USER MOD reduce.3.24.130724 H: found=0, std=0, add=1110, rem=0, adj=32 USER MOD reduce.3.24.130724 removed 1111 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 59 ASN :FLIP amide:sc= -2.91! C(o=-14!,f=-5.9!) USER MOD Set 1.2: A 60 ASN :FLIP amide:sc= -3.01! C(o=-7!,f=-5.9!) USER MOD Set 2.1: A 36 MET CE :methyl -167:sc= -2.94! (180deg=-2.88!) USER MOD Set 2.2: A 41 GLN : amide:sc= -1.43 K(o=-8.6,f=-12!) USER MOD Set 2.3: A 72 MET CE :methyl -146:sc= -2.23 (180deg=-2.75!) USER MOD Set 2.4: A 75 GLN : amide:sc= -1.84 K(o=-8.6,f=-17!) USER MOD Set 2.5: A 76 MET CE :methyl -130:sc= -0.135 (180deg=-1.4!) USER MOD Set 3.1: A 24 THR OG1 : rot 180:sc= 0.0382 USER MOD Set 3.2: A 62 GLN :FLIP amide:sc= -4.37! C(o=-8!,f=-4.3!) USER MOD Single : A 2 SER OG : rot -28:sc= 0.0349 USER MOD Single : A 5 THR OG1 : rot 180:sc=0.000453 USER MOD Single : A 8 GLN : amide:sc= -0.123 K(o=-0.12,f=-0.76) USER MOD Single : A 13 LYS NZ :NH3+ -171:sc=-0.00536 (180deg=-0.103) USER MOD Single : A 18 GLN : amide:sc= 0.405 K(o=0.41,f=-0.75) USER MOD Single : A 21 LYS NZ :NH3+ 154:sc= -2.09! (180deg=-3.54!) USER MOD Single : A 26 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 29 THR OG1 : rot 180:sc= -0.0299 USER MOD Single : A 34 THR OG1 : rot 180:sc= 0 USER MOD Single : A 38 THR OG1 : rot -27:sc= 0.304! USER MOD Single : A 42 ASN :FLIP amide:sc= -1.2 F(o=-4.6!,f=-1.2) USER MOD Single : A 44 THR OG1 : rot 180:sc= 0 USER MOD Single : A 49 GLN : amide:sc= -0.044 K(o=-0.044,f=-0.77) USER MOD Single : A 57 ASN :FLIP amide:sc= -1.18 F(o=-4.5!,f=-1.2) USER MOD Single : A 58 ASN : amide:sc= -0.0399 X(o=-0.04,f=-0.15) USER MOD Single : A 64 ASN : amide:sc= -4.05! C(o=-4!,f=-5.2!) USER MOD Single : A 66 THR OG1 : rot 180:sc= 0 USER MOD Single : A 69 CYS SG : rot 71:sc= 0.528 USER MOD Single : A 74 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 79 THR OG1 : rot -130:sc= -0.194 USER MOD Single : A 81 THR OG1 : rot -23:sc= 0.633 USER MOD Single : A 85 MET CE :methyl 165:sc= -3.19 (180deg=-3.85!) USER MOD Single : A 90 LYS NZ :NH3+ 135:sc= -0.085 (180deg=-0.494) USER MOD Single : A 101 SER OG : rot 180:sc= 0 USER MOD Single : A 109 MET CE :methyl -159:sc= -0.35 (180deg=-1.26) USER MOD Single : A 111 ASN : amide:sc= -0.625 X(o=-0.63,f=-1.1) USER MOD Single : A 115 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 117 THR OG1 : rot 180:sc= -0.13 USER MOD Single : A 124 MET CE :methyl -161:sc= -0.108 (180deg=-0.44) USER MOD Single : A 135 MET CE :methyl -146:sc= -0.295 (180deg=-1.84!) USER MOD Single : A 137 ASN : amide:sc= -4.37! C(o=-4.4!,f=-6.6!) USER MOD Single : A 138 TYR OH : rot -173:sc= -0.472 USER MOD Single : A 144 MET CE :methyl 155:sc= -2.39! (180deg=-3.33!) USER MOD Single : A 146 SER OG : rot -18:sc= 0.116 USER MOD Single : A 147 GLN : amide:sc= 0.562 K(o=0.56,f=-0.78) USER MOD Single : A 148 LYS NZ :NH3+ -167:sc= -0.0315 (180deg=-0.206) USER MOD ----------------------------------------------------------------- ATOM 1 N SER A 2 11.786 -15.311 -0.760 1.00 2.42 N ATOM 2 CA SER A 2 10.876 -14.737 0.264 1.00 1.65 C ATOM 3 C SER A 2 11.521 -14.774 1.647 1.00 1.35 C ATOM 4 O SER A 2 12.590 -15.358 1.825 1.00 2.12 O ATOM 5 CB SER A 2 9.554 -15.509 0.288 1.00 2.20 C ATOM 6 OG SER A 2 9.761 -16.865 0.639 1.00 2.82 O ATOM 0 HA SER A 2 10.681 -13.698 0.000 1.00 1.65 H new ATOM 0 HB2 SER A 2 8.872 -15.046 1.001 1.00 2.20 H new ATOM 0 HB3 SER A 2 9.078 -15.452 -0.691 1.00 2.20 H new ATOM 0 HG SER A 2 10.662 -17.140 0.367 1.00 2.82 H new ATOM 12 N GLU A 3 10.864 -14.143 2.619 1.00 0.87 N ATOM 13 CA GLU A 3 11.366 -14.100 3.992 1.00 0.57 C ATOM 14 C GLU A 3 12.719 -13.398 4.067 1.00 0.48 C ATOM 15 O GLU A 3 13.319 -13.067 3.044 1.00 0.55 O ATOM 16 CB GLU A 3 11.490 -15.517 4.558 1.00 0.70 C ATOM 17 CG GLU A 3 10.196 -16.313 4.503 1.00 1.23 C ATOM 18 CD GLU A 3 9.076 -15.658 5.288 1.00 1.78 C ATOM 19 OE1 GLU A 3 9.029 -15.843 6.522 1.00 2.20 O ATOM 20 OE2 GLU A 3 8.245 -14.961 4.668 1.00 2.49 O ATOM 0 H GLU A 3 9.980 -13.653 2.481 1.00 0.87 H new ATOM 0 HA GLU A 3 10.651 -13.533 4.588 1.00 0.57 H new ATOM 0 HB2 GLU A 3 12.260 -16.054 4.004 1.00 0.70 H new ATOM 0 HB3 GLU A 3 11.825 -15.457 5.593 1.00 0.70 H new ATOM 0 HG2 GLU A 3 9.888 -16.428 3.464 1.00 1.23 H new ATOM 0 HG3 GLU A 3 10.373 -17.314 4.895 1.00 1.23 H new ATOM 27 N LEU A 4 13.194 -13.179 5.288 1.00 0.44 N ATOM 28 CA LEU A 4 14.478 -12.524 5.505 1.00 0.39 C ATOM 29 C LEU A 4 15.530 -13.555 5.890 1.00 0.37 C ATOM 30 O LEU A 4 16.013 -13.577 7.023 1.00 0.45 O ATOM 31 CB LEU A 4 14.372 -11.447 6.595 1.00 0.47 C ATOM 32 CG LEU A 4 13.797 -10.091 6.153 1.00 0.43 C ATOM 33 CD1 LEU A 4 14.034 -9.043 7.227 1.00 1.12 C ATOM 34 CD2 LEU A 4 14.405 -9.644 4.831 1.00 1.25 C ATOM 0 H LEU A 4 12.708 -13.446 6.144 1.00 0.44 H new ATOM 0 HA LEU A 4 14.774 -12.038 4.575 1.00 0.39 H new ATOM 0 HB2 LEU A 4 13.751 -11.836 7.402 1.00 0.47 H new ATOM 0 HB3 LEU A 4 15.366 -11.279 7.009 1.00 0.47 H new ATOM 0 HG LEU A 4 12.723 -10.209 6.008 1.00 0.43 H new ATOM 0 HD11 LEU A 4 13.622 -8.088 6.901 1.00 1.12 H new ATOM 0 HD12 LEU A 4 13.546 -9.352 8.151 1.00 1.12 H new ATOM 0 HD13 LEU A 4 15.105 -8.936 7.401 1.00 1.12 H new ATOM 0 HD21 LEU A 4 13.981 -8.682 4.542 1.00 1.25 H new ATOM 0 HD22 LEU A 4 15.485 -9.545 4.942 1.00 1.25 H new ATOM 0 HD23 LEU A 4 14.185 -10.384 4.061 1.00 1.25 H new ATOM 46 N THR A 5 15.877 -14.412 4.937 1.00 0.35 N ATOM 47 CA THR A 5 16.870 -15.452 5.163 1.00 0.37 C ATOM 48 C THR A 5 18.275 -14.868 5.060 1.00 0.35 C ATOM 49 O THR A 5 18.430 -13.670 4.854 1.00 0.39 O ATOM 50 CB THR A 5 16.706 -16.596 4.145 1.00 0.40 C ATOM 51 OG1 THR A 5 15.320 -16.763 3.819 1.00 0.46 O ATOM 52 CG2 THR A 5 17.255 -17.907 4.691 1.00 0.47 C ATOM 0 H THR A 5 15.482 -14.406 3.996 1.00 0.35 H new ATOM 0 HA THR A 5 16.720 -15.854 6.165 1.00 0.37 H new ATOM 0 HB THR A 5 17.270 -16.331 3.251 1.00 0.40 H new ATOM 0 HG1 THR A 5 15.222 -17.491 3.170 1.00 0.46 H new ATOM 0 HG21 THR A 5 17.124 -18.694 3.948 1.00 0.47 H new ATOM 0 HG22 THR A 5 18.316 -17.792 4.915 1.00 0.47 H new ATOM 0 HG23 THR A 5 16.719 -18.175 5.602 1.00 0.47 H new ATOM 60 N GLU A 6 19.296 -15.702 5.203 1.00 0.36 N ATOM 61 CA GLU A 6 20.670 -15.224 5.117 1.00 0.37 C ATOM 62 C GLU A 6 21.016 -14.846 3.684 1.00 0.33 C ATOM 63 O GLU A 6 21.774 -13.906 3.441 1.00 0.34 O ATOM 64 CB GLU A 6 21.642 -16.284 5.636 1.00 0.45 C ATOM 65 CG GLU A 6 21.462 -16.591 7.112 1.00 0.87 C ATOM 66 CD GLU A 6 20.262 -17.477 7.385 1.00 0.98 C ATOM 67 OE1 GLU A 6 20.410 -18.715 7.319 1.00 1.20 O ATOM 68 OE2 GLU A 6 19.173 -16.932 7.661 1.00 1.17 O ATOM 0 H GLU A 6 19.202 -16.703 5.377 1.00 0.36 H new ATOM 0 HA GLU A 6 20.762 -14.335 5.741 1.00 0.37 H new ATOM 0 HB2 GLU A 6 21.509 -17.201 5.062 1.00 0.45 H new ATOM 0 HB3 