HD12 ILE A 28 0.649 1.228 6.296 1.00 10.00 H new ATOM 0 HD13 ILE A 28 0.677 2.999 6.121 1.00 10.00 H new ATOM 443 N GLU A 29 0.813 2.675 12.179 1.00 10.00 N ATOM 444 CA GLU A 29 -0.073 2.999 13.280 1.00 10.00 C ATOM 445 C GLU A 29 -1.208 3.906 12.794 1.00 10.00 C ATOM 446 O GLU A 29 -2.374 3.641 13.080 1.00 10.00 O ATOM 447 CB GLU A 29 0.720 3.613 14.440 1.00 10.00 C ATOM 448 CG GLU A 29 1.662 2.598 15.119 1.00 10.00 C ATOM 449 CD GLU A 29 2.927 2.259 14.332 1.00 10.00 C ATOM 450 OE1 GLU A 29 3.181 2.941 13.312 1.00 10.00 O ATOM 451 OE2 GLU A 29 3.621 1.320 14.779 1.00 10.00 O ATOM 0 H GLU A 29 1.751 3.069 12.259 1.00 10.00 H new ATOM 0 HA GLU A 29 -0.533 2.087 13.660 1.00 10.00 H new ATOM 0 HB2 GLU A 29 1.305 4.455 14.069 1.00 10.00 H new ATOM 0 HB3 GLU A 29 0.025 4.009 15.180 1.00 10.00 H new ATOM 0 HG2 GLU A 29 1.953 2.992 16.093 1.00 10.00 H new ATOM 0 HG3 GLU A 29 1.108 1.677 15.300 1.00 10.00 H new ATOM 458 N GLY A 30 -0.904 4.952 12.016 1.00 10.00 N ATOM 459 CA GLY A 30 -1.901 5.930 11.620 1.00 10.00 C ATOM 460 C GLY A 30 -2.705 5.468 10.410 1.00 10.00 C ATOM 461 O GLY A 30 -2.935 6.247 9.489 1.00 10.00 O ATOM 0 H GLY A 30 0.031 5.135 11.652 1.00 10.00 H new ATOM 0 HA2 GLY A 30 -2.577 6.117 12.454 1.00 10.00 H new ATOM 0 HA3 GLY A 30 -1.410 6.875 11.390 1.00 10.00 H new ATOM 465 N VAL A 31 -3.126 4.206 10.396 1.00 10.00 N ATOM 466 CA VAL A 31 -3.844 3.585 9.304 1.00 10.00 C ATOM 467 C VAL A 31 -5.317 3.478 9.682 1.00 10.00 C ATOM 468 O VAL A 31 -5.652 3.395 10.862 1.00 10.00 O ATOM 469 CB VAL A 31 -3.186 2.224 9.034 1.00 10.00 C ATOM 470 CG1 VAL A 31 -3.670 1.126 9.988 1.00 10.00 C ATOM 471 CG2 VAL A 31 -3.339 1.821 7.572 1.00 10.00 C ATOM 0 H VAL A 31 -2.967 3.570 11.178 1.00 10.00 H new ATOM 0 HA VAL A 31 -3.798 4.171 8.386 1.00 10.00 H new ATOM 0 HB VAL A 31 -2.122 2.343 9.237 1.00 10.00 H new ATOM 0 HG11 VAL A 31 -3.169 0.188 9.747 1.00 10.00 H new ATOM 0 HG12 VAL A 31 -3.438 1.408 11.015 1.00 10.00 H new ATOM 0 HG13 VAL A 31 -4.747 1.000 9.881 1.00 10.00 H new ATOM 0 HG21 VAL A 31 -2.864 0.854 7.410 1.00 10.00 H new ATOM 0 HG22 VAL A 31 -4.398 1.752 7.323 1.00 10.00 H new ATOM 0 HG23 VAL A 31 -2.865 2.569 6.937 1.00 10.00 H new ATOM 481 N ALA A 32 -6.194 3.478 8.679 1.00 10.00 N ATOM 482 CA ALA A 32 -7.595 3.133 8.849 1.00 10.00 C ATOM 483 C ALA A 32 -7.897 1.898 8.015 1.00 10.00 C ATOM 484 O ALA A 32 -8.296 0.879 8.571 1.00 10.00 O ATOM 485 CB ALA A 32 -8.490 4.315 8.482 1.00 10.00 C ATOM 0 H ALA A 32 -5.945 3.720 7.720 1.00 10.00 H new ATOM 0 HA ALA A 32 -7.802 2.903 9.894 1.00 10.00 H new ATOM 0 HB1 ALA A 32 -9.535 4.036 8.616 1.00 10.00 H new ATOM 0 HB2 ALA A 32 -8.255 5.163 9.126 1.00 10.00 H new ATOM 0 HB3 ALA A 32 -8.319 4.591 7.442 1.00 10.00 H new ATOM 491 N ASN A 33 -7.698 1.970 6.694 1.00 10.00 N ATOM 492 CA ASN A 33 -7.988 0.850 5.809 1.00 10.00 C ATOM 493 C ASN A 33 -6.895 0.750 4.747 1.00 10.00 C ATOM 494 O ASN A 33 -6.184 1.720 4.491 1.00 10.00 O ATOM 495 CB ASN A 33 -9.381 1.000 5.168 1.00 10.00 C ATOM 496 CG ASN A 33 -10.508 1.201 6.178 1.00 10.00 C ATOM 497 OD1 ASN A 33 -10.844 0.290 6.927 1.00 10.00 O ATOM 498 ND2 ASN A 33 -11.121 2.380 6.203 1.00 10.00 N ATOM 0 H ASN A 33 -7.336 2.797 6.219 1.00 10.00 H new ATOM 0 HA ASN A 33 -8.000 -0.073 6.389 1.00 10.00 H new ATOM 0 HB2 ASN A 33 -9.365 1.847 4.482 1.00 10.00 H new ATOM 0 HB3 ASN A 33 -9.594 0.112 4.573 1.00 10.00 H new ATOM 0 HD21 ASN A 33 -11.889 2.542 6.855 1.00 10.00 H new ATOM 0 HD22 ASN A 33 -10.824 3.123 5.570 1.00 10.00 H new ATOM 505 N ALA A 34 -6.761 -0.417 4.116 1.00 10.00 N ATOM 506 CA ALA A 34 -5.857 -0.616 2.988 1.00 10.00 C ATOM 507 C ALA A 34 -6.408 -1.680 2.029 1.00 10.00 C ATOM 508 O ALA A 34 -5.799 -2.738 1.870 1.00 10.00 O ATOM 509 CB ALA A 34 -4.458 -0.969 3.511 1.00 10.00 C ATOM 0 H ALA A 34 -7.281 -1.255 4.377 1.00 10.00 H new ATOM 0 HA ALA A 34 -5.778 0.307 2.414 1.00 10.00 H new ATOM 0 HB1 ALA A 34 -3.782 -1.118 2.669 1.00 10.00 H new ATOM 0 HB2 ALA A 34 -4.087 -0.156 4.135 1.00 10.00 H new ATOM 0 HB3 ALA A 34 -4.510 -1.884 4.101 1.00 10.00 H new ATOM 515 N PRO A 35 -7.566 -1.435 1.394 1.00 10.00 N ATOM 516 CA PRO A 35 -8.212 -2.407 0.527 1.00 10.00 C ATOM 517 C PRO A 35 -7.508 -2.434 -0.833 1.00 10.00 C ATOM 518 O PRO A 35 -8.004 -1.878 -1.812 1.00 10.00 O ATOM 519 CB PRO A 35 -9.665 -1.929 0.434 1.00 10.00 C ATOM 520 CG PRO A 35 -9.530 -0.407 0.515 1.00 10.00 C ATOM 521 CD PRO A 35 -8.365 -0.221 1.488 1.00 10.00 C ATOM 0 HA PRO A 35 -8.165 -3.430 0.901 1.00 10.00 H new ATOM 0 HB2 PRO A 35 -10.135 -2.244 -0.498 1.00 10.00 H new ATOM 0 HB3 PRO A 35 -10.273 -2.325 1.247 1.00 10.00 H new ATOM 0 HG2 PRO A 35 -9.317 0.033 -0.459 1.00 10.00 H new ATOM 0 HG3 PRO A 35 -10.443 0.061 0.883 1.00 10.00 H new ATOM 0 HD2 PRO A 35 -7.774 0.656 1.226 1.00 10.00 H new ATOM 0 HD3 PRO A 