GLU A 6 22.664 -15.946 5.464 1.00 0.45 H new ATOM 0 HG2 GLU A 6 22.361 -17.078 7.490 1.00 0.87 H new ATOM 0 HG3 GLU A 6 21.351 -15.657 7.662 1.00 0.87 H new ATOM 75 N GLU A 7 20.439 -15.577 2.738 1.00 0.34 N ATOM 76 CA GLU A 7 20.678 -15.325 1.326 1.00 0.35 C ATOM 77 C GLU A 7 19.885 -14.109 0.868 1.00 0.30 C ATOM 78 O GLU A 7 20.384 -13.272 0.114 1.00 0.30 O ATOM 79 CB GLU A 7 20.290 -16.553 0.500 1.00 0.44 C ATOM 80 CG GLU A 7 18.859 -17.015 0.727 1.00 0.47 C ATOM 81 CD GLU A 7 18.493 -18.218 -0.121 1.00 0.57 C ATOM 82 OE1 GLU A 7 18.096 -18.022 -1.289 1.00 0.64 O ATOM 83 OE2 GLU A 7 18.603 -19.355 0.383 1.00 0.61 O ATOM 0 H GLU A 7 19.801 -16.350 2.926 1.00 0.34 H new ATOM 0 HA GLU A 7 21.739 -15.125 1.179 1.00 0.35 H new ATOM 0 HB2 GLU A 7 20.426 -16.326 -0.557 1.00 0.44 H new ATOM 0 HB3 GLU A 7 20.969 -17.371 0.740 1.00 0.44 H new ATOM 0 HG2 GLU A 7 18.724 -17.263 1.780 1.00 0.47 H new ATOM 0 HG3 GLU A 7 18.177 -16.195 0.502 1.00 0.47 H new ATOM 90 N GLN A 8 18.646 -14.019 1.338 1.00 0.30 N ATOM 91 CA GLN A 8 17.772 -12.907 0.996 1.00 0.30 C ATOM 92 C GLN A 8 18.276 -11.619 1.633 1.00 0.25 C ATOM 93 O GLN A 8 18.441 -10.604 0.958 1.00 0.24 O ATOM 94 CB GLN A 8 16.350 -13.207 1.469 1.00 0.35 C ATOM 95 CG GLN A 8 15.751 -14.456 0.842 1.00 0.45 C ATOM 96 CD GLN A 8 15.694 -14.379 -0.671 1.00 0.72 C ATOM 97 OE1 GLN A 8 16.630 -14.783 -1.360 1.00 1.32 O ATOM 98 NE2 GLN A 8 14.591 -13.857 -1.197 1.00 1.02 N ATOM 0 H GLN A 8 18.224 -14.708 1.960 1.00 0.30 H new ATOM 0 HA GLN A 8 17.771 -12.778 -0.086 1.00 0.30 H new ATOM 0 HB2 GLN A 8 16.353 -13.320 2.553 1.00 0.35 H new ATOM 0 HB3 GLN A 8 15.712 -12.354 1.239 1.00 0.35 H new ATOM 0 HG2 GLN A 8 16.341 -15.324 1.136 1.00 0.45 H new ATOM 0 HG3 GLN A 8 14.745 -14.607 1.233 1.00 0.45 H new ATOM 0 HE21 GLN A 8 13.839 -13.534 -0.588 1.00 1.02 H new ATOM 0 HE22 GLN A 8 14.496 -13.779 -2.210 1.00 1.02 H new ATOM 107 N ILE A 9 18.525 -11.674 2.937 1.00 0.25 N ATOM 108 CA ILE A 9 19.017 -10.518 3.675 1.00 0.26 C ATOM 109 C ILE A 9 20.271 -9.949 3.023 1.00 0.25 C ATOM 110 O ILE A 9 20.387 -8.740 2.841 1.00 0.27 O ATOM 111 CB ILE A 9 19.312 -10.870 5.150 1.00 0.32 C ATOM 112 CG1 ILE A 9 18.003 -10.997 5.934 1.00 0.37 C ATOM 113 CG2 ILE A 9 20.217 -9.824 5.789 1.00 0.34 C ATOM 114 CD1 ILE A 9 18.193 -11.462 7.362 1.00 0.45 C ATOM 0 H ILE A 9 18.393 -12.510 3.506 1.00 0.25 H new ATOM 0 HA ILE A 9 18.230 -9.764 3.651 1.00 0.26 H new ATOM 0 HB ILE A 9 19.832 -11.827 5.177 1.00 0.32 H new ATOM 0 HG12 ILE A 9 17.498 -10.031 5.940 1.00 0.37 H new ATOM 0 HG13 ILE A 9 17.347 -11.697 5.417 1.00 0.37 H new ATOM 0 HG21 ILE A 9 20.410 -10.095 6.827 1.00 0.34 H new ATOM 0 HG22 ILE A 9 21.160 -9.778 5.245 1.00 0.34 H new ATOM 0 HG23 ILE A 9 19.729 -8.850 5.753 1.00 0.34 H new ATOM 0 HD11 ILE A 9 17.223 -11.529 7.855 1.00 0.45 H new ATOM 0 HD12 ILE A 9 18.670 -12.442 7.365 1.00 0.45 H new ATOM 0 HD13 ILE A 9 18.823 -10.750 7.896 1.00 0.45 H new ATOM 126 N ALA A 10 21.200 -10.827 2.666 1.00 0.26 N ATOM 127 CA ALA A 10 22.447 -10.410 2.039 1.00 0.28 C ATOM 128 C ALA A 10 22.231 -9.982 0.590 1.00 0.24 C ATOM 129 O ALA A 10 23.048 -9.256 0.021 1.00 0.25 O ATOM 130 CB ALA A 10 23.466 -11.537 2.111 1.00 0.36 C ATOM 0 H ALA A 10 21.113 -11.834 2.801 1.00 0.26 H new ATOM 0 HA ALA A 10 22.826 -9.546 2.585 1.00 0.28 H new ATOM 0 HB1 ALA A 10 24.396 -11.218 1.640 1.00 0.36 H new ATOM 0 HB2 ALA A 10 23.656 -11.790 3.154 1.00 0.36 H new ATOM 0 HB3 ALA A 10 23.078 -12.412 1.590 1.00 0.36 H new ATOM 136 N GLU A 11 21.127 -10.427 -0.003 1.00 0.24 N ATOM 137 CA GLU A 11 20.822 -10.100 -1.393 1.00 0.25 C ATOM 138 C GLU A 11 20.497 -8.614 -1.573 1.00 0.22 C ATOM 139 O GLU A 11 21.154 -7.918 -2.353 1.00 0.22 O ATOM 140 CB GLU A 11 19.655 -10.959 -1.890 1.00 0.31 C ATOM 141 CG GLU A 11 19.218 -10.633 -3.309 1.00 0.40 C ATOM 142 CD GLU A 11 18.059 -11.493 -3.773 1.00 1.06 C ATOM 143 OE1 GLU A 11 16.904 -11.171 -3.425 1.00 1.93 O ATOM 144 OE2 GLU A 11 18.308 -12.490 -4.483 1.00 1.02 O ATOM 0 H GLU A 11 20.430 -11.014 0.456 1.00 0.24 H new ATOM 0 HA GLU A 11 21.711 -10.316 -1.986 1.00 0.25 H new ATOM 0 HB2 GLU A 11 19.941 -12.010 -1.840 1.00 0.31 H new ATOM 0 HB3 GLU A 11 18.807 -10.827 -1.219 1.00 0.31 H new ATOM 0 HG2 GLU A 11 18.932 -9.583 -3.365 1.00 0.40 H new ATOM 0 HG3 GLU A 11 20.061 -10.770 -3.986 1.00 0.40 H new ATOM 151 N PHE A 12 19.499 -8.120 -0.843 1.00 0.21 N ATOM 152 CA PHE A 12 19.117 -6.716 -0.959 1.00 0.23 C ATOM 153 C PHE A 12 20.060 -5.832 -0.154 1.00 0.20 C ATOM 154 O PHE A 12 20.195 -4.645 -0.437 1.00 0.22 O ATOM 155 CB PHE A 12 17.668 -6.494 -0.523 1.00 0.29 C ATOM 156 CG PHE A 12 17.373 -6.952 0.872 1.00 0.27 C ATOM 157 CD1 PHE A 12 17.702 -6.155 1.953 1.00 0.32 C ATOM 158 CD2 PHE A 12 16.768 -8.177 1.101 1.00 0.27 C ATOM 159 CE1 PHE A 12 17.433 -6.570 3.239 1.00 0.36 C ATOM 160 CE2 PHE A 12 16.496 -8.596 2.386 1.00 0.28 C ATOM 161 CZ PHE A 12 16.823 -7.808 3.448 1.00 0.33 C ATOM 0 H PHE A 12 18.949 -8.661 -0.176 1.00 0.21 H new ATOM 0 HA PHE A 12 19.195 -6.438 -2.010 1.00 0.23 H new ATOM 0 HB2 PHE A 12 17.434 -5.432 -0.603 1.00 0.29 H new ATOM 0 HB3 PHE A 12 17.008 -7.018 -1.214 1.00 0.29 H new ATOM 0 HD1 PHE A 12 18.174 -5.198 1.788 1.00 0.32 H new ATOM 0 HD2 PHE A 12 16.507 -8.809 0.265 1.00 0.27 H new ATOM 0 HE1 PHE A 12 17.692 -5.942 4.079 1.00 0.36 H new ATOM 0 HE2 PHE A 12 16.022 -9.552 2.551 1.00 0.28 H new ATOM 0 HZ PHE A 12 16.610 -8.142 4.453 1.00 0.33 H new ATOM 171 N LYS A 13 20.705 -6.412 0.857 1.00 0.18 N ATOM 172 CA LYS A 13 21.655 -5.661 1.667 1.00 0.21 C ATOM 173 C LYS A 13 22.828 -5.245 0.793 1.00 0.19 C ATOM 174 O LYS A 13 23.402 -4.169 0.964 1.00 0.24 O ATOM 175 CB LYS A 13 22.136 -6.493 2.860 1.00 0.26 C ATOM 176 CG LYS A 13 23.398 -5.953 3.521 1.00 0.31 C ATOM 177 CD LYS A 13 23.171 -4.577 4.127 1.00 0.40 C ATOM 178 CE LYS A 13 24.463 -3.988 4.669 1.00 0.68 C ATOM 179 NZ LYS A 13 25.039 -4.821 5.759 1.00 1.53 N ATOM 0 H LYS A 13 20.588 -7.388 1.130 1.00 0.18 H new ATOM 0 HA LYS A 13 21.165 -4.773 2.065 1.00 0.21 H new ATOM 0 HB2 LYS A 13 21.340 -6.539 3.603 1.00 0.26 H new ATOM 0 HB3 LYS A 13 22.321 -7.514 2.527 1.00 0.26 H new ATOM 0 HG2 LYS A 13 23.726 -6.643 4.298 1.00 0.31 H new ATOM 0 HG3 LYS A 13 24.200 -5.899 2.785 1.00 0.31 H new ATOM 0 HD2 LYS A 13 22.754 -3.910 3.372 1.00 0.40 H new ATOM 0 HD3 LYS A 13 22.437 -4.648 4.930 1.00 0.40 H new ATOM 0 HE2 LYS A 13 25.188 -3.897 3.860 1.00 0.68 H new ATOM 0 HE3 LYS A 13 24.274 -2.982 5.042 1.00 0.68 H new ATOM 0 HZ1 LYS A 13 25.830 -4.312 6.204 1.00 1.53 H new ATOM 0 HZ2 LYS A 13 24.307 -5.014 6.472 1.00 1.53 H new ATOM 0 HZ3 LYS A 13 25.383 -5.719 5.364 1.00 1.53 H new ATOM 193 N ASP A 14 23.179 -6.118 -0.148 1.00 0.16 N ATOM 194 CA ASP A 14 24.256 -5.839 -1.082 1.00 0.19 C ATOM 195 C ASP A 14 23.802 -4.756 -2.053 1.00 0.18 C ATOM 196 O ASP A 14 24.513 -3.779 -2.300 1.00 0.20 O ATOM 197 CB ASP A 14 24.646 -7.110 -1.840 1.00 0.23 C ATOM 198 CG ASP A 14 25.840 -6.902 -2.749 1.00 0.30 C ATOM 199 OD1 ASP A 14 26.976 -6.840 -2.232 1.00 0.38 O ATOM 200 OD2 ASP A 14 25.641 -6.800 -3.977 1.00 0.39 O ATOM 0 H ASP A 14 22.730 -7.024 -0.280 1.00 0.16 H new ATOM 0 HA ASP A 14 25.132 -5.491 -0.535 1.00 0.19 H new ATOM 0 HB2 ASP A 14 24.872 -7.901 -1.124 1.00 0.23 H new ATOM 0 HB3 ASP A 14 23.797 -7.450 -2.433 1.00 0.23 H new ATOM 205 N ALA A 15 22.599 -4.933 -2.595 1.00 0.17 N ATOM 206 CA ALA A 15 22.026 -3.962 -3.517 1.00 0.19 C ATOM 207 C ALA A 15 21.772 -2.637 -2.801 1.00 0.20 C ATOM 208 O ALA A 15 21.543 -1.607 -3.434 1.00 0.24 O ATOM 209 CB ALA A 15 20.731 -4.499 -4.114 1.00 0.22 C ATOM 0 H ALA A 15 22.004 -5.741 -2.410 1.00 0.17 H new ATOM 0 HA ALA A 15 22.736 -3.789 -4.326 1.00 0.19 H new ATOM 0 HB1 ALA A 15 20.314 -3.763 -4.801 1.00 0.22 H new ATOM 0 HB2 ALA A 15 20.935 -5.424 -4.654 1.00 0.22 H new ATOM 0 HB3 ALA A 15 20.016 -4.695 -3.315 1.00 0.22 H new ATOM 215 N PHE A 16 21.818 -2.681 -1.471 1.00 0.21 N ATOM 216 CA PHE A 16 21.584 -1.502 -0.642 1.00 0.25 C ATOM 217 C PHE A 16 22.831 -0.630 -0.560 1.00 0.23 C ATOM 218 O PHE A 16 22.767 0.581 -0.773 1.00 0.24 O ATOM 219 CB PHE A 16 21.145 -1.934 0.762 1.00 0.31 C ATOM 220 CG PHE A 16 21.077 -0.810 1.758 1.00 0.35 C ATOM 221 CD1 PHE A 16 19.977 0.031 1.797 1.00 0.43 C ATOM 222 CD2 PHE A 16 22.115 -0.592 2.650 1.00 0.41 C ATOM 223 CE1 PHE A 16 19.912 1.070 2.706 1.00 0.52 C ATOM 224 CE2 PHE A 16 22.056 0.445 3.561 1.00 0.50 C ATOM 225 CZ PHE A 16 20.952 1.259 3.610 1.00 0.54 C ATOM 0 H PHE A 16 22.017 -3.529 -0.941 1.00 0.21 H new ATOM 0 HA PHE A 16 20.792 -0.911 -1.102 1.00 0.25 H new ATOM 0 HB2 PHE A 16 20.165 -2.405 0.695 1.00 0.31 H new ATOM 0 HB3 PHE A 16 21.838 -2.690 1.131 1.00 0.31 H new ATOM 0 HD1 PHE A 16 19.160 -0.127 1.109 1.00 0.43 H new ATOM 0 HD2 PHE A 16 22.979 -1.240 2.633 1.00 0.41 H new ATOM 0 HE1 PHE A 16 19.058 1.732 2.714 1.00 0.52 H new ATOM 0 HE2 PHE A 16 22.881 0.616 4.237 1.00 0.50 H new ATOM 0 HZ PHE A 16 20.891 2.044 4.349 1.00 0.54 H new ATOM 235 N VAL A 17 23.965 -1.251 -0.252 1.00 0.23 N ATOM 236 CA VAL A 17 25.222 -0.525 -0.142 1.00 0.24 C ATOM 237 C VAL A 17 25.639 0.025 -1.498 1.00 0.23 C ATOM 238 O VAL A 17 26.379 1.007 -1.584 1.00 0.28 O ATOM 239 CB VAL A 17 26.347 -1.415 0.418 1.00 0.28 C ATOM 240 CG1 VAL A 17 26.072 -1.770 1.871 1.00 0.90 C ATOM 241 CG2 VAL A 17 26.509 -2.672 -0.421 1.00 0.76 C ATOM 0 H VAL A 17 24.038 -2.253 -0.075 1.00 0.23 H new ATOM 0 HA VAL A 17 25.059 0.299 0.553 1.00 0.24 H new ATOM 0 HB VAL A 17 27.281 -0.855 0.372 1.00 0.28 H new ATOM 0 HG11 VAL A 17 26.877 -2.399 2.250 1.00 0.90 H new ATOM 0 HG12 VAL A 17 26.015 -0.857 2.464 1.00 0.90 H new ATOM 0 HG13 VAL A 17 25.127 -2.308 1.941 1.00 0.90 H new ATOM 0 HG21 VAL A 17 27.309 -3.285 -0.007 1.00 0.76 H new ATOM 0 HG22 VAL A 17 25.577 -3.237 -0.413 1.00 0.76 H new ATOM 0 HG23 VAL A 17 26.757 -2.396 -1.446 1.00 0.76 H new ATOM 251 N GLN A 18 25.159 -0.617 -2.558 1.00 0.20 N ATOM 252 CA GLN A 18 25.462 -0.191 -3.916 1.00 0.21 C ATOM 253 C GLN A 18 24.903 1.204 -4.189 1.00 0.21 C ATOM 254 O GLN A 18 25.460 1.961 -4.983 1.00 0.26 O ATOM 255 CB GLN A 18 24.880 -1.188 -4.917 1.00 0.24 C ATOM 256 CG GLN A 18 25.641 -2.501 -4.988 1.00 0.29 C ATOM 257 CD GLN A 18 25.037 -3.472 -5.984 1.00 1.04 C ATOM 258 OE1 GLN A 18 24.430 -3.065 -6.975 1.00 1.86 O ATOM 259 NE2 GLN A 18 25.203 -4.762 -5.724 1.00 1.60 N ATOM 0 H GLN A 18 24.556 -1.438 -2.500 1.00 0.20 H new ATOM 0 HA GLN A 18 26.546 -0.155 -4.029 1.00 0.21 H new ATOM 0 HB2 GLN A 18 23.843 -1.394 -4.650 1.00 0.24 H new ATOM 0 HB3 GLN A 18 24.870 -0.731 -5.906 1.00 0.24 H new ATOM 0 HG2 GLN A 18 26.677 -2.302 -5.263 1.00 0.29 H new ATOM 0 HG3 GLN A 18 25.656 -2.962 -4.000 1.00 0.29 H new ATOM 0 HE21 GLN A 18 25.713 -5.053 -4.890 1.00 1.60 H new ATOM 0 HE22 GLN A 18 24.820 -5.463 -6.358 1.00 1.60 H new ATOM 268 N PHE A 19 23.797 1.533 -3.525 1.00 0.22 N ATOM 269 CA PHE A 19 23.151 2.817 -3.691 1.00 0.25 C ATOM 270 C PHE A 19 23.681 3.843 -2.692 1.00 0.23 C ATOM 271 O PHE A 19 23.471 5.045 -2.858 1.00 0.32 O ATOM 272 CB PHE A 19 21.654 2.627 -3.509 1.00 0.29 C ATOM 273 CG PHE A 19 20.936 2.279 -4.779 1.00 0.30 C ATOM 274 CD1 PHE A 19 20.963 0.986 -5.276 1.00 0.44 C ATOM 275 CD2 PHE A 19 20.229 3.246 -5.476 1.00 0.64 C ATOM 276 CE1 PHE A 19 20.298 0.664 -6.445 1.00 0.46 C ATOM 277 CE2 PHE A 19 19.563 2.931 -6.644 1.00 0.69 C ATOM 278 CZ PHE A 19 19.613 1.628 -7.135 1.00 0.42 C ATOM 0 H PHE A 19 23.331 0.914 -2.861 1.00 0.22 H new ATOM 0 HA PHE A 19 23.366 3.199 -4.689 1.00 0.25 H new ATOM 0 HB2 PHE A 19 21.482 1.839 -2.776 1.00 0.29 H new ATOM 0 HB3 PHE A 19 21.227 3.542 -3.099 1.00 0.29 H new ATOM 0 HD1 PHE A 19 21.510 0.221 -4.745 1.00 0.44 H new ATOM 0 HD2 PHE A 19 20.199 4.258 -5.101 1.00 0.64 H new ATOM 0 HE1 PHE A 19 20.319 -0.351 -6.815 1.00 0.46 H new ATOM 0 HE2 PHE A 19 19.007 3.690 -7.174 1.00 0.69 H new ATOM 0 HZ PHE A 19 19.112 1.379 -8.059 1.00 0.42 H new ATOM 288 N ASP A 20 24.363 3.365 -1.657 1.00 0.25 N ATOM 289 CA ASP A 20 24.924 4.245 -0.637 1.00 0.24 C ATOM 290 C ASP A 20 25.848 5.285 -1.264 1.00 0.24 C ATOM 291 O ASP A 20 26.998 4.989 -1.592 1.00 0.29 O ATOM 292 CB ASP A 20 25.682 3.424 0.407 1.00 0.28 C ATOM 293 CG ASP A 20 26.463 4.291 1.374 1.00 0.32 C ATOM 294 OD1 ASP A 20 25.866 4.757 2.367 1.00 0.37 O ATOM 295 OD2 ASP A 20 27.670 4.507 1.137 1.00 0.37 O ATOM 0 H ASP A 20 24.541 2.373 -1.502 1.00 0.25 H new ATOM 0 HA ASP A 20 24.103 4.770 -0.148 1.00 0.24 H new ATOM 0 HB2 ASP A 20 24.975 2.810 0.965 1.00 0.28 H new ATOM 0 HB3 ASP A 20 26.366 2.743 -0.099 1.00 0.28 H new ATOM 300 N LYS A 21 25.338 6.504 -1.428 1.00 0.24 N ATOM 301 CA LYS A 21 26.117 7.585 -2.023 1.00 0.30 C ATOM 302 C LYS A 21 26.718 8.498 -0.957 1.00 0.29 C ATOM 303 O LYS A 21 27.922 8.759 -0.961 1.00 0.33 O ATOM 304 CB LYS A 21 25.242 8.405 -2.974 1.00 0.36 C ATOM 305 CG LYS A 21 24.917 7.685 -4.273 1.00 0.90 C ATOM 306 CD LYS A 21 26.141 7.555 -5.170 1.00 1.04 C ATOM 307 CE LYS A 21 26.399 8.828 -5.963 1.00 1.70 C ATOM 308 NZ LYS A 21 26.781 9.968 -5.086 1.00 2.47 N ATOM 0 H LYS A 21 24.390 6.766 -1.157 1.00 0.24 H new ATOM 0 HA LYS A 21 26.937 7.133 -2.581 1.00 0.30 H new ATOM 0 HB2 LYS A 21 24.311 8.662 -2.468 1.00 0.36 H new ATOM 0 HB3 LYS A 21 25.749 9.342 -3.204 1.00 0.36 H new ATOM 0 HG2 LYS A 21 24.523 6.693 -4.050 1.00 0.90 H new ATOM 0 HG3 LYS A 21 24.134 8.227 -4.803 1.00 0.90 H new ATOM 0 HD2 LYS A 21 27.015 7.323 -4.561 1.00 1.04 H new ATOM 0 HD3 LYS A 21 26.001 6.721 -5.857 1.00 1.04 H new ATOM 0 HE2 LYS A 21 27.192 8.648 -6.688 1.00 1.70 