35 -8.726 -0.070 2.505 1.00 10.00 H new ATOM 529 N VAL A 36 -6.328 -3.052 -0.900 1.00 10.00 N ATOM 530 CA VAL A 36 -5.545 -3.093 -2.122 1.00 10.00 C ATOM 531 C VAL A 36 -6.176 -3.999 -3.176 1.00 10.00 C ATOM 532 O VAL A 36 -6.921 -4.920 -2.839 1.00 10.00 O ATOM 533 CB VAL A 36 -4.119 -3.532 -1.788 1.00 10.00 C ATOM 534 CG1 VAL A 36 -3.587 -2.676 -0.634 1.00 10.00 C ATOM 535 CG2 VAL A 36 -4.016 -5.021 -1.437 1.00 10.00 C ATOM 0 H VAL A 36 -5.896 -3.533 -0.111 1.00 10.00 H new ATOM 0 HA VAL A 36 -5.522 -2.093 -2.555 1.00 10.00 H new ATOM 0 HB VAL A 36 -3.512 -3.385 -2.682 1.00 10.00 H new ATOM 0 HG11 VAL A 36 -2.570 -2.984 -0.391 1.00 10.00 H new ATOM 0 HG12 VAL A 36 -3.587 -1.627 -0.929 1.00 10.00 H new ATOM 0 HG13 VAL A 36 -4.225 -2.807 0.240 1.00 10.00 H new ATOM 0 HG21 VAL A 36 -2.980 -5.270 -1.210 1.00 10.00 H new ATOM 0 HG22 VAL A 36 -4.639 -5.234 -0.568 1.00 10.00 H new ATOM 0 HG23 VAL A 36 -4.356 -5.619 -2.283 1.00 10.00 H new ATOM 545 N ASN A 37 -5.840 -3.773 -4.450 1.00 10.00 N ATOM 546 CA ASN A 37 -6.379 -4.581 -5.534 1.00 10.00 C ATOM 547 C ASN A 37 -5.350 -5.617 -5.977 1.00 10.00 C ATOM 548 O ASN A 37 -4.168 -5.308 -6.109 1.00 10.00 O ATOM 549 CB ASN A 37 -6.778 -3.698 -6.713 1.00 10.00 C ATOM 550 CG ASN A 37 -7.890 -2.708 -6.369 1.00 10.00 C ATOM 551 OD1 ASN A 37 -8.847 -3.061 -5.690 1.00 10.00 O ATOM 552 ND2 ASN A 37 -7.802 -1.470 -6.848 1.00 10.00 N ATOM 0 H ASN A 37 -5.199 -3.038 -4.749 1.00 10.00 H new ATOM 0 HA ASN A 37 -7.268 -5.097 -5.173 1.00 10.00 H new ATOM 0 HB2 ASN A 37 -5.903 -3.147 -7.060 1.00 10.00 H new ATOM 0 HB3 ASN A 37 -7.105 -4.330 -7.539 1.00 10.00 H new ATOM 0 HD21 ASN A 37 -8.540 -0.794 -6.652 1.00 10.00 H new ATOM 0 HD22 ASN A 37 -6.997 -1.197 -7.411 1.00 10.00 H new ATOM 559 N PHE A 38 -5.808 -6.845 -6.229 1.00 10.00 N ATOM 560 CA PHE A 38 -4.973 -8.008 -6.507 1.00 10.00 C ATOM 561 C PHE A 38 -5.306 -8.594 -7.881 1.00 10.00 C ATOM 562 O PHE A 38 -5.586 -9.783 -8.019 1.00 10.00 O ATOM 563 CB PHE A 38 -5.149 -9.023 -5.373 1.00 10.00 C ATOM 564 CG PHE A 38 -6.558 -9.158 -4.818 1.00 10.00 C ATOM 565 CD1 PHE A 38 -6.966 -8.339 -3.746 1.00 10.00 C ATOM 566 CD2 PHE A 38 -7.472 -10.062 -5.391 1.00 10.00 C ATOM 567 CE1 PHE A 38 -8.279 -8.421 -3.253 1.00 10.00 C ATOM 568 CE2 PHE A 38 -8.784 -10.150 -4.889 1.00 10.00 C ATOM 569 CZ PHE A 38 -9.187 -9.330 -3.821 1.00 10.00 C ATOM 0 H PHE A 38 -6.805 -7.061 -6.245 1.00 10.00 H new ATOM 0 HA PHE A 38 -3.922 -7.720 -6.545 1.00 10.00 H new ATOM 0 HB2 PHE A 38 -4.825 -10.000 -5.732 1.00 10.00 H new ATOM 0 HB3 PHE A 38 -4.482 -8.746 -4.556 1.00 10.00 H new ATOM 0 HD1 PHE A 38 -6.267 -7.646 -3.302 1.00 10.00 H new ATOM 0 HD2 PHE A 38 -7.167 -10.688 -6.216 1.00 10.00 H new ATOM 0 HE1 PHE A 38 -8.590 -7.785 -2.437 1.00 10.00 H new ATOM 0 HE2 PHE A 38 -9.482 -10.849 -5.325 1.00 10.00 H new ATOM 0 HZ PHE A 38 -10.194 -9.399 -3.437 1.00 10.00 H new ATOM 579 N ALA A 39 -5.259 -7.733 -8.896 1.00 10.00 N ATOM 580 CA ALA A 39 -5.501 -8.055 -10.298 1.00 10.00 C ATOM 581 C ALA A 39 -5.256 -6.804 -11.140 1.00 10.00 C ATOM 582 O ALA A 39 -4.675 -6.873 -12.217 1.00 10.00 O ATOM 583 CB ALA A 39 -6.939 -8.549 -10.505 1.00 10.00 C ATOM 0 H ALA A 39 -5.041 -6.747 -8.755 1.00 10.00 H new ATOM 0 HA ALA A 39 -4.823 -8.852 -10.603 1.00 10.00 H new ATOM 0 HB1 ALA A 39 -7.095 -8.783 -11.558 1.00 10.00 H new ATOM 0 HB2 ALA A 39 -7.106 -9.444 -9.906 1.00 10.00 H new ATOM 0 HB3 ALA A 39 -7.639 -7.771 -10.198 1.00 10.00 H new ATOM 589 N LEU A 40 -5.718 -5.660 -10.627 1.00 10.00 N ATOM 590 CA LEU A 40 -5.731 -4.379 -11.319 1.00 10.00 C ATOM 591 C LEU A 40 -4.372 -3.680 -11.228 1.00 10.00 C ATOM 592 O LEU A 40 -4.125 -2.722 -11.953 1.00 10.00 O ATOM 593 CB LEU A 40 -6.816 -3.484 -10.705 1.00 10.00 C ATOM 594 CG LEU A 40 -8.137 -4.199 -10.364 1.00 10.00 C ATOM 595 CD1 LEU A 40 -9.146 -3.146 -9.913 1.00 10.00 C ATOM 596 CD2 LEU A 40 -8.700 -5.011 -11.533 1.00 10.00 C ATOM 0 H LEU A 40 -6.106 -5.604 -9.685 1.00 10.00 H new ATOM 0 HA LEU A 40 -5.945 -4.559 -12.373 1.00 10.00 H new ATOM 0 HB2 LEU A 40 -6.420 -3.032 -9.796 1.00 10.00 H new ATOM 0 HB3 LEU A 40 -7.030 -2.671 -11.399 1.00 10.00 H new ATOM 0 HG LEU A 40 -7.940 -4.918 -9.569 1.00 10.00 H new ATOM 0 HD11 LEU A 40 -10.091 -3.630 -9.666 1.00 10.00 H new ATOM 0 HD12 LEU A 40 -8.763 -2.628 -9.034 1.00 10.00 H new ATOM 0 HD13 LEU A 40 -9.306 -2.427 -10.717 1.00 10.00 H new ATOM 0 HD21 LEU A 40 -9.631 -5.490 -11.229 1.00 10.00 H new ATOM 0 HD22 LEU A 40 -8.892 -4.349 -12.377 1.00 10.00 H new ATOM 0 HD23 LEU A 40 -7.979 -5.774 -11.827 1.00 10.00 H new ATOM 608 N GLU A 41 -3.522 -4.153 -10.310 1.00 10.00 N ATOM 609 CA GLU A 41 -2.136 -3.738 -10.139 1.00 10.00 C ATOM 610 C GLU A 41 -2.071 -2.341 -9.524 1.00 10.00 C ATOM 611 O GLU A 41 -1.280 -1.493 -9.934 1.00 10.00 O ATOM 612 CB GLU A 41 -1.349 -3.882 -11.451 1.00 10.00 C ATOM 613 CG GLU A 41 -1.533 -5.281 -12.053 1.00 10.00 C ATOM 614 CD GLU A 41 -0.426 -5.626 -13.039 1.00 10.00 C ATOM 615 OE1 GLU A 41 -0.606 -5.313 -14.235 1.00 10.00 O ATOM 616 OE2 GLU A 41 0.573 -6.213 -12.571 1.00 10.00 O ATOM 0 H GLU A 41 -3.800 -4.868 -9.638 1.00 10.00 H new ATOM 0 HA GLU A 41 -1.643 -4.405 -9.432 1.00 10.00 H new ATOM 0 HB2 GLU A 41 -1.684 -3.129 -12.164 1.00 10.00 H new ATOM 0 HB3 GLU A 41 -0.291 -3.698 -11.266 1.00 10.00 H new ATOM 0 HG2 GLU A 41 -1.550 -6.021 -11.253 1.00 10.00 H new ATOM 0 HG3 GLU A 41 -2.498 -5.335 -12.557 1.00 10.00 H new ATOM 623 N THR A 42 -2.908 -2.129 -8.502 1.00 10.00 N ATOM 624 CA THR A 42 -3.025 -0.886 -7.760 1.00 10.00 C ATOM 625 C THR A 42 -3.221 -1.205 -6.281 1.00 10.00 C ATOM 626 O THR A 42 -4.106 -1.992 -5.934 1.00 10.00 O ATOM 627 CB THR A 42 -4.240 -0.103 -8.262 1.00 10.00 C ATOM 628 OG1 THR A 42 -5.373 -0.947 -8.205 1.00 10.00 O ATOM 629 CG2 THR A 42 -4.011 0.421 -9.676 1.00 10.00 C ATOM 0 H THR A 42 -3.543 -2.851 -8.163 1.00 10.00 H new ATOM 0 HA THR A 42 -2.122 -0.292 -7.900 1.00 10.00 H new ATOM 0 HB THR A 42 -4.403 0.767 -7.626 1.00 10.00 H new ATOM 0 HG1 THR A 42 -5.991 -0.714 -8.929 1.00 10.00 H new ATOM 0 HG21 THR A 42 -4.891 0.973 -10.006 1.00 10.00 H new ATOM 0 HG22 THR A 42 -3.144 1.082 -9.683 1.00 10.00 H new ATOM 0 HG23 THR A 42 -3.834 -0.417 -10.350 1.00 10.00 H new ATOM 637 N VAL A 43 -2.455 -0.549 -5.420 1.00 10.00 N ATOM 638 CA VAL A 43 -2.684 -0.531 -3.981 1.00 10.00 C ATOM 639 C VAL A 43 -3.383 0.780 -3.638 1.00 10.00 C ATOM 640 O VAL A 43 -3.059 1.818 -4.211 1.00 10.00 O ATOM 641 CB VAL A 43 -1.340 -0.690 -3.259 1.00 10.00 C ATOM 642 CG1 VAL A 43 -1.301 -0.165 -1.819 1.00 10.00 C ATOM 643 CG2 VAL A 43 -0.849 -2.140 -3.334 1.00 10.00 C ATOM 0 H VAL A 43 -1.642 -0.004 -5.707 1.00 10.00 H new ATOM 0 HA VAL A 43 -3.321 -1.355 -3.658 1.00 10.00 H new ATOM 0 HB VAL A 43 -0.653 -0.042 -3.803 1.00 10.00 H new ATOM 0 HG11 VAL A 43 -0.308 -0.325 -1.400 1.00 10.00 H new ATOM 0 HG12 VAL A 43 -1.529 0.901 -1.814 1.00 10.00 H new ATOM 0 HG13 VAL A 43 -2.038 -0.697 -1.218 1.00 10.00 H new ATOM 0 HG21 VAL A 43 0.106 -2.228 -2.815 1.00 10.00 H new ATOM 0 HG22 VAL A 43 -1.580 -2.797 -2.863 1.00 10.00 H new ATOM 0 HG23 VAL A 43 -0.723 -2.428 -4.378 1.00 10.00 H new ATOM 653 N THR A 44 -4.325 0.718 -2.698 1.00 10.00 N ATOM 654 CA THR A 44 -5.153 1.822 -2.269 1.00 10.00 C ATOM 655 C THR A 44 -5.078 1.856 -0.746 1.00 10.00 C ATOM 656 O THR A 44 -5.340 0.829 -0.117 1.00 10.00 O ATOM 657 CB THR A 44 -6.577 1.546 -2.760 1.00 10.00 C ATOM 658 OG1 THR A 44 -6.553 1.364 -4.162 1.00 10.00 O ATOM 659 CG2 THR A 44 -7.493 2.710 -2.403 1.00 10.00 C ATOM 0 H THR A 44 -4.534 -0.146 -2.198 1.00 10.00 H new ATOM 0 HA THR A 44 -4.832 2.785 -2.667 1.00 10.00 H new ATOM 0 HB THR A 44 -6.959 0.646 -2.278 1.00 10.00 H new ATOM 0 HG1 THR A 44 -7.461 1.185 -4.484 1.00 10.00 H new ATOM 0 HG21 THR A 44 -8.502 2.501 -2.758 1.00 10.00 H new ATOM 0 HG22 THR A 44 -7.509 2.842 -1.321 1.00 10.00 H new ATOM 0 HG23 THR A 44 -7.124 3.621 -2.874 1.00 10.00 H new ATOM 667 N VAL A 45 -4.682 2.990 -0.157 1.00 10.00 N ATOM 668 CA VAL A 45 -4.481 3.111 1.278 1.00 10.00 C ATOM 669 C VAL A 45 -5.273 4.283 1.834 1.00 10.00 C ATOM 670 O VAL A 45 -5.231 5.386 1.293 1.00 10.00 O ATOM 671 CB VAL A 45 -2.994 3.268 1.613 1.00 10.00 C ATOM 672 CG1 VAL A 45 -2.792 3.143 3.129 1.00 10.00 C ATOM 673 CG2 VAL A 45 -2.183 2.194 0.885 1.00 10.00 C ATOM 0 H VAL A 45 -4.493 3.850 -0.672 1.00 10.00 H new ATOM 0 HA VAL A 45 -4.842 2.194 1.745 1.00 10.00 H new ATOM 0 HB VAL A 45 -2.652 4.250 1.287 1.00 10.00 H new ATOM 0 HG11 VAL A 45 -1.734 3.255 3.366 1.00 10.00 H new ATOM 0 HG12 VAL A 45 -3.362 3.921 3.637 1.00 10.00 H new ATOM 0 HG13 VAL A 45 -3.137 2.164 3.463 1.00 10.00 H new ATOM 0 HG21 VAL A 45 -1.126 2.310 1.126 1.00 10.00 H new ATOM 0 HG22 VAL A 45 -2.521 1.207 1.200 1.00 10.00 H new ATOM 0 HG23 VAL A 45 -2.323 2.299 -0.191 1.00 10.00 H new ATOM 683 N GLU A 46 -5.945 4.026 2.952 1.00 10.00 N ATOM 684 CA GLU A 46 -6.633 4.975 3.788 1.00 10.00 C ATOM 685 C GLU A 46 -5.821 5.104 5.075 1.00 10.00 C ATOM 686 O GLU A 46 -5.990 4.307 6.003 1.00 10.00 O ATOM 687 CB GLU A 46 -8.035 4.423 4.039 1.00 10.00 C ATOM 688 CG GLU A 46 -9.029 5.064 3.077 1.00 10.00 C ATOM 689 CD GLU A 46 -10.396 4.412 3.157 1.00 10.00 C ATOM 690 OE1 GLU A 46 -10.862 4.241 4.303 1.00 10.00 O ATOM 691 OE2 GLU A 46 -10.963 4.134 2.081 1.00 10.00 O ATOM 0 H GLU A 46 -6.022 3.076 3.315 1.00 10.00 H new ATOM 0 HA GLU A 46 -6.730 5.963 3.338 1.00 10.00 H new ATOM 0 HB2 GLU A 46 -8.037 3.341 3.909 1.00 10.00 H new ATOM 0 HB3 GLU A 46 -8.334 4.621 5.068 1.00 10.00 H new ATOM 0 HG2 GLU A 46 -9.120 6.126 3.304 1.00 10.00 H new ATOM 0 HG3 GLU A 46 -8.649 4.987 2.058 1.00 10.00 H new ATOM 698 