H new ATOM 0 HE3 LYS A 21 25.504 9.090 -6.528 1.00 1.70 H new ATOM 0 HZ1 LYS A 21 27.353 10.646 -5.628 1.00 2.47 H new ATOM 0 HZ2 LYS A 21 25.923 10.440 -4.737 1.00 2.47 H new ATOM 0 HZ3 LYS A 21 27.334 9.615 -4.279 1.00 2.47 H new ATOM 322 N GLU A 22 25.876 8.980 -0.048 1.00 0.27 N ATOM 323 CA GLU A 22 26.325 9.871 1.017 1.00 0.29 C ATOM 324 C GLU A 22 27.419 9.226 1.862 1.00 0.31 C ATOM 325 O GLU A 22 28.235 9.920 2.470 1.00 0.41 O ATOM 326 CB GLU A 22 25.147 10.268 1.909 1.00 0.31 C ATOM 327 CG GLU A 22 24.075 11.064 1.184 1.00 0.35 C ATOM 328 CD GLU A 22 24.581 12.402 0.679 1.00 0.51 C ATOM 329 OE1 GLU A 22 25.131 12.443 -0.442 1.00 0.44 O ATOM 330 OE2 GLU A 22 24.426 13.407 1.404 1.00 0.93 O ATOM 0 H GLU A 22 24.878 8.768 -0.027 1.00 0.27 H new ATOM 0 HA GLU A 22 26.740 10.763 0.548 1.00 0.29 H new ATOM 0 HB2 GLU A 22 24.698 9.367 2.326 1.00 0.31 H new ATOM 0 HB3 GLU A 22 25.519 10.856 2.748 1.00 0.31 H new ATOM 0 HG2 GLU A 22 23.701 10.480 0.343 1.00 0.35 H new ATOM 0 HG3 GLU A 22 23.233 11.229 1.857 1.00 0.35 H new ATOM 337 N GLY A 23 27.434 7.897 1.896 1.00 0.31 N ATOM 338 CA GLY A 23 28.434 7.188 2.672 1.00 0.34 C ATOM 339 C GLY A 23 28.114 7.181 4.154 1.00 0.34 C ATOM 340 O GLY A 23 28.881 6.656 4.960 1.00 0.39 O ATOM 0 H GLY A 23 26.772 7.300 1.401 1.00 0.31 H new ATOM 0 HA2 GLY A 23 28.508 6.161 2.314 1.00 0.34 H new ATOM 0 HA3 GLY A 23 29.408 7.651 2.515 1.00 0.34 H new ATOM 344 N THR A 24 26.976 7.768 4.511 1.00 0.34 N ATOM 345 CA THR A 24 26.547 7.835 5.903 1.00 0.38 C ATOM 346 C THR A 24 25.791 6.574 6.307 1.00 0.36 C ATOM 347 O THR A 24 24.921 6.612 7.177 1.00 0.40 O ATOM 348 CB THR A 24 25.642 9.057 6.148 1.00 0.41 C ATOM 349 OG1 THR A 24 24.440 8.937 5.378 1.00 1.23 O ATOM 350 CG2 THR A 24 26.359 10.346 5.777 1.00 1.39 C ATOM 0 H THR A 24 26.332 8.206 3.852 1.00 0.34 H new ATOM 0 HA THR A 24 27.448 7.926 6.509 1.00 0.38 H new ATOM 0 HB THR A 24 25.394 9.090 7.209 1.00 0.41 H new ATOM 0 HG1 THR A 24 23.869 9.717 5.540 1.00 1.23 H new ATOM 0 HG21 THR A 24 25.699 11.195 5.959 1.00 1.39 H new ATOM 0 HG22 THR A 24 27.259 10.449 6.383 1.00 1.39 H new ATOM 0 HG23 THR A 24 26.633 10.319 4.722 1.00 1.39 H new ATOM 358 N GLY A 25 26.130 5.455 5.672 1.00 0.34 N ATOM 359 CA GLY A 25 25.465 4.201 5.975 1.00 0.37 C ATOM 360 C GLY A 25 24.000 4.228 5.592 1.00 0.31 C ATOM 361 O GLY A 25 23.234 3.338 5.964 1.00 0.36 O ATOM 0 H GLY A 25 26.852 5.395 4.954 1.00 0.34 H new ATOM 0 HA2 GLY A 25 25.963 3.389 5.445 1.00 0.37 H new ATOM 0 HA3 GLY A 25 25.557 3.990 7.040 1.00 0.37 H new ATOM 365 N LYS A 26 23.612 5.256 4.845 1.00 0.27 N ATOM 366 CA LYS A 26 22.234 5.414 4.404 1.00 0.23 C ATOM 367 C LYS A 26 22.176 5.738 2.915 1.00 0.21 C ATOM 368 O LYS A 26 23.140 6.254 2.348 1.00 0.24 O ATOM 369 CB LYS A 26 21.536 6.503 5.222 1.00 0.25 C ATOM 370 CG LYS A 26 21.307 6.105 6.673 1.00 0.29 C ATOM 371 CD LYS A 26 20.722 7.244 7.495 1.00 0.51 C ATOM 372 CE LYS A 26 19.318 7.601 7.039 1.00 0.89 C ATOM 373 NZ LYS A 26 18.750 8.733 7.820 1.00 1.58 N ATOM 0 H LYS A 26 24.239 5.997 4.531 1.00 0.27 H new ATOM 0 HA LYS A 26 21.711 4.471 4.565 1.00 0.23 H new ATOM 0 HB2 LYS A 26 22.136 7.413 5.191 1.00 0.25 H new ATOM 0 HB3 LYS A 26 20.577 6.738 4.760 1.00 0.25 H new ATOM 0 HG2 LYS A 26 20.634 5.248 6.711 1.00 0.29 H new ATOM 0 HG3 LYS A 26 22.252 5.788 7.115 1.00 0.29 H new ATOM 0 HD2 LYS A 26 20.702 6.961 8.547 1.00 0.51 H new ATOM 0 HD3 LYS A 26 21.365 8.120 7.413 1.00 0.51 H new ATOM 0 HE2 LYS A 26 19.336 7.863 5.981 1.00 0.89 H new ATOM 0 HE3 LYS A 26 18.671 6.730 7.141 1.00 0.89 H new ATOM 0 HZ1 LYS A 26 17.791 8.945 7.477 1.00 1.58 H new ATOM 0 HZ2 LYS A 26 18.709 8.474 8.826 1.00 1.58 H new ATOM 0 HZ3 LYS A 26 19.353 9.572 7.703 1.00 1.58 H new ATOM 387 N ILE A 27 21.046 5.430 2.283 1.00 0.19 N ATOM 388 CA ILE A 27 20.885 5.675 0.853 1.00 0.20 C ATOM 389 C ILE A 27 19.811 6.717 0.575 1.00 0.19 C ATOM 390 O ILE A 27 18.903 6.920 1.380 1.00 0.23 O ATOM 391 CB ILE A 27 20.533 4.383 0.096 1.00 0.23 C ATOM 392 CG1 ILE A 27 19.148 3.885 0.505 1.00 0.26 C ATOM 393 CG2 ILE A 27 21.584 3.315 0.357 1.00 0.25 C ATOM 394 CD1 ILE A 27 18.217 3.680 -0.668 1.00 0.54 C ATOM 0 H ILE A 27 20.233 5.013 2.736 1.00 0.19 H new ATOM 0 HA ILE A 27 21.844 6.051 0.498 1.00 0.20 H new ATOM 0 HB ILE A 27 20.518 4.599 -0.972 1.00 0.23 H new ATOM 0 HG12 ILE A 27 19.253 2.944 1.046 1.00 0.26 H new ATOM 0 HG13 ILE A 27 18.701 4.601 1.194 1.00 0.26 H new ATOM 0 HG21 ILE A 27 21.322 2.406 -0.185 1.00 0.25 H new ATOM 0 HG22 ILE A 27 22.557 3.672 0.019 1.00 0.25 H new ATOM 0 HG23 ILE A 27 21.628 3.101 1.425 1.00 0.25 H new ATOM 0 HD11 ILE A 27 17.251 3.326 -0.308 1.00 0.54 H new ATOM 0 HD12 ILE A 27 18.084 4.624 -1.196 1.00 0.54 H new ATOM 0 HD13 ILE A 27 18.644 2.942 -1.347 1.00 0.54 H new ATOM 406 N ALA A 28 19.929 7.371 -0.579 1.00 0.23 N ATOM 407 CA ALA A 28 18.990 8.412 -0.981 1.00 0.25 C ATOM 408 C ALA A 28 17.589 7.853 -1.236 1.00 0.25 C ATOM 409 O ALA A 28 17.431 6.799 -1.852 1.00 0.28 O ATOM 410 CB ALA A 28 19.504 9.118 -2.226 1.00 0.31 C ATOM 0 H ALA A 28 20.672 7.195 -1.255 1.00 0.23 H new ATOM 0 HA ALA A 28 18.914 9.124 -0.159 1.00 0.25 H new ATOM 0 HB1 ALA A 28 18.798 9.894 -2.521 1.00 0.31 H new ATOM 0 HB2 ALA A 28 20.473 9.570 -2.014 1.00 0.31 H new ATOM 0 HB3 ALA A 28 19.610 8.396 -3.036 1.00 0.31 H new ATOM 416 N THR A 29 16.576 8.576 -0.755 1.00 0.28 N ATOM 417 CA THR A 29 15.179 8.180 -0.936 1.00 0.31 C ATOM 418 C THR A 29 14.768 8.283 -2.398 1.00 0.32 C ATOM 419 O THR A 29 14.063 7.419 -2.921 1.00 0.34 O ATOM 420 CB THR A 29 14.229 9.068 -0.107 1.00 0.39 C ATOM 421 OG1 THR A 29 14.340 10.432 -0.530 1.00 0.40 O ATOM 422 CG2 THR A 29 14.537 8.971 1.377 1.00 0.43 C ATOM 0 H THR A 29 16.699 9.444 -0.234 1.00 0.28 H new ATOM 0 HA THR A 29 15.101 7.147 -0.598 1.00 0.31 H new ATOM 0 HB THR A 29 13.211 8.713 -0.271 1.00 0.39 H new ATOM 0 HG1 THR A 29 13.732 10.989 -0.000 1.00 0.40 H new ATOM 0 HG21 THR A 29 13.850 9.608 1.934 1.00 0.43 H new ATOM 0 HG22 THR A 29 14.421 7.938 1.706 1.00 0.43 H new ATOM 0 HG23 THR A 29 15.561 9.297 1.558 1.00 0.43 H new ATOM 430 N ARG A 30 15.210 9.354 -3.051 1.00 0.35 N ATOM 431 CA ARG A 30 14.892 9.586 -4.455 1.00 0.40 C ATOM 432 C ARG A 30 15.464 8.479 -5.332 1.00 0.40 C ATOM 433 O ARG A 30 15.084 8.333 -6.493 1.00 0.52 O ATOM 434 CB ARG A 30 15.439 10.943 -4.901 1.00 0.46 C ATOM 435 CG ARG A 30 14.968 12.101 -4.034 1.00 0.50 C ATOM 436 CD ARG A 30 15.665 13.400 -4.405 1.00 0.73 C ATOM 437 NE ARG A 30 15.265 14.500 -3.532 1.00 1.71 N ATOM 438 CZ ARG A 30 15.794 15.720 -3.588 1.00 2.26 C ATOM 439 NH1 ARG A 30 16.738 16.000 -4.477 1.00 2.04 N ATOM 440 NH2 ARG A 30 15.378 16.662 -2.753 1.00 3.39 N ATOM 0 H ARG A 30 15.792 10.077 -2.628 1.00 0.35 H new ATOM 0 HA ARG A 30 