N TYR A 47 -4.931 6.100 5.120 1.00 10.00 N ATOM 699 CA TYR A 47 -4.092 6.371 6.280 1.00 10.00 C ATOM 700 C TYR A 47 -3.985 7.874 6.488 1.00 10.00 C ATOM 701 O TYR A 47 -4.303 8.653 5.595 1.00 10.00 O ATOM 702 CB TYR A 47 -2.705 5.729 6.130 1.00 10.00 C ATOM 703 CG TYR A 47 -1.708 6.522 5.303 1.00 10.00 C ATOM 704 CD1 TYR A 47 -1.861 6.653 3.909 1.00 10.00 C ATOM 705 CD2 TYR A 47 -0.721 7.273 5.968 1.00 10.00 C ATOM 706 CE1 TYR A 47 -1.053 7.558 3.196 1.00 10.00 C ATOM 707 CE2 TYR A 47 0.019 8.238 5.270 1.00 10.00 C ATOM 708 CZ TYR A 47 -0.153 8.388 3.886 1.00 10.00 C ATOM 709 OH TYR A 47 0.529 9.362 3.222 1.00 10.00 O ATOM 0 H TYR A 47 -4.775 6.743 4.344 1.00 10.00 H new ATOM 0 HA TYR A 47 -4.554 5.924 7.160 1.00 10.00 H new ATOM 0 HB2 TYR A 47 -2.285 5.574 7.124 1.00 10.00 H new ATOM 0 HB3 TYR A 47 -2.826 4.745 5.678 1.00 10.00 H new ATOM 0 HD1 TYR A 47 -2.598 6.060 3.388 1.00 10.00 H new ATOM 0 HD2 TYR A 47 -0.533 7.106 7.018 1.00 10.00 H new ATOM 0 HE1 TYR A 47 -1.124 7.615 2.120 1.00 10.00 H new ATOM 0 HE2 TYR A 47 0.721 8.866 5.798 1.00 10.00 H new ATOM 0 HH TYR A 47 1.107 9.843 3.850 1.00 10.00 H new ATOM 719 N ASN A 48 -3.550 8.275 7.678 1.00 10.00 N ATOM 720 CA ASN A 48 -3.346 9.674 8.032 1.00 10.00 C ATOM 721 C ASN A 48 -1.878 10.062 7.829 1.00 10.00 C ATOM 722 O ASN A 48 -0.991 9.349 8.301 1.00 10.00 O ATOM 723 CB ASN A 48 -3.832 9.967 9.463 1.00 10.00 C ATOM 724 CG ASN A 48 -2.945 9.433 10.592 1.00 10.00 C ATOM 725 OD1 ASN A 48 -1.810 9.860 10.769 1.00 10.00 O ATOM 726 ND2 ASN A 48 -3.469 8.540 11.425 1.00 10.00 N ATOM 0 H ASN A 48 -3.326 7.628 8.434 1.00 10.00 H new ATOM 0 HA ASN A 48 -3.949 10.293 7.367 1.00 10.00 H new ATOM 0 HB2 ASN A 48 -3.926 11.047 9.580 1.00 10.00 H new ATOM 0 HB3 ASN A 48 -4.830 9.545 9.581 1.00 10.00 H new ATOM 0 HD21 ASN A 48 -2.926 8.204 12.220 1.00 10.00 H new ATOM 0 HD22 ASN A 48 -4.415 8.191 11.269 1.00 10.00 H new ATOM 733 N PRO A 49 -1.575 11.192 7.173 1.00 10.00 N ATOM 734 CA PRO A 49 -0.218 11.709 7.112 1.00 10.00 C ATOM 735 C PRO A 49 0.128 12.426 8.424 1.00 10.00 C ATOM 736 O PRO A 49 0.502 13.597 8.408 1.00 10.00 O ATOM 737 CB PRO A 49 -0.215 12.640 5.895 1.00 10.00 C ATOM 738 CG PRO A 49 -1.635 13.203 5.897 1.00 10.00 C ATOM 739 CD PRO A 49 -2.475 12.021 6.385 1.00 10.00 C ATOM 0 HA PRO A 49 0.542 10.935 7.002 1.00 10.00 H new ATOM 0 HB2 PRO A 49 0.533 13.428 5.990 1.00 10.00 H new ATOM 0 HB3 PRO A 49 0.005 12.101 4.974 1.00 10.00 H new ATOM 0 HG2 PRO A 49 -1.727 14.064 6.560 1.00 10.00 H new ATOM 0 HG3 PRO A 49 -1.940 13.532 4.903 1.00 10.00 H new ATOM 0 HD2 PRO A 49 -3.318 12.362 6.985 1.00 10.00 H new ATOM 0 HD3 PRO A 49 -2.887 11.461 5.545 1.00 10.00 H new ATOM 747 N LYS A 50 0.010 11.728 9.562 1.00 10.00 N ATOM 748 CA LYS A 50 0.493 12.219 10.854 1.00 10.00 C ATOM 749 C LYS A 50 1.567 11.261 11.381 1.00 10.00 C ATOM 750 O LYS A 50 2.604 11.703 11.866 1.00 10.00 O ATOM 751 CB LYS A 50 -0.679 12.486 11.835 1.00 10.00 C ATOM 752 CG LYS A 50 -0.714 11.560 13.062 1.00 10.00 C ATOM 753 CD LYS A 50 -2.000 11.648 13.896 1.00 10.00 C ATOM 754 CE LYS A 50 -1.997 10.377 14.758 1.00 10.00 C ATOM 755 NZ LYS A 50 -3.064 10.292 15.767 1.00 10.00 N ATOM 0 H LYS A 50 -0.424 10.806 9.609 1.00 10.00 H new ATOM 0 HA LYS A 50 0.968 13.193 10.738 1.00 10.00 H new ATOM 0 HB2 LYS A 50 -0.620 13.519 12.178 1.00 10.00 H new ATOM 0 HB3 LYS A 50 -1.619 12.384 11.293 1.00 10.00 H new ATOM 0 HG2 LYS A 50 -0.584 10.531 12.727 1.00 10.00 H new ATOM 0 HG3 LYS A 50 0.135 11.796 13.703 1.00 10.00 H new ATOM 0 HD2 LYS A 50 -2.009 12.545 14.515 1.00 10.00 H new ATOM 0 HD3 LYS A 50 -2.883 11.691 13.258 1.00 10.00 H new ATOM 0 HE2 LYS A 50 -2.075 9.512 14.099 1.00 10.00 H new ATOM 0 HE3 LYS A 50 -1.035 10.306 15.265 1.00 10.00 H new ATOM 0 HZ1 LYS A 50 -2.974 9.400 16.293 1.00 10.00 H new ATOM 0 HZ2 LYS A 50 -2.983 11.093 16.426 1.00 10.00 H new ATOM 0 HZ3 LYS A 50 -3.991 10.324 15.296 1.00 10.00 H new ATOM 769 N GLU A 51 1.296 9.952 11.308 1.00 10.00 N ATOM 770 CA GLU A 51 2.060 8.920 11.990 1.00 10.00 C ATOM 771 C GLU A 51 3.061 8.264 11.028 1.00 10.00 C ATOM 772 O GLU A 51 4.229 8.104 11.374 1.00 10.00 O ATOM 773 CB GLU A 51 1.053 7.923 12.603 1.00 10.00 C ATOM 774 CG GLU A 51 1.244 7.664 14.112 1.00 10.00 C ATOM 775 CD GLU A 51 -0.067 7.742 14.897 1.00 10.00 C ATOM 776 OE1 GLU A 51 -1.113 7.343 14.339 1.00 10.00 O ATOM 777 OE2 GLU A 51 -0.036 8.288 16.021 1.00 10.00 O ATOM 0 H GLU A 51 0.521 9.581 10.759 1.00 10.00 H new ATOM 0 HA GLU A 51 2.665 9.338 12.794 1.00 10.00 H new ATOM 0 HB2 GLU A 51 0.043 8.298 12.437 1.00 10.00 H new ATOM 0 HB3 GLU A 51 1.132 6.974 12.072 1.00 10.00 H new ATOM 0 HG2 GLU A 51 1.689 6.679 14.254 1.00 10.00 H new ATOM 0 HG3 GLU A 51 1.948 8.393 14.515 1.00 10.00 H new ATOM 784 N ALA A 52 2.613 7.908 9.818 1.00 10.00 N ATOM 785 CA ALA A 52 3.457 7.362 8.754 1.00 10.00 C ATOM 786 C ALA A 52 3.338 8.239 7.502 1.00 10.00 C ATOM 787 O ALA A 52 2.726 9.306 7.548 1.00 10.00 O ATOM 788 CB ALA A 52 3.050 5.922 8.462 1.00 10.00 C ATOM 0 H ALA A 52 1.633 7.994 9.548 1.00 10.00 H new ATOM 0 HA ALA A 52 4.500 7.361 9.072 1.00 10.00 H new ATOM 0 HB1 ALA A 52 3.681 5.519 7.669 1.00 10.00 H new ATOM 0 HB2 ALA A 52 3.170 5.320 9.363 1.00 10.00 H new ATOM 0 HB3 ALA A 52 2.008 5.896 8.145 1.00 10.00 H new ATOM 794 N SER A 53 3.901 7.797 6.371 1.00 10.00 N ATOM 795 CA SER A 53 3.808 8.505 5.102 1.00 10.00 C ATOM 796 C SER A 53 3.838 7.517 3.935 1.00 10.00 C ATOM 797 O SER A 53 4.157 6.340 4.111 1.00 10.00 O ATOM 798 CB SER A 53 4.957 9.513 4.997 1.00 10.00 C ATOM 799 OG SER A 53 6.196 8.829 4.974 1.00 10.00 O ATOM 0 H SER A 53 4.437 6.931 6.317 1.00 10.00 H new ATOM 0 HA SER A 53 2.861 9.044 5.057 1.00 10.00 H new ATOM 0 HB2 SER A 53 4.845 10.112 4.093 1.00 10.00 H new ATOM 0 HB3 SER A 53 4.927 10.201 5.842 1.00 10.00 H new ATOM 0 HG SER A 53 6.927 9.478 4.905 1.00 10.00 H new ATOM 805 N VAL A 54 3.569 8.022 2.727 1.00 10.00 N ATOM 806 CA VAL A 54 3.702 7.268 1.489 1.00 10.00 C ATOM 807 C VAL A 54 5.065 6.567 1.407 1.00 10.00 C ATOM 808 O VAL A 54 5.150 5.409 1.005 1.00 10.00 O ATOM 809 CB VAL A 54 3.440 8.176 0.269 1.00 10.00 C ATOM 810 CG1 VAL A 54 2.030 8.779 0.333 1.00 10.00 C ATOM 811 CG2 VAL A 54 4.455 9.316 0.106 1.00 10.00 C ATOM 0 H VAL A 54 3.249 8.980 2.586 1.00 10.00 H new ATOM 0 HA VAL A 54 2.945 6.484 1.481 1.00 10.00 H new ATOM 0 HB VAL A 54 3.545 7.523 -0.597 1.00 10.00 H new ATOM 0 HG11 VAL A 54 1.867 9.416 -0.537 1.00 10.00 H new ATOM 0 HG12 VAL A 54 1.291 7.977 0.340 1.00 10.00 H new ATOM 0 HG13 VAL A 54 1.929 9.373 1.241 1.00 10.00 H new ATOM 0 HG21 VAL A 54 4.200 9.907 -0.774 1.00 10.00 H new ATOM 0 HG22 VAL A 54 4.432 9.953 0.990 1.00 10.00 H new ATOM 0 HG23 VAL A 54 5.455 8.899 -0.014 1.00 10.00 H new ATOM 821 N SER A 55 6.133 7.266 1.804 1.00 10.00 N ATOM 822 CA SER A 55 7.494 6.748 1.759 1.00 10.00 C ATOM 823 C SER A 55 7.656 5.506 2.638 1.00 10.00 C ATOM 824 O SER A 55 8.320 4.547 2.229 1.00 10.00 O ATOM 825 CB SER A 55 8.476 7.846 2.175 1.00 10.00 C ATOM 826 OG SER A 55 8.478 8.864 1.194 1.00 10.00 O ATOM 0 H SER A 55 6.071 8.217 2.169 1.00 10.00 H new ATOM 0 HA SER A 55 7.712 6.443 0.735 1.00 10.00 H new ATOM 0 HB2 SER A 55 8.191 8.258 3.143 1.00 10.00 H new ATOM 0 HB3 SER A 55 9.478 7.431 2.288 1.00 10.00 H new ATOM 0 HG SER A 55 9.104 9.570 1.457 1.00 10.00 H new ATOM 832 N ASP A 56 7.068 5.541 3.836 1.00 10.00 N ATOM 833 CA ASP A 56 7.135 4.445 4.790 1.00 10.00 C ATOM 834 C ASP A 56 6.475 3.206 4.190 1.00 10.00 C ATOM 835 O ASP A 56 7.108 2.165 4.012 1.00 10.00 O ATOM 836 CB ASP A 56 6.442 4.861 6.091 1.00 10.00 C ATOM 837 CG ASP A 56 6.378 3.687 7.053 1.00 10.00 C ATOM 838 OD1 ASP A 56 7.351 3.534 7.819 1.00 10.00 O ATOM 839 OD2 ASP A 56 5.363 2.963 6.980 1.00 10.00 O ATOM 0 H ASP A 56 6.529 6.340 4.169 1.00 10.00 H new ATOM 0 HA ASP A 56 8.175 4.206 5.013 1.00 10.00 H new ATOM 0 HB2 ASP A 56 6.983 5.688 6.551 1.00 10.00 H new ATOM 0 HB3 ASP A 56 5.435 5.219 5.876 1.00 10.00 H new ATOM 844 N LEU A 57 5.206 3.336 3.807 1.00 10.00 N ATOM 845 CA LEU A 57 4.435 2.187 3.361 1.00 10.00 C ATOM 846 C LEU A 57 5.011 1.633 2.056 1.00 10.00 C ATOM 847 O LEU A 57 5.183 0.425 1.890 1.00 10.00 O ATOM 848 CB LEU A 57 2.952 2.555 3.332 1.00 10.00 C ATOM 849 CG LEU A 57 2.518 3.574 2.274 1.00 10.00 C ATOM 850 CD1 LEU A 57 2.241 2.910 0.920 1.00 10.00 C ATOM 851 CD2 LEU A 57 1.281 4.340 2.757 1.00 10.00 C ATOM 0 H LEU A 57 4.697 4.220 3.798 1.00 10.00 H new ATOM 0 HA LEU A 57 4.514 1.356 4.062 1.00 10.00 H new ATOM 0 HB2 LEU A 57 2.377 1.641 3.181 1.00 10.00 H new ATOM 0 HB3 LEU A 57 2.679 2.945 4.313 1.00 10.00 H new ATOM 0 HG LEU A 57 3.341 4.274 2.131 1.00 10.00 H new ATOM 0 HD11 LEU A 57 1.936 3.668 0.199 1.00 10.00 H new ATOM 0 HD12 LEU A 57 3.145 2.415 0.566 1.00 10.00 H new ATOM 0 HD13 LEU A 57 1.445 2.174 1.032 1.00 10.00 H new ATOM 0 HD21 LEU A 57 0.981 5.062 1.998 1.00 10.00 H new ATOM 0 HD22 LEU A 57 0.465 3.639 2.934 1.00 10.00 H new ATOM 0 HD23 LEU A 57 1.516 4.864 3.683 1.00 10.00 H new ATOM 863 N LYS A 58 5.401 2.533 1.154 1.00 10.00 N ATOM 864 CA LYS A 58 6.276 2.211 0.036 1.00 10.00 C ATOM 865 C LYS A 58 7.459 1.336 0.447 1.00 10.00 C ATOM 866 O LYS A 58 7.756 0.371 -0.249 1.00 10.00 O ATOM 867 CB LYS A 58 6.729 3.507 -0.645 1.00 10.00 C ATOM 868 CG LYS A 58 7.652 3.295 -1.850 1.00 10.00 C ATOM 869 CD LYS A 58 9.054 3.905 -1.684 1.00 10.00 C ATOM 870 CE LYS A 58 10.041 3.081 -0.838 1.00 10.00 C ATOM 871 NZ LYS A 58 10.164 3.563 0.557 1.00 10.00 N ATOM 0 H LYS A 58 5.115 3.512 1.182 1.00 10.00 H new ATOM 0 HA LYS A 58 5.710 1.614 -0.679 1.00 10.00 H new ATOM 0 HB2 LYS A 58 5.848 4.061 -0.970 