13.807 9.584 -4.564 1.00 0.40 H new ATOM 0 HB2 ARG A 30 16.528 10.909 -4.888 1.00 0.46 H new ATOM 0 HB3 ARG A 30 15.138 11.126 -5.933 1.00 0.46 H new ATOM 0 HG2 ARG A 30 13.890 12.222 -4.143 1.00 0.50 H new ATOM 0 HG3 ARG A 30 15.159 11.872 -2.986 1.00 0.50 H new ATOM 0 HD2 ARG A 30 16.745 13.263 -4.345 1.00 0.73 H new ATOM 0 HD3 ARG A 30 15.433 13.654 -5.439 1.00 0.73 H new ATOM 0 HE ARG A 30 14.538 14.323 -2.839 1.00 1.71 H new ATOM 0 HH11 ARG A 30 17.062 15.279 -5.122 1.00 2.04 H new ATOM 0 HH12 ARG A 30 17.140 16.937 -4.516 1.00 2.04 H new ATOM 0 HH21 ARG A 30 14.652 16.452 -2.068 1.00 3.39 H new ATOM 0 HH22 ARG A 30 15.784 17.597 -2.796 1.00 3.39 H new ATOM 454 N GLU A 31 16.380 7.699 -4.765 1.00 0.33 N ATOM 455 CA GLU A 31 17.005 6.602 -5.493 1.00 0.36 C ATOM 456 C GLU A 31 16.554 5.254 -4.938 1.00 0.31 C ATOM 457 O GLU A 31 16.876 4.206 -5.497 1.00 0.33 O ATOM 458 CB GLU A 31 18.528 6.711 -5.414 1.00 0.42 C ATOM 459 CG GLU A 31 19.065 8.070 -5.833 1.00 0.52 C ATOM 460 CD GLU A 31 20.580 8.112 -5.867 1.00 1.10 C ATOM 461 OE1 GLU A 31 21.190 8.424 -4.822 1.00 2.01 O ATOM 462 OE2 GLU A 31 21.158 7.830 -6.937 1.00 1.12 O ATOM 0 H GLU A 31 16.705 7.807 -3.804 1.00 0.33 H new ATOM 0 HA GLU A 31 16.695 6.670 -6.536 1.00 0.36 H new ATOM 0 HB2 GLU A 31 18.846 6.504 -4.392 1.00 0.42 H new ATOM 0 HB3 GLU A 31 18.972 5.943 -6.048 1.00 0.42 H new ATOM 0 HG2 GLU A 31 18.676 8.322 -6.819 1.00 0.52 H new ATOM 0 HG3 GLU A 31 18.699 8.830 -5.142 1.00 0.52 H new ATOM 469 N LEU A 32 15.809 5.289 -3.836 1.00 0.31 N ATOM 470 CA LEU A 32 15.319 4.067 -3.207 1.00 0.33 C ATOM 471 C LEU A 32 14.446 3.273 -4.171 1.00 0.29 C ATOM 472 O LEU A 32 14.545 2.049 -4.240 1.00 0.29 O ATOM 473 CB LEU A 32 14.534 4.389 -1.935 1.00 0.40 C ATOM 474 CG LEU A 32 14.094 3.170 -1.120 1.00 0.57 C ATOM 475 CD1 LEU A 32 14.146 3.475 0.367 1.00 1.39 C ATOM 476 CD2 LEU A 32 12.692 2.743 -1.523 1.00 1.39 C ATOM 0 H LEU A 32 15.532 6.148 -3.362 1.00 0.31 H new ATOM 0 HA LEU A 32 16.184 3.460 -2.940 1.00 0.33 H new ATOM 0 HB2 LEU A 32 15.147 5.030 -1.300 1.00 0.40 H new ATOM 0 HB3 LEU A 32 13.649 4.963 -2.208 1.00 0.40 H new ATOM 0 HG LEU A 32 14.782 2.350 -1.328 1.00 0.57 H new ATOM 0 HD11 LEU A 32 13.830 2.597 0.930 1.00 1.39 H new ATOM 0 HD12 LEU A 32 15.165 3.739 0.649 1.00 1.39 H new ATOM 0 HD13 LEU A 32 13.480 4.308 0.591 1.00 1.39 H new ATOM 0 HD21 LEU A 32 12.393 1.875 -0.935 1.00 1.39 H new ATOM 0 HD22 LEU A 32 11.996 3.562 -1.341 1.00 1.39 H new ATOM 0 HD23 LEU A 32 12.680 2.485 -2.582 1.00 1.39 H new ATOM 488 N GLY A 33 13.586 3.971 -4.906 1.00 0.33 N ATOM 489 CA GLY A 33 12.722 3.302 -5.862 1.00 0.35 C ATOM 490 C GLY A 33 13.512 2.409 -6.797 1.00 0.33 C ATOM 491 O GLY A 33 13.193 1.231 -6.960 1.00 0.41 O ATOM 0 H GLY A 33 13.472 4.983 -4.857 1.00 0.33 H new ATOM 0 HA2 GLY A 33 11.981 2.707 -5.329 1.00 0.35 H new ATOM 0 HA3 GLY A 33 12.176 4.046 -6.443 1.00 0.35 H new ATOM 495 N THR A 34 14.551 2.978 -7.405 1.00 0.30 N ATOM 496 CA THR A 34 15.411 2.236 -8.318 1.00 0.31 C ATOM 497 C THR A 34 15.942 0.977 -7.640 1.00 0.27 C ATOM 498 O THR A 34 16.118 -0.061 -8.280 1.00 0.30 O ATOM 499 CB THR A 34 16.596 3.096 -8.794 1.00 0.37 C ATOM 500 OG1 THR A 34 16.116 4.324 -9.353 1.00 0.42 O ATOM 501 CG2 THR A 34 17.424 2.354 -9.832 1.00 0.41 C ATOM 0 H THR A 34 14.817 3.955 -7.280 1.00 0.30 H new ATOM 0 HA THR A 34 14.811 1.960 -9.185 1.00 0.31 H new ATOM 0 HB THR A 34 17.229 3.309 -7.932 1.00 0.37 H new ATOM 0 HG1 THR A 34 16.876 4.866 -9.652 1.00 0.42 H new ATOM 0 HG21 THR A 34 18.255 2.983 -10.152 1.00 0.41 H new ATOM 0 HG22 THR A 34 17.813 1.433 -9.397 1.00 0.41 H new ATOM 0 HG23 THR A 34 16.799 2.113 -10.692 1.00 0.41 H new ATOM 509 N LEU A 35 16.197 1.084 -6.338 1.00 0.27 N ATOM 510 CA LEU A 35 16.693 -0.042 -5.554 1.00 0.30 C ATOM 511 C LEU A 35 15.669 -1.170 -5.568 1.00 0.31 C ATOM 512 O LEU A 35 16.017 -2.346 -5.668 1.00 0.37 O ATOM 513 CB LEU A 35 16.954 0.398 -4.108 1.00 0.35 C ATOM 514 CG LEU A 35 18.155 -0.252 -3.408 1.00 0.50 C ATOM 515 CD1 LEU A 35 18.161 0.105 -1.928 1.00 1.23 C ATOM 516 CD2 LEU A 35 18.145 -1.762 -3.584 1.00 1.25 C ATOM 0 H LEU A 35 16.067 1.943 -5.803 1.00 0.27 H new ATOM 0 HA LEU A 35 17.626 -0.395 -5.993 1.00 0.30 H new ATOM 0 HB2 LEU A 35 17.096 1.479 -4.099 1.00 0.35 H new ATOM 0 HB3 LEU A 35 16.060 0.189 -3.520 1.00 0.35 H new ATOM 0 HG LEU A 35 19.063 0.135 -3.871 1.00 0.50 H new ATOM 0 HD11 LEU A 35 19.018 -0.363 -1.444 1.00 1.23 H new ATOM 0 HD12 LEU A 35 18.227 1.187 -1.815 1.00 1.23 H new ATOM 0 HD13 LEU A 35 17.242 -0.253 -1.464 1.00 1.23 H new ATOM 0 HD21 LEU A 35 19.008 -2.193 -3.077 1.00 1.25 H new ATOM 0 HD22 LEU A 35 17.230 -2.172 -3.156 1.00 1.25 H new ATOM 0 HD23 LEU A 35 18.189 -2.005 -4.646 1.00 1.25 H new ATOM 528 N MET A 36 14.402 -0.791 -5.463 1.00 0.35 N ATOM 529 CA MET A 36 13.309 -1.744 -5.455 1.00 0.43 C ATOM 530 C MET A 36 13.038 -2.291 -6.856 1.00 0.43 C ATOM 531 O MET A 36 12.371 -3.311 -7.010 1.00 0.54 O ATOM 532 CB MET A 36 12.057 -1.075 -4.895 1.00 0.56 C ATOM 533 CG MET A 36 12.339 -0.164 -3.710 1.00 0.59 C ATOM 534 SD MET A 36 10.846 0.326 -2.833 1.00 1.21 S ATOM 535 CE MET A 36 10.437 -1.197 -1.985 1.00 0.72 C ATOM 0 H MET A 36 14.108 0.182 -5.382 1.00 0.35 H new ATOM 0 HA MET A 36 13.588 -2.586 -4.821 1.00 0.43 H new ATOM 0 HB2 MET A 36 11.580 -0.495 -5.685 1.00 0.56 H new ATOM 0 HB3 MET A 36 11.347 -1.845 -4.592 1.00 0.56 H new ATOM 0 HG2 MET A 36 13.010 -0.673 -3.018 1.00 0.59 H new ATOM 0 HG3 MET A 36 12.858 0.728 -4.060 1.00 0.59 H new ATOM 0 HE1 MET A 36 9.424 -1.132 -1.588 1.00 0.72 H new ATOM 0 HE2 MET A 36 10.499 -2.031 -2.684 1.00 0.72 H new ATOM 0 HE3 MET A 36 11.138 -1.357 -1.166 1.00 0.72 H new ATOM 545 N ARG A 37 13.552 -1.604 -7.876 1.00 0.42 N ATOM 546 CA ARG A 37 13.364 -2.042 -9.256 1.00 0.47 C ATOM 547 C ARG A 37 14.240 -3.253 -9.551 1.00 0.43 C ATOM 548 O ARG A 37 13.767 -4.271 -10.055 1.00 0.47 O ATOM 549 CB ARG A 37 13.703 -0.910 -10.228 1.00 0.55 C ATOM 550 CG ARG A 37 12.976 0.392 -9.939 1.00 0.95 C ATOM 551 CD ARG A 37 11.483 0.188 -9.796 1.00 1.20 C ATOM 552 NE ARG A 37 10.748 1.448 -9.872 1.00 1.99 N ATOM 553 CZ ARG A 37 9.421 1.531 -9.856 1.00 2.52 C ATOM 554 NH1 ARG A 37 8.684 0.431 -9.767 1.00 2.46 N ATOM 555 NH2 ARG A 37 8.829 2.715 -9.932 1.00 3.51 N ATOM 0 H ARG A 37 14.098 -0.748 -7.773 1.00 0.42 H new ATOM 0 HA ARG A 37 12.318 -2.319 -9.387 1.00 0.47 H new ATOM 0 HB2 ARG A 37 14.777 -0.729 -10.198 1.00 0.55 H new ATOM 0 HB3 ARG A 37 13.462 -1.231 -11.241 1.00 0.55 H new ATOM 0 HG2 ARG A 37 13.371 0.832 -9.024 1.00 0.95 H new ATOM 0 HG3 ARG A 37 13.170 1.102 -10.743 1.00 0.95 H new ATOM 0 HD2 ARG A 37 11.132 -0.484 -10.579 1.00 1.20 H new ATOM 0 HD3 ARG A 37 11.273 -0.297 -8.843 1.00 1.20 H new ATOM 0 HE ARG A 37 11.283 2.314 -9.941 1.00 1.99 H new ATOM 0 HH11 ARG A 37 9.135 -0.482 -9.711 1.00 2.46 H new ATOM 0 HH12 ARG A 37 7.666 0.499 -9.755 1.00 2.46 H new ATOM 0 HH21 ARG A 37 9.392 3.563 -10.003 1.00 3.51 H new ATOM 0 HH22 ARG A 37 7.811 2.778 -9.920 1.00 3.51 H new ATOM 569 N THR A 38 15.523 -3.125 -9.231 1.00 0.39 N ATOM 570 CA THR A 38 16.483 -4.202 -9.445 1.00 0.39 C ATOM 571 C THR A 38 16.134 -5.416 -8.589 1.00 0.36 C ATOM 572 O THR A 38 16.658 -6.510 -8.798 1.00 0.39 O ATOM 573 CB THR A 38 17.921 -3.746 -9.131 1.00 0.40 C ATOM 574 OG1 THR A 38 18.816 -4.862 -9.203 1.00 0.46 O ATOM 575 CG2 THR A 38 18.002 -3.112 -7.751 1.00 0.32 C ATOM 0 H THR A 38 15.924 -2.282 -8.820 1.00 0.39 H new ATOM 0 HA THR A 38 16.429 -4.478 -10.498 1.00 0.39 H new ATOM 0 HB THR A 38 18.210 -3.000 -9.871 1.00 0.40 H new ATOM 0 HG1 THR A 38 18.326 -5.687 -9.004 1.00 0.46 H new ATOM 0 HG21 THR A 38 19.027 -2.799 -7.554 1.00 0.32 H new ATOM 0 HG22 THR A 38 17.343 -2.244 -7.710 1.00 0.32 H new ATOM 0 HG23 THR A 38 17.693 -3.838 -6.999 1.00 0.32 H new ATOM 583 N LEU A 39 15.242 -5.208 -7.626 1.00 0.33 N ATOM 584 CA LEU A 39 14.807 -6.271 -6.728 1.00 0.34 C ATOM 585 C LEU A 39 13.338 -6.606 -6.975 1.00 0.40 C ATOM 586 O LEU A 39 12.589 -5.790 -7.510 1.00 0.43 O ATOM 587 CB LEU A 39 15.005 -5.853 -5.272 1.00 0.32 C ATOM 588 CG LEU A 39 16.432 -5.445 -4.899 1.00 0.44 C ATOM 589 CD1 LEU A 39 16.436 -4.679 -3.589 1.00 1.05 C ATOM 590 CD2 LEU A 39 17.334 -6.664 -4.792 1.00 1.15 C ATOM 0 H LEU A 39 14.803 -4.305 -7.447 1.00 0.33 H new ATOM 0 HA LEU A 39 15.411 -7.157 -6.926 1.00 0.34 H new ATOM 0 HB2 LEU A 39 14.338 -5.019 -5.056 1.00 0.32 H new ATOM 0 HB3 LEU A 39 14.701 -6.679 -4.629 1.00 0.32 H new ATOM 0 HG LEU A 39 16.817 -4.800 -5.689 1.00 0.44 H new ATOM 0 HD11 LEU A 39 17.458 -4.395 -3.336 1.00 1.05 H new ATOM 0 HD12 LEU A 39 15.825 -3.782 -3.690 1.00 1.05 H new ATOM 0 HD13 LEU A 39 16.028 -5.309 -2.798 1.00 1.05 H new ATOM 0 HD21 LEU A 39 18.343 -6.348 -4.526 1.00 1.15 H new ATOM 0 HD22 LEU A 39 16.949 -7.335 -4.024 1.00 1.15 H new ATOM 0 HD23 LEU A 39 17.358 -7.184 -5.749 1.00 1.15 H new ATOM 602 N GLY A 40 12.942 -7.818 -6.599 1.00 0.45 N ATOM 603 CA GLY A 40 11.568 -8.256 -6.795 1.00 0.52 C ATOM 604 C GLY A 40 10.534 -7.335 -6.166 1.00 0.49 C ATOM 605 O GLY A 40 9.333 -7.555 -6.319 1.00 0.64 O ATOM 0 H GLY A 40 13.550 -8.509 -6.160 1.00 0.45 H new ATOM 0 HA2 GLY A 40 11.370 -8.333 -7.864 1.00 0.52 H new ATOM 0 HA3 GLY A 40 11.452 -9.256 -6.377 1.00 0.52 H new ATOM 609 N GLN A 41 10.991 -6.306 -5.456 1.00 0.46 N ATOM 610 CA GLN A 41 10.084 -5.358 -4.813 1.00 0.44 C ATOM 611 C GLN A 41 9.364 -4.495 -5.845 1.00 0.48 C ATOM 612 O GLN A 41 9.867 -4.279 -6.947 1.00 1.01 O ATOM 613 CB GLN A 41 10.850 -4.467 -3.831 1.00 0.48 C ATOM 614 CG GLN A 41 11.155 -5.132 -2.496 1.00 0.54 C ATOM 615 CD GLN A 41 11.021 -6.644 -2.540 1.00 1.55 C ATOM 616 OE1 GLN A 41 9.972 -7.196 -2.206 1.00 2.37 O ATOM 617 NE2 GLN A 41 12.080 -7.321 -2.969 1.00 2.20 N ATOM 0 H GLN A 41 11.981 -6.108 -5.312 1.00 0.46 H new ATOM 0 HA GLN A 41 9.336 -5.932 -4.266 1.00 0.44 H new ATOM 0 HB2 GLN A 41 11.787 -4.158 -4.293 1.00 0.48 H new ATOM 0 HB3 GLN A 41 10.270 -3.562 -3.650 1.00 0.48 H new ATOM 0 HG2 GLN A 41 12.168 -4.872 -2.190 1.00 0.54 H new ATOM 0 HG3 GLN A 41 10.481 -4.735 -1.737 1.00 0.54 H new ATOM 0 HE21 GLN A 41 12.930 -6.824 -3.236 1.00 2.20 H new ATOM 0 HE22 GLN A 41 12.044 -8.338 -3.032 1.00 2.20 H new ATOM 626 N ASN A 42 8.182 -4.009 -5.476 1.00 0.52 N ATOM 627 CA ASN A 42 7.387 -3.168 -6.363 1.00 0.53 C ATOM 628 C ASN A 42 6.246 -2.492 -5.596 1.00 0.51 C ATOM 629 O ASN A 42 5.089 -2.904 -5.697 1.00 0.59 O ATOM 630 CB ASN A 42 6.835 -3.997 -7.532 1.00 0.66 C ATOM 631 CG ASN A 42 5.841 -5.065 -7.100 1.00 1.27 C ATOM 632 OD1 ASN A 42 5.997 -5.578 -5.884 1.00 2.15 O flip ATOM 633 ND2 ASN A 42 4.938 -5.424 -7.856 1.00 1.71 N flip ATOM 0 H ASN A 42 7.754 -4.184 -4.567 1.00 0.52 H new ATOM 0 HA ASN A 42 8.033 -2.387 -6.765 1.00 0.53 H new ATOM 0 HB2 ASN A 42 6.352 -3.329 -8.245 1.00 0.66 H new ATOM 0 HB3 ASN A 42 7.665 -4.474 -8.053 1.00 0.66 H new ATOM 0 HD21 ASN A 42 4.852 -5.006 -8.782 1.00 1.71 H new ATOM 0 HD22 ASN A 42 4.276 -6.140 -7.556 1.00 1.71 H new ATOM 640 N PRO A 43 6.555 -1.437 -4.819 1.00 0.47 N ATOM 641 CA PRO A 43 5.548 -0.713 -4.037 1.00 0.54 C ATOM 642 C PRO A 43 4.698 0.205 -4.901 1.00 0.54 C ATOM 643 O PRO A 43 5.001 0.427 -6.074 1.00 0.64 O ATOM 644 CB PRO A 43 6.398 0.117 -3.080 1.00 0.53 C ATOM 645 CG PRO A 43 7.630 0.402 -3.860 1.00 0.46 C ATOM 646 CD PRO A 43 7.903 -0.854 -4.640 1.00 0.45 C ATOM 0 HA PRO A 43 4.843 -1.386 -3.549 1.00 0.54 H new ATOM 0 HB2 PRO A 43 5.889 1.035 -2.786 1.00 0.53 H new ATOM 0 HB3 PRO A 43 6.621 -0.431 -2.165 1.00 0.53 H new ATOM 0 HG2 PRO A 43 7.487 1.255 -4.524 1.00 0.46 H new ATOM 0 HG3 PRO A 43 8.464 0.646 -3.203 1.00 0.46 H new ATOM 0 HD2 PRO A 43 8.380 -0.639 -5.596 1.00 0.45 H new ATOM 0 HD3 PRO A 43 8.566 -1.529 -4.098 1.00 0.45 H new ATOM 654 N THR A 44 3.632 0.735 -4.316 1.00 0.59 N ATOM 655 CA THR A 44 2.752 1.644 -5.029 1.00 0.65 C ATOM 656 C THR A 44 3.377 3.031 -5.092 1.00 0.57 C ATOM 657 O THR A 44 4.019 3.464 -4.135 1.00 0.51 O ATOM 658 CB THR A 44 1.369 1.736 -4.358 1.00 0.78 C ATOM 659 OG1 THR A 44 0.844 0.422 -4.136 1.00 1.05 O ATOM 660 CG2 THR A 44 0.399 2.532 -5.218 1.00 1.02 C ATOM 0 H THR A 44 3.358 0.550 -3.351 1.00 0.59 H new ATOM 0 HA THR A 44 2.617 1.252 -6.037 1.00 0.65 H new ATOM 0 HB THR A 44 1.489 2.248 -3.403 1.00 0.78 H new ATOM 0 HG1 THR A 44 -0.035 0.489 -3.707 1.00 1.05 H new ATOM 0 HG21 THR A 44 -0.570 2.582 -4.722 1.00 1.02 H new ATOM 0 HG22 THR A 44 0.785 3.541 -5.363 1.00 1.02 H new ATOM 0 HG23 THR A 44 0.286 2.044 -6.186 1.00 1.02 H new ATOM 668 N GLU A 45 3.203 3.715 -6.217 1.00 0.61 N ATOM 669 CA GLU A 45 3.765 5.050 -6.397 1.00 0.61 C ATOM 670 C GLU A 45 3.595 5.896 -5.137 1.00 0.60 C ATOM 671 O GLU A 45 4.519 6.591 -4.716 1.00 0.56 O ATOM 672 CB GLU A 45 3.103 5.745 -7.589 1.00 0.75 C ATOM 673 CG GLU A 45 3.726 7.086 -7.937 1.00 1.33 C ATOM 674 CD GLU A 45 3.024 7.769 -9.094 1.00 2.16 C ATOM 675 OE1 GLU A 45 3.382 7.486 -10.257 1.00 2.64 O ATOM 676 OE2 GLU A 45 2.117 8.589 -8.837 1.00 2.69 O ATOM 0 H GLU A 45 2.677 3.368 -7.019 1.00 0.61 H new ATOM 0 HA GLU A 45 4.832 4.943 -6.592 1.00 0.61 H new ATOM 0 HB2 GLU A 45 3.162 5.090 -8.459 1.00 0.75 H new ATOM 0 HB3 GLU A 45 2.045 5.891 -7.371 1.00 0.75 H new ATOM 0 HG2 GLU A 45 3.694 7.736 -7.062 1.00 1.33 H new ATOM 0 HG3 GLU A 45 4.777 6.941 -8.188 1.00 1.33 H new ATOM 683 N ALA A 46 2.414 5.816 -4.530 1.00 0.66 N ATOM 684 CA ALA A 46 2.125 6.575 -3.319 1.00 0.70 C ATOM 685 C ALA A 46 3.078 6.207 -2.189 1.00 0.64 C ATOM 686 O ALA A 46 3.610 7.084 -1.513 1.00 0.66 O ATOM 687 CB ALA A 46 0.688 6.352 -2.881 1.00 0.83 C ATOM 0 H ALA A 46 1.643 5.234 -4.857 1.00 0.66 H new ATOM 0 HA ALA A 46 2.267 7.631 -3.551 1.00 0.70 H new ATOM 0 HB1 ALA A 46 0.490 6.926 -1.976 1.00 0.83 H new ATOM 0 HB2 ALA A 46 0.012 6.677 -3.672 1.00 0.83 H new ATOM 0 HB3 ALA A 46 0.529 5.292 -2.681 1.00 0.83 H new ATOM 693 N GLU A 47 3.289 4.908 -1.985 1.00 0.62 N ATOM 694 CA GLU A 47 4.177 4.440 -0.925 1.00 0.62 C ATOM 695 C GLU A 47 5.566 5.043 -1.087 1.00 0.50 C ATOM 696 O GLU A 47 6.103 5.641 -0.156 1.00 0.48 O ATOM 697 CB GLU A 47 4.266 2.913 -0.927 1.00 0.69 C ATOM 698 CG GLU A 47 5.014 2.352 0.273 1.00 0.75 C ATOM 699 CD GLU A 47 5.051 0.837 0.285 1.00 1.31 C ATOM 700 OE1 GLU A 47 4.027 0.221 0.648 1.00 1.34 O ATOM 701 OE2 GLU A 47 6.103 0.266 -0.070 1.00 2.23 O ATOM 0 H GLU A 47 2.860 4.165 -2.537 1.00 0.62 H new ATOM 0 HA GLU A 47 3.762 4.763 0.030 1.00 0.62 H new ATOM 0 HB2 GLU A 47 3.259 2.497 -0.945 1.00 0.69 H new ATOM 0 HB3 GLU A 47 4.762 2.586 -1.841 1.00 0.69 H new ATOM 0 HG2 GLU A 47 6.034 2.736 0.272 1.00 0.75 H new ATOM 0 HG3 GLU A 47 4.541 2.707 1.189 1.00 0.75 H new ATOM 708 N LEU A 48 6.140 4.880 -2.274 1.00 0.45 N ATOM 709 CA LEU A 48 7.463 5.416 -2.568 1.00 0.39 C ATOM 710 C LEU A 48 7.507 6.912 -2.260 1.00 0.35 C ATOM 711 O LEU A 48 8.519 7.442 -1.796 1.00 0.34 O ATOM 712 CB LEU A 48 7.811 5.157 -4.037 1.00 0.40 C ATOM 713 CG LEU A 48 9.288 4.883 -4.336 1.00 0.66 C ATOM 714 CD1 LEU A 48 10.163 6.034 -3.866 1.00 1.42 C ATOM 715 CD2 LEU A 48 9.721 3.578 -3.690 1.00 1.39 C ATOM 0 H LEU A 48 5.708 4.379 -3.050 1.00 0.45 H new ATOM 0 HA LEU A 48 8.200 4.916 -1.940 1.00 0.39 H new ATOM 0 HB2 LEU A 48 7.226 4.305 -4.384 1.00 0.40 H new ATOM 0 HB3 LEU A 48 7.496 6.020 -4.623 1.00 0.40 H new ATOM 0 HG LEU A 48 9.408 4.794 -5.416 1.00 0.66 H new ATOM 0 HD11 LEU A 48 11.206 5.813 -4.091 1.00 1.42 H new ATOM 0 HD12 LEU A 48 9.867 6.949 -4.379 1.00 1.42 H new ATOM 0 HD13 LEU A 48 10.044 6.166 -2.791 1.00 1.42 H new ATOM 0 HD21 LEU A 48 10.773 3.395 -3.910 1.00 1.39 H new ATOM 0 HD22 LEU A 48 9.582 3.642 -2.611 1.00 1.39 H new ATOM 0 HD23 LEU A 48 9.120 2.759 -4.085 1.00 1.39 H new ATOM 727 N GLN A 49 6.389 7.583 -2.510 1.00 0.45 N ATOM 728 CA GLN A 49 6.274 9.014 -2.260 1.00 0.52 C ATOM 729 C GLN A 49 6.147 9.297 -0.768 1.00 0.54 C ATOM 730 O GLN A 49 6.543 10.359 -0.292 1.00 0.58 O ATOM 731 CB GLN A 49 5.053 9.573 -2.984 1.00 0.67 C ATOM 732 CG GLN A 49 5.186 9.578 -4.499 1.00 0.70 C ATOM 733 CD GLN A 49 6.268 10.520 -4.990 1.00 0.77 C ATOM 734 OE1 GLN A 49 6.559 11.533 -4.355 1.00 1.21 O ATOM 735 NE2 GLN A 49 6.869 10.191 -6.127 1.00 1.02 N ATOM 0 H GLN A 49 5.544 7.155 -2.888 1.00 0.45 H new ATOM 0 HA GLN A 49 7.177 9.496 -2.634 1.00 0.52 H new ATOM 0 HB2 GLN A 49 4.178 8.985 -2.708 1.00 0.67 H new ATOM 0 HB3 GLN A 49 4.874 10.592 -2.641 1.00 0.67 H new ATOM 0 HG2 GLN A 49 5.406 8.568 -4.843 1.00 0.70 H new ATOM 0 HG3 GLN A 49 4.232 9.865 -4.942 1.00 0.70 H new ATOM 0 HE21 GLN A 49 6.596 9.341 -6.621 1.00 1.02 H new ATOM 0 HE22 GLN A 49 7.604 10.788 -6.507 1.00 1.02 H new ATOM 744 N ASP A 50 5.586 8.338 -0.038 1.00 0.59 N ATOM 745 CA ASP A 50 5.392 8.480 1.400 1.00 0.68 C ATOM 746 C ASP A 50 6.729 8.586 2.117 1.00 0.59 C ATOM 747 O ASP A 50 6.940 9.491 2.922 1.00 0.57 O ATOM 748 CB ASP A 50 4.589 7.304 1.960 1.00 0.88 C ATOM 749 CG ASP A 50 3.117 7.384 1.601 1.00 1.05 C ATOM 750 OD1 ASP A 50 2.444 8.328 2.065 1.00 1.09 O ATOM 751 OD2 ASP A 50 2.638 6.504 0.857 1.00 1.19 O ATOM 0 H ASP A 50 5.257 7.452 -0.421 1.00 0.59 H new ATOM 0 HA ASP A 50 4.830 9.398 1.572 1.00 0.68 H new ATOM 0 HB2 ASP A 50 5.003 6.371 1.578 1.00 0.88 H new ATOM 0 HB3 ASP A 50 4.695 7.279 3.045 1.00 0.88 H new ATOM 756 N LEU A 51 7.630 7.652 1.828 1.00 0.60 N ATOM 757 CA LEU A 51 8.945 7.664 2.447 1.00 0.64 C ATOM 758 C LEU A 51 9.709 8.916 2.043 1.00 0.54 C ATOM 759 O LEU A 51 10.323 9.573 2.881 1.00 0.64 O ATOM 760 CB LEU A 51 9.749 6.427 2.066 1.00 0.76 C ATOM 761 CG LEU A 51 9.526 5.927 0.650 1.00 0.40 C ATOM 762 CD1 LEU A 51 10.853 5.704 -0.056 1.00 0.86 C ATOM 763 CD2 LEU A 51 8.709 4.649 0.681 1.00 0.84 C ATOM 0 H LEU A 51 7.473 6.885 1.174 1.00 0.60 H new ATOM 0 HA LEU A 51 8.801 7.661 3.527 1.00 0.64 H new ATOM 0 HB2 LEU A 51 10.809 6.647 2.195 1.00 0.76 H new ATOM 0 HB3 LEU A 51 9.504 5.624 2.761 1.00 0.76 H new ATOM 0 HG LEU A 51 8.974 6.683 0.091 1.00 0.40 H new ATOM 0 HD11 LEU A 51 10.670 5.346 -1.069 1.00 0.86 H new ATOM 0 HD12 LEU A 51 11.406 6.643 -0.097 1.00 0.86 H new ATOM 0 HD13 LEU A 51 11.436 4.963 0.491 1.00 0.86 H new ATOM 0 HD21 LEU A 51 8.551 4.293 -0.337 1.00 0.84 H new ATOM 0 HD22 LEU A 51 9.243 3.889 1.252 1.00 0.84 H new ATOM 0 HD23 LEU A 51 7.745 4.845 1.151 1.00 0.84 H new ATOM 775 N ILE A 52 9.674 9.242 0.750 1.00 0.44 N ATOM 776 CA ILE A 52 10.361 10.429 0.258 1.00 0.48 C ATOM 777 C ILE A 52 9.792 11.681 0.905 1.00 0.53 C ATOM 778 O ILE A 52 10.505 12.657 1.097 1.00 0.68 O ATOM 779 CB ILE A 52 10.255 10.579 -1.271 1.00 0.48 C ATOM 780 CG1 ILE A 52 10.945 9.406 -1.972 1.00 0.48 C ATOM 781 CG2 ILE A 52 10.862 11.909 -1.715 1.00 0.67 C ATOM 782 CD1 ILE A 52 10.786 9.418 -3.478 1.00 0.54 C ATOM 0 H ILE A 52 9.183 8.706 0.035 1.00 0.44 H new ATOM 0 HA ILE A 52 11.412 10.307 0.522 1.00 0.48 H new ATOM 0 HB ILE A 52 9.202 10.571 -1.552 1.00 0.48 H new ATOM 0 HG12 ILE A 52 12.007 9.422 -1.728 1.00 0.48 H new ATOM 0 HG13 ILE A 52 10.542 8.472 -1.580 1.00 0.48 H new ATOM 0 HG21 ILE A 52 10.781 12.003 -2.798 1.00 0.67 H new ATOM 0 HG22 ILE A 52 10.327 12.730 -1.239 1.00 0.67 H new ATOM 0 HG23 ILE A 52 11.912 11.944 -1.426 1.00 0.67 H new ATOM 0 HD11 ILE A 52 11.301 8.557 -3.905 1.00 0.54 H new ATOM 0 HD12 ILE A 52 9.727 9.370 -3.732 1.00 0.54 H new ATOM 0 HD13 ILE A 52 11.215 10.335 -3.882 1.00 0.54 H new ATOM 794 N ALA A 53 8.503 11.645 1.229 1.00 0.50 N ATOM 795 CA ALA A 53 7.834 12.784 1.849 1.00 0.60 C ATOM 796 C ALA A 53 8.204 12.907 3.322 1.00 0.64 C ATOM 797 O ALA A 53 8.389 14.011 3.835 1.00 0.73 O ATOM 798 CB ALA A 53 6.327 12.662 1.690 1.00 0.67 C ATOM 0 H ALA A 53 7.900 10.838 1.072 1.00 0.50 H new ATOM 0 HA ALA A 53 8.170 13.688 1.342 1.00 0.60 H new ATOM 0 HB1 ALA A 53 5.841 13.519 2.157 1.00 0.67 H new ATOM 0 HB2 ALA A 53 6.074 12.635 0.630 1.00 0.67 H new ATOM 0 HB3 ALA A 53 5.984 11.745 2.168 1.00 0.67 H new ATOM 804 N GLU A 54 8.307 11.768 3.998 1.00 0.63 N ATOM 805 CA GLU A 54 8.658 11.751 5.412 1.00 0.72 C ATOM 806 C GLU A 54 10.106 12.180 5.604 1.00 0.66 C ATOM 807 O GLU A 54 10.409 13.028 6.444 1.00 0.72 O ATOM 808 CB GLU A 54 8.442 10.354 5.997 1.00 0.81 C ATOM 809 CG GLU A 54 8.726 10.268 7.487 1.00 1.18 C ATOM 810 CD GLU A 54 7.815 11.161 8.305 1.00 1.71 C ATOM 811 OE1 GLU A 54 6.725 10.696 8.701 1.00 1.82 O ATOM 812 OE2 GLU A 54 8.191 12.327 8.552 1.00 2.45 O ATOM 0 H GLU A 54 8.153 10.846 3.590 1.00 0.63 H new ATOM 0 HA GLU A 54 8.012 12.455 5.937 1.00 0.72 H new ATOM 0 HB2 GLU A 54 7.412 10.048 5.814 1.00 0.81 H new ATOM 0 HB3 GLU A 54 9.083 9.646 5.472 1.00 0.81 H new ATOM 0 HG2 GLU A 54 8.609 9.236 7.817 1.00 1.18 H new ATOM 0 HG3 GLU A 54 9.764 10.546 7.672 1.00 1.18 H new ATOM 819 N ALA A 55 10.998 11.585 4.817 1.00 0.58 N ATOM 820 CA ALA A 55 12.418 11.906 4.890 1.00 0.56 C ATOM 821 C ALA A 55 12.729 13.191 4.129 1.00 0.58 C ATOM 822 O ALA A 55 13.813 13.757 4.266 1.00 0.62 O ATOM 823 CB ALA A 55 13.248 10.753 4.346 1.00 0.56 C ATOM 0 H ALA A 55 10.761 10.878 4.121 1.00 0.58 H new ATOM 0 HA ALA A 55 12.678 12.063 5.937 1.00 0.56 H new ATOM 0 HB1 ALA A 55 14.306 11.006 4.407 1.00 0.56 H new ATOM 0 HB2 ALA A 55 13.055 9.856 4.935 1.00 0.56 H new ATOM 0 HB3 ALA A 55 12.978 10.569 3.306 1.00 0.56 H new ATOM 829 N GLU A 56 11.766 13.636 3.322 1.00 0.59 N ATOM 830 CA GLU A 56 11.916 14.843 2.509 1.00 0.65 C ATOM 831 C GLU A 56 12.613 15.967 3.268 1.00 0.72 C ATOM 832 O GLU A 56 13.625 16.502 2.813 1.00 0.77 O ATOM 833 CB GLU A 56 10.546 15.344 2.040 1.00 0.72 C ATOM 834 CG GLU A 56 10.622 16.354 0.906 1.00 0.82 C ATOM 835 CD GLU A 56 9.255 16.803 0.429 1.00 1.52 C ATOM 836 OE1 GLU A 56 8.699 17.749 1.024 1.00 2.45 O ATOM 837 OE2 GLU A 56 8.739 16.206 -0.540 1.00 1.79 O ATOM 0 H GLU A 56 10.864 13.173 3.213 1.00 0.59 H new ATOM 0 HA GLU A 56 12.534 14.569 1.654 1.00 0.65 H new ATOM 0 HB2 GLU A 56 9.948 14.492 1.717 1.00 0.72 H new ATOM 0 HB3 GLU A 56 10.026 15.797 2.884 1.00 0.72 H new ATOM 0 HG2 GLU A 56 11.190 17.223 1.237 1.00 0.82 H new ATOM 0 HG3 GLU A 56 11.168 15.916 0.071 1.00 0.82 H new ATOM 844 N ASN A 57 12.067 16.318 4.427 1.00 0.77 N ATOM 845 CA ASN A 57 12.614 17.406 5.228 1.00 0.88 C ATOM 846 C ASN A 57 13.354 16.891 6.462 1.00 0.82 C ATOM 847 O ASN A 57 14.228 17.574 6.996 1.00 1.21 O ATOM 848 CB ASN A 57 11.484 18.351 5.644 1.00 1.17 C ATOM 849 CG ASN A 57 10.376 18.417 4.604 1.00 1.21 C ATOM 850 OD1 ASN A 57 10.739 18.241 3.334 1.00 1.80 O flip ATOM 851 ND2 ASN A 57 9.210 18.624 4.938 1.00 1.19 N flip ATOM 0 H ASN A 57 11.247 15.866 4.832 1.00 0.77 H new ATOM 0 HA ASN A 57 13.340 17.943 4.617 1.00 0.88 H new ATOM 0 HB2 ASN A 57 11.067 18.020 6.595 1.00 1.17 H new ATOM 0 HB3 ASN A 57 11.889 19.350 5.804 1.00 1.17 H new ATOM 0 HD21 ASN A 57 8.977 18.753 5.923 1.00 1.19 H new ATOM 0 HD22 ASN A 57 8.477 18.666 4.230 1.00 1.19 H new ATOM 858 N ASN A 58 13.004 15.689 6.911 1.00 1.05 N ATOM 859 CA ASN A 58 13.648 15.099 8.081 1.00 1.01 C ATOM 860 C ASN A 58 15.127 14.847 7.809 1.00 0.95 C ATOM 861 O ASN A 58 15.913 14.635 8.733 1.00 1.57 O ATOM 862 CB ASN A 58 12.954 13.791 8.471 1.00 1.04 C ATOM 863 CG ASN A 58 13.482 13.220 9.773 1.00 1.42 C ATOM 864 OD1 ASN A 58 14.426 12.429 9.781 1.00 1.82 O ATOM 865 ND2 ASN A 58 12.875 13.621 10.885 1.00 1.89 N ATOM 0 H ASN A 58 12.282 15.107 6.486 1.00 1.05 H new ATOM 0 HA ASN A 58 13.562 15.802 8.909 1.00 1.01 H new ATOM 0 HB2 ASN A 58 11.882 13.965 8.563 1.00 1.04 H new ATOM 0 HB3 ASN A 58 13.091 13.059 7.675 1.00 1.04 H new ATOM 0 HD21 ASN A 58 13.188 13.272 11.791 1.00 1.89 H new ATOM 0 HD22 ASN A 58 12.096 14.278 10.833 1.00 1.89 H new ATOM 872 N ASN A 59 15.492 14.879 6.533 1.00 0.75 N ATOM 873 CA ASN A 59 16.871 14.662 6.113 1.00 0.73 C ATOM 874 C ASN A 59 17.000 14.903 4.610 1.00 0.84 C ATOM 875 O ASN A 59 16.000 15.123 3.926 1.00 1.76 O ATOM 876 CB ASN A 59 17.319 13.237 6.473 1.00 0.76 C ATOM 877 CG ASN A 59 18.726 12.929 6.003 1.00 0.95 C ATOM 878 OD1 ASN A 59 18.832 12.208 4.893 1.00 1.75 O flip ATOM 879 ND2 ASN A 59 19.705 13.322 6.637 1.00 0.92 N flip ATOM 0 H ASN A 59 14.845 15.055 5.764 1.00 0.75 H new ATOM 0 HA ASN A 59 17.518 15.366 6.636 1.00 0.73 H new ATOM 0 HB2 ASN A 59 17.265 13.106 7.554 1.00 0.76 H new ATOM 0 HB3 ASN A 59 16.627 12.520 6.030 1.00 0.76 H new ATOM 0 HD21 ASN A 59 19.575 13.874 7.485 1.00 0.92 H new ATOM 0 HD22 ASN A 59 20.646 13.096 6.314 1.00 0.92 H new ATOM 886 N ASN A 60 18.226 14.872 4.097 1.00 0.57 N ATOM 887 CA ASN A 60 18.458 15.074 2.670 1.00 0.52 C ATOM 888 C ASN A 60 17.756 13.990 1.868 1.00 0.42 C ATOM 889 O ASN A 60 17.745 14.015 0.636 1.00 0.53 O ATOM 890 CB ASN A 60 19.956 15.042 2.355 1.00 0.58 C ATOM 891 CG ASN A 60 20.568 13.667 2.574 1.00 0.93 C ATOM 892 OD1 ASN A 60 20.457 12.795 1.572 1.00 1.99 O flip ATOM 893 ND2 ASN A 60 21.128 13.388 3.635 1.00 0.55 N flip ATOM 0 H ASN A 60 19.071 14.710 4.645 1.00 0.57 H new ATOM 0 HA ASN A 60 18.058 16.050 2.397 1.00 0.52 H new ATOM 0 HB2 ASN A 60 20.113 15.345 1.320 1.00 0.58 H new ATOM 0 HB3 ASN A 60 20.471 15.770 2.982 1.00 0.58 H new ATOM 0 HD21 ASN A 60 21.191 14.085 4.377 1.00 0.55 H new ATOM 0 HD22 ASN A 60 21.528 12.460 3.772 1.00 0.55 H new ATOM 900 N GLY A 61 17.169 13.041 2.584 1.00 0.37 N ATOM 901 CA GLY A 61 16.489 11.939 1.950 1.00 0.33 C ATOM 902 C GLY A 61 17.319 10.683 2.043 1.00 0.27 C ATOM 903 O GLY A 61 17.715 10.120 1.034 1.00 0.33 O ATOM 0 H GLY A 61 17.154 13.019 3.604 1.00 0.37 H new ATOM 0 HA2 GLY A 61 15.521 11.779 2.426 1.00 0.33 H new ATOM 0 HA3 GLY A 61 16.295 12.177 0.904 1.00 0.33 H new ATOM 907 N GLN A 62 17.603 10.258 3.267 1.00 0.29 N ATOM 908 CA GLN A 62 18.409 9.067 3.494 1.00 0.25 C ATOM 909 C GLN A 62 17.650 8.043 4.334 1.00 0.29 C ATOM 910 O GLN A 62 16.736 8.393 5.081 1.00 0.42 O ATOM 911 CB GLN A 62 19.718 9.441 4.194 1.00 0.30 C ATOM 912 CG GLN A 62 20.694 10.210 3.321 1.00 0.31 C ATOM 913 CD GLN A 62 21.477 9.308 2.390 1.00 0.32 C ATOM 914 OE1 GLN A 62 20.973 9.129 1.178 1.00 0.38 O flip ATOM 915 NE2 GLN A 62 22.529 8.787 2.755 1.00 0.54 N flip ATOM 0 H GLN A 62 17.286 10.721 4.119 1.00 0.29 H new ATOM 0 HA GLN A 62 18.632 8.621 2.525 1.00 0.25 H new ATOM 0 HB2 GLN A 62 19.487 10.039 5.075 1.00 0.30 H new ATOM 0 HB3 GLN A 62 20.202 8.530 4.545 1.00 0.30 H new ATOM 0 HG2 GLN A 62 20.147 10.947 2.733 1.00 0.31 H new ATOM 0 HG3 GLN A 62 21.388 10.761 3.956 1.00 0.31 H new ATOM 0 HE21 GLN A 62 22.880 8.953 3.698 1.00 0.54 H new ATOM 0 HE22 GLN A 62 23.051 8.189 2.115 1.00 0.54 H new ATOM 924 N LEU A 63 18.035 6.776 4.202 1.00 0.28 N ATOM 925 CA LEU A 63 17.399 5.696 4.954 1.00 0.37 C ATOM 926 C LEU A 63 18.431 4.684 5.428 1.00 0.27 C ATOM 927 O LEU A 63 19.497 4.547 4.834 1.00 0.23 O ATOM 928 CB LEU A 63 16.343 4.985 4.117 1.00 0.57 C ATOM 929 CG LEU A 63 15.439 5.907 3.315 1.00 0.90 C ATOM 930 CD1 LEU A 63 16.034 6.138 1.943 1.00 1.58 C ATOM 931 CD2 LEU A 63 14.039 5.330 3.219 1.00 1.61 C ATOM 0 H LEU A 63 18.785 6.471 3.581 1.00 0.28 H new ATOM 0 HA LEU A 63 16.915 6.148 5.820 1.00 0.37 H new ATOM 0 HB2 LEU A 63 16.843 4.302 3.430 1.00 0.57 H new ATOM 0 HB3 LEU A 63 15.725 4.377 4.777 1.00 0.57 H new ATOM 0 HG