1.00 10.00 H new ATOM 0 HB3 LYS A 58 7.244 4.128 0.088 1.00 10.00 H new ATOM 0 HG2 LYS A 58 7.753 2.225 -2.033 1.00 10.00 H new ATOM 0 HG3 LYS A 58 7.182 3.727 -2.734 1.00 10.00 H new ATOM 0 HD2 LYS A 58 9.486 4.052 -2.674 1.00 10.00 H new ATOM 0 HD3 LYS A 58 8.950 4.891 -1.231 1.00 10.00 H new ATOM 0 HE2 LYS A 58 9.718 2.040 -0.828 1.00 10.00 H new ATOM 0 HE3 LYS A 58 11.023 3.106 -1.311 1.00 10.00 H new ATOM 0 HZ1 LYS A 58 10.691 2.866 1.120 1.00 10.00 H new ATOM 0 HZ2 LYS A 58 10.671 4.471 0.567 1.00 10.00 H new ATOM 0 HZ3 LYS A 58 9.216 3.691 0.965 1.00 10.00 H new ATOM 885 N GLU A 59 8.165 1.668 1.533 1.00 10.00 N ATOM 886 CA GLU A 59 9.287 0.861 1.987 1.00 10.00 C ATOM 887 C GLU A 59 8.796 -0.530 2.355 1.00 10.00 C ATOM 888 O GLU A 59 9.377 -1.521 1.930 1.00 10.00 O ATOM 889 CB GLU A 59 9.983 1.549 3.168 1.00 10.00 C ATOM 890 CG GLU A 59 11.495 1.293 3.192 1.00 10.00 C ATOM 891 CD GLU A 59 11.901 0.274 4.257 1.00 10.00 C ATOM 892 OE1 GLU A 59 11.214 -0.766 4.356 1.00 10.00 O ATOM 893 OE2 GLU A 59 12.900 0.555 4.952 1.00 10.00 O ATOM 0 H GLU A 59 7.975 2.489 2.108 1.00 10.00 H new ATOM 0 HA GLU A 59 10.020 0.760 1.186 1.00 10.00 H new ATOM 0 HB2 GLU A 59 9.801 2.622 3.117 1.00 10.00 H new ATOM 0 HB3 GLU A 59 9.543 1.195 4.100 1.00 10.00 H new ATOM 0 HG2 GLU A 59 11.815 0.937 2.213 1.00 10.00 H new ATOM 0 HG3 GLU A 59 12.016 2.233 3.376 1.00 10.00 H new ATOM 900 N ALA A 60 7.675 -0.601 3.077 1.00 10.00 N ATOM 901 CA ALA A 60 7.089 -1.881 3.451 1.00 10.00 C ATOM 902 C ALA A 60 6.911 -2.770 2.212 1.00 10.00 C ATOM 903 O ALA A 60 7.312 -3.936 2.216 1.00 10.00 O ATOM 904 CB ALA A 60 5.780 -1.677 4.221 1.00 10.00 C ATOM 0 H ALA A 60 7.159 0.213 3.411 1.00 10.00 H new ATOM 0 HA ALA A 60 7.771 -2.400 4.125 1.00 10.00 H new ATOM 0 HB1 ALA A 60 5.361 -2.647 4.490 1.00 10.00 H new ATOM 0 HB2 ALA A 60 5.976 -1.103 5.127 1.00 10.00 H new ATOM 0 HB3 ALA A 60 5.070 -1.136 3.595 1.00 10.00 H new ATOM 910 N VAL A 61 6.344 -2.214 1.139 1.00 10.00 N ATOM 911 CA VAL A 61 6.225 -2.923 -0.131 1.00 10.00 C ATOM 912 C VAL A 61 7.590 -3.213 -0.782 1.00 10.00 C ATOM 913 O VAL A 61 7.837 -4.344 -1.191 1.00 10.00 O ATOM 914 CB VAL A 61 5.235 -2.202 -1.056 1.00 10.00 C ATOM 915 CG1 VAL A 61 5.012 -3.020 -2.335 1.00 10.00 C ATOM 916 CG2 VAL A 61 3.885 -2.030 -0.345 1.00 10.00 C ATOM 0 H VAL A 61 5.959 -1.270 1.128 1.00 10.00 H new ATOM 0 HA VAL A 61 5.809 -3.911 0.069 1.00 10.00 H new ATOM 0 HB VAL A 61 5.650 -1.227 -1.310 1.00 10.00 H new ATOM 0 HG11 VAL A 61 4.308 -2.498 -2.983 1.00 10.00 H new ATOM 0 HG12 VAL A 61 5.961 -3.145 -2.857 1.00 10.00 H new ATOM 0 HG13 VAL A 61 4.609 -3.999 -2.075 1.00 10.00 H new ATOM 0 HG21 VAL A 61 3.188 -1.518 -1.008 1.00 10.00 H new ATOM 0 HG22 VAL A 61 3.484 -3.009 -0.083 1.00 10.00 H new ATOM 0 HG23 VAL A 61 4.024 -1.441 0.562 1.00 10.00 H new ATOM 926 N ASP A 62 8.511 -2.250 -0.853 1.00 10.00 N ATOM 927 CA ASP A 62 9.830 -2.509 -1.433 1.00 10.00 C ATOM 928 C ASP A 62 10.513 -3.673 -0.702 1.00 10.00 C ATOM 929 O ASP A 62 11.109 -4.558 -1.313 1.00 10.00 O ATOM 930 CB ASP A 62 10.687 -1.233 -1.430 1.00 10.00 C ATOM 931 CG ASP A 62 11.667 -1.207 -2.597 1.00 10.00 C ATOM 932 OD1 ASP A 62 12.285 -2.257 -2.880 1.00 10.00 O ATOM 933 OD2 ASP A 62 11.771 -0.137 -3.231 1.00 10.00 O ATOM 0 H ASP A 62 8.371 -1.296 -0.521 1.00 10.00 H new ATOM 0 HA ASP A 62 9.709 -2.805 -2.475 1.00 10.00 H new ATOM 0 HB2 ASP A 62 10.038 -0.359 -1.481 1.00 10.00 H new ATOM 0 HB3 ASP A 62 11.237 -1.167 -0.492 1.00 10.00 H new ATOM 938 N LYS A 63 10.338 -3.723 0.621 1.00 10.00 N ATOM 939 CA LYS A 63 10.914 -4.722 1.500 1.00 10.00 C ATOM 940 C LYS A 63 10.307 -6.089 1.198 1.00 10.00 C ATOM 941 O LYS A 63 11.000 -7.101 1.284 1.00 10.00 O ATOM 942 CB LYS A 63 10.683 -4.303 2.962 1.00 10.00 C ATOM 943 CG LYS A 63 11.493 -5.128 3.972 1.00 10.00 C ATOM 944 CD LYS A 63 12.952 -4.646 4.026 1.00 10.00 C ATOM 945 CE LYS A 63 13.865 -5.594 4.817 1.00 10.00 C ATOM 946 NZ LYS A 63 13.477 -5.704 6.237 1.00 10.00 N ATOM 0 H LYS A 63 9.769 -3.039 1.120 1.00 10.00 H new ATOM 0 HA LYS A 63 11.989 -4.796 1.334 1.00 10.00 H new ATOM 0 HB2 LYS A 63 10.942 -3.250 3.075 1.00 10.00 H new ATOM 0 HB3 LYS A 63 9.622 -4.398 3.195 1.00 10.00 H new ATOM 0 HG2 LYS A 63 11.041 -5.046 4.961 1.00 10.00 H new ATOM 0 HG3 LYS A 63 11.463 -6.182 3.695 1.00 10.00 H new ATOM 0 HD2 LYS A 63 13.334 -4.545 3.010 1.00 10.00 H new ATOM 0 HD3 LYS A 63 12.986 -3.655 4.479 1.00 10.00 H new ATOM 0 HE2 LYS A 63 13.839 -6.583 4.360 1.00 10.00 H new ATOM 0 HE3 LYS A 63 14.894 -5.240 4.752 1.00 10.00 H new ATOM 0 HZ1 LYS A 63 14.125 -6.355 6.724 1.00 10.00 H new ATOM 0 HZ2 LYS A 63 13.527 -4.766 6.684 1.00 10.00 H new ATOM 0 HZ3 LYS A 63 12.505 -6.068 6.304 1.00 10.00 H new ATOM 960 N LEU A 64 9.018 -6.132 0.846 1.00 10.00 N ATOM 961 CA LEU A 64 8.410 -7.343 0.326 1.00 10.00 C ATOM 962 C LEU A 64 9.112 -7.841 -0.943 1.00 10.00 C ATOM 963 O LEU A 64 9.124 -9.047 -1.183 1.00 10.00 O ATOM 964 CB LEU A 64 6.920 -7.106 0.067 1.00 10.00 C ATOM 965 CG LEU A 64 6.087 -7.073 1.350 1.00 10.00 C ATOM 966 CD1 LEU A 64 4.764 -6.337 1.093 1.00 10.00 C ATOM 967 CD2 LEU A 64 5.828 -8.502 1.830 1.00 10.00 C ATOM 0 H LEU A 64 8.382 -5.337 0.915 1.00 10.00 H new ATOM 0 HA LEU A 64 8.524 -8.125 1.077 1.00 10.00 H new ATOM 0 HB2 LEU A 64 6.795 -6.163 -0.465 1.00 10.00 H new ATOM 0 HB3 LEU A 64 6.541 -7.893 -0.585 1.00 10.00 H new ATOM 0 HG LEU A 64 6.633 -6.538 2.127 1.00 10.00 H new ATOM 0 HD11 LEU A 64 4.175 -6.317 2.010 1.00 10.00 H new ATOM 0 HD12 LEU A 64 4.972 -5.316 0.772 1.00 10.00 H new ATOM 0 HD13 LEU A 64 4.205 -6.855 0.314 1.00 10.00 H new ATOM 0 HD21 LEU A 64 5.235 -8.477 2.744 1.00 10.00 H new ATOM 0 HD22 LEU A 64 5.286 -9.052 1.060 1.00 10.00 H new ATOM 0 HD23 LEU A 64 6.779 -8.997 2.028 1.00 10.00 H new ATOM 979 N GLY A 65 9.687 -6.942 -1.750 1.00 10.00 N ATOM 980 CA GLY A 65 10.528 -7.297 -2.889 1.00 10.00 C ATOM 981 C GLY A 65 10.217 -6.436 -4.111 1.00 10.00 C ATOM 982 O GLY A 65 11.115 -6.048 -4.859 1.00 10.00 O ATOM 0 H GLY A 65 9.577 -5.936 -1.625 1.00 10.00 H new ATOM 0 HA2 GLY A 65 11.577 -7.178 -2.618 1.00 10.00 H new ATOM 0 HA3 GLY A 65 10.380 -8.348 -3.137 1.00 10.00 H new ATOM 986 N TYR A 66 8.927 -6.171 -4.325 1.00 10.00 N ATOM 987 CA TYR A 66 8.393 -5.500 -5.502 1.00 10.00 C ATOM 988 C TYR A 66 8.179 -4.022 -5.193 1.00 10.00 C ATOM 989 O TYR A 66 8.005 -3.660 -4.035 1.00 10.00 O ATOM 990 CB TYR A 66 7.103 -6.198 -5.948 1.00 10.00 C ATOM 991 CG TYR A 66 6.121 -6.586 -4.858 1.00 10.00 C ATOM 992 CD1 TYR A 66 6.284 -7.799 -4.159 1.00 10.00 C ATOM 993 CD2 TYR A 66 4.954 -5.830 -4.661 1.00 10.00 C ATOM 994 CE1 TYR A 66 5.318 -8.223 -3.235 1.00 10.00 C ATOM 995 CE2 TYR A 66 3.953 -6.299 -3.804 1.00 10.00 C ATOM 996 CZ TYR A 66 4.139 -7.483 -3.069 1.00 10.00 C ATOM 997 OH TYR A 66 3.136 -7.965 -2.279 1.00 10.00 O ATOM 0 H TYR A 66 8.202 -6.429 -3.656 1.00 10.00 H new ATOM 0 HA TYR A 66 9.100 -5.561 -6.329 1.00 10.00 H new ATOM 0 HB2 TYR A 66 6.588 -5.543 -6.651 1.00 10.00 H new ATOM 0 HB3 TYR A 66 7.377 -7.100 -6.495 1.00 10.00 H new ATOM 0 HD1 TYR A 66 7.159 -8.406 -4.336 1.00 10.00 H new ATOM 0 HD2 TYR A 66 4.829 -4.886 -5.171 1.00 10.00 H new ATOM 0 HE1 TYR A 66 5.482 -9.118 -2.653 1.00 10.00 H new ATOM 0 HE2 TYR A 66 3.030 -5.747 -3.706 1.00 10.00 H new ATOM 0 HH TYR A 66 3.518 -8.519 -1.567 1.00 10.00 H new ATOM 1007 N LYS A 67 8.243 -3.151 -6.203 1.00 10.00 N ATOM 1008 CA LYS A 67 8.262 -1.717 -5.973 1.00 10.00 C ATOM 1009 C LYS A 67 6.844 -1.154 -5.936 1.00 10.00 C ATOM 1010 O LYS A 67 5.919 -1.689 -6.552 1.00 10.00 O ATOM 1011 CB LYS A 67 9.117 -1.023 -7.041 1.00 10.00 C ATOM 1012 CG LYS A 67 10.566 -0.790 -6.585 1.00 10.00 C ATOM 1013 CD LYS A 67 11.269 -2.103 -6.225 1.00 10.00 C ATOM 1014 CE LYS A 67 12.763 -1.871 -5.969 1.00 10.00 C ATOM 1015 NZ LYS A 67 13.337 -2.968 -5.166 1.00 10.00 N ATOM 0 H LYS A 67 8.282 -3.421 -7.186 1.00 10.00 H new ATOM 0 HA LYS A 67 8.713 -1.522 -5.000 1.00 10.00 H new ATOM 0 HB2 LYS A 67 9.119 -1.628 -7.948 1.00 10.00 H new ATOM 0 HB3 LYS A 67 8.663 -0.066 -7.298 1.00 10.00 H new ATOM 0 HG2 LYS A 67 11.120 -0.287 -7.378 1.00 10.00 H new ATOM 0 HG3 LYS A 67 10.572 -0.126 -5.721 1.00 10.00 H new ATOM 0 HD2 LYS A 67 10.807 -2.536 -5.338 1.00 10.00 H new ATOM 0 HD3 LYS A 67 11.142 -2.822 -7.034 1.00 10.00 H new ATOM 0 HE2 LYS A 67 13.291 -1.796 -6.919 1.00 10.00 H new ATOM 0 HE3 LYS A 67 12.904 -0.923 -5.450 1.00 10.00 H new ATOM 0 HZ1 LYS A 67 14.372 -2.870 -5.134 1.00 10.00 H new ATOM 0 HZ2 LYS A 67 12.955 -2.927 -4.199 1.00 10.00 H new ATOM 0 HZ3 LYS A 67 13.089 -3.881 -5.598 1.00 10.00 H new ATOM 1029 N LEU A 68 6.721 -0.043 -5.209 1.00 10.00 N ATOM 1030 CA LEU A 68 5.511 0.732 -5.028 1.00 10.00 C ATOM 1031 C LEU A 68 5.856 2.185 -5.310 1.00 10.00 C ATOM 1032 O LEU A 68 6.961 2.618 -4.979 1.00 10.00 O ATOM 1033 CB LEU A 68 5.064 0.615 -3.564 1.00 10.00 C ATOM 1034 CG LEU A 68 3.683 1.241 -3.335 1.00 10.00 C ATOM 1035 CD1 LEU A 68 2.641 0.387 -4.044 1.00 10.00 C ATOM 1036 CD2 LEU A 68 3.326 1.410 -1.864 1.00 10.00 C ATOM 0 H LEU A 68 7.513 0.356 -4.705 1.00 10.00 H new ATOM 0 HA LEU A 68 4.719 0.378 -5.688 1.00 10.00 H new ATOM 0 HB2 LEU A 68 5.038 -0.436 -3.275 1.00 10.00 H new ATOM 0 HB3 LEU A 68 5.795 1.105 -2.921 1.00 10.00 H new ATOM 0 HG LEU A 68 3.704 2.250 -3.747 1.00 10.00 H new ATOM 0 HD11 LEU A 68 1.652 0.818 -3.891 1.00 10.00 H new ATOM 0 HD12 LEU A 68 2.862 0.355 -5.111 1.00 10.00 H new ATOM 0 HD13 LEU A 68 2.662 -0.624 -3.638 1.00 10.00 H new ATOM 0 HD21 LEU A 68 2.336 1.858 -1.779 1.00 10.00 H new ATOM 0 HD22 LEU A 68 3.326 0.436 -1.375 1.00 10.00 H new ATOM 0 HD23 LEU A 68 4.060 2.057 -1.384 1.00 10.00 H new ATOM 1048 N LYS A 69 4.904 2.956 -5.833 1.00 10.00 N ATOM 1049 CA LYS A 69 4.997 4.398 -5.865 1.00 10.00 C ATOM 1050 C LYS A 69 3.597 4.980 -5.916 1.00 10.00 C ATOM 1051 O LYS A 69 2.697 4.301 -6.394 1.00 10.00 O ATOM 1052 CB LYS A 69 5.830 4.824 -7.080 1.00 10.00 C ATOM 1053 CG LYS A 69 6.556 6.143 -6.829 1.00 10.00 C ATOM 1054 CD LYS A 69 7.422 6.008 -5.566 1.00 10.00 C ATOM 1055 CE LYS A 69 8.729 6.808 -5.653 1.00 10.00 C ATOM 1056 NZ LYS A 69 8.497 8.261 -5.783 1.00 10.00 N ATOM 0 H LYS A 69 4.047 2.588 -6.246 1.00 10.00 H new ATOM 0 HA LYS A 69 5.492 4.773 -4.969 1.00 10.00 H new ATOM 0 HB2 LYS A 69 6.557 4.047 -7.314 1.00 10.00 H new ATOM 0 HB3 LYS A 69 5.181 4.925 -7.950 1.00 10.00 H new ATOM 0 HG2 LYS A 69 7.179 6.399 -7.686 1.00 10.00 H new ATOM 0 HG3 LYS A 69 5.835 6.951 -6.706 1.00 10.00 H new ATOM 0 HD2 LYS A 69 6.851 6.347 -4.702 1.00 10.00 H new ATOM 0 HD3 LYS A 69 7.655 4.956 -5.402 1.00 10.00 H new ATOM 0 HE2 LYS A 69 9.327 6.617 -4.762 1.00 10.00 H new ATOM 0 HE3 LYS A 69 9.309 6.458 -6.507 1.00 10.00 H new ATOM 0 HZ1 LYS A 69 9.411 8.755 -5.838 1.00 10.00 H new ATOM 0 HZ2 LYS A 69 7.949 8.449 -6.647 1.00 10.00 H new ATOM 0 HZ3 LYS A 69 7.968 8.603 -4.956 1.00 10.00 H new ATOM 1070 N LEU A 70 3.405 6.203 -5.411 1.00 10.00 N ATOM 1071 CA LEU A 70 2.099 6.848 -5.451 1.00 10.00 C ATOM 1072 C LEU A 70 1.676 7.053 -6.905 1.00 10.00 C ATOM 1073 O LEU A 70 2.523 7.202 -7.786 1.00 10.00 O ATOM 1074 CB LEU A 70 2.139 8.214 -4.753 1.00 10.00 C ATOM 1075 CG LEU A 70 0.819 8.657 -4.111 1.00 10.00 C ATOM 1076 CD1 LEU A 70 0.546 7.805 -2.874 1.00 10.00 C ATOM 1077 CD2 LEU A 70 0.923 10.124 -3.679 1.00 10.00 C ATOM 0 H LEU A 70 4.138 6.760 -4.972 1.00 10.00 H new ATOM 0 HA LEU A 70 1.386 6.206 -4.933 1.00 10.00 H new ATOM 0 HB2 LEU A 70 2.909 8.188 -3.982 1.00 10.00 H new ATOM 0 HB3 LEU A 70 2.442 8.967 -5.480 1.00 10.00 H new ATOM 0 HG LEU A 70 0.013 8.539 -4.835 1.00 10.00 H new ATOM 0 HD11 LEU A 70 -0.392 8.118 -2.416 1.00 10.00 H new ATOM 0 HD12 LEU A 70 0.476 6.756 -3.163 1.00 10.00 H new ATOM 0 HD13 LEU A 70 1.359 7.931 -2.159 1.00 10.00 H new ATOM 0 HD21 LEU A 70 -0.016 10.436 -3.223 1.00 10.00 H new ATOM 0 HD22 LEU A 70 1.731 10.234 -2.956 1.00 10.00 H new ATOM 0 HD23 LEU A 70 1.128 10.746 -4.550 1.00 10.00 H new ATOM 1089 N LYS A 71 0.368 7.128 -7.116 1.00 10.00 N ATOM 1090 CA LYS A 71 -0.259 7.543 -8.348 1.00 10.00 C ATOM 1091 C LYS A 71 -0.862 8.923 -8.098 1.00 10.00 C ATOM 1092 O LYS A 71 -0.488 9.894 -8.751 1.00 10.00 O ATOM 1093 CB LYS A 71 -1.304 6.494 -8.763 1.00 10.00 C ATOM 1094 CG LYS A 71 -2.206 7.062 -9.864 1.00 10.00 C ATOM 1095 CD LYS A 71 -2.533 6.095 -11.014 1.00 10.00 C ATOM 1096 CE LYS A 71 -3.800 5.243 -10.845 1.00 10.00 C ATOM 1097 NZ LYS A 71 -3.696 4.231 -9.778 1.00 10.00 N ATOM 0 H LYS A 71 -0.310 6.888 -6.393 1.00 10.00 H new ATOM 0 HA LYS A 71 0.448 7.616 -9.174 1.00 10.00 H new ATOM 0 HB2 LYS A 71 -0.805 5.592 -9.119 1.00 10.00 H new ATOM 0 HB3 LYS A 71 -1.905 6.206 -7.901 1.00 10.00 H new ATOM 0 HG2 LYS A 71 -3.141 7.390 -9.411 1.00 10.00 H new ATOM 0 HG3 LYS A 71 -1.727 7.947 -10.282 1.00 10.00 H new ATOM 0 HD2 LYS A 71 -2.630 6.675 -11.932 1.00 10.00 H new ATOM 0 HD3 LYS A 71 -1.685 5.424 -11.149 1.00 10.00 H new ATOM 0 HE2 LYS A 71 -4.643 5.900 -10.630 1.00 10.00 H new ATOM 0 HE3 LYS A 71 -4.019 4.742 -11.788 1.00 10.00 H new ATOM 0 HZ1 LYS A 71 -4.147 3.348 -10.092 1.00 10.00 H new ATOM 0 HZ2 LYS A 71 -2.694 4.052 -9.566 1.00 10.00 H new ATOM 0 HZ3 LYS A 71 -4.174 4.579 -8.922 1.00 10.00 H new ATOM 1111 N GLY A 72 -1.797 9.007 -7.151 1.00 10.00 N ATOM 1112 CA GLY A 72 -2.452 10.260 -6.824 1.00 10.00 C ATOM 1113 C GLY A 72 -3.364 10.072 -5.621 1.00 10.00 C ATOM 1114 O GLY A 72 -2.989 10.408 -4.500 1.00 10.00 O ATOM 0 H GLY A 72 -2.115 8.212 -6.597 1.00 10.00 H new ATOM 0 HA2 GLY A 72 -1.706 11.025 -6.609 1.00 10.00 H new ATOM 0 HA3 GLY A 72 -3.031 10.611 -7.678 1.00 10.00 H new ATOM 1118 N GLU A 73 -4.548 9.511 -5.856 1.00 10.00 N ATOM 1119 CA GLU A 73 -5.623 9.426 -4.883 1.00 10.00 C ATOM 1120 C GLU A 73 -6.609 8.364 -5.357 1.00 10.00 C ATOM 1121 O GLU A 73 -6.411 7.818 -6.441 1.00 10.00 O ATOM 1122 CB GLU A 73 -6.267 10.806 -4.675 1.00 10.00 C ATOM 1123 CG GLU A 73 -6.808 11.438 -5.966 1.00 10.00 C ATOM 1124 CD GLU A 73 -7.228 12.886 -5.736 1.00 10.00 C ATOM 1125 OE1 GLU A 73 -7.804 13.146 -4.658 1.00 10.00 O ATOM 1126 OE2 GLU A 73 -6.935 13.711 -6.628 1.00 10.00 O ATOM 0 H GLU A 73 -4.788 9.093 -6.755 1.00 10.00 H new ATOM 0 HA GLU A 73 -5.247 9.125 -3.905 1.00 10.00 H new ATOM 0 HB2 GLU A 73 -7.083 10.712 -3.958 1.00 10.00 H new ATOM 0 HB3 GLU A 73 -5.531 11.478 -4.234 1.00 10.00 H new ATOM 0 HG2 GLU A 73 -6.044 11.397 -6.742 1.00 10.00 H new ATOM 0 HG3 GLU A 73 -7.660 10.862 -6.327 1.00 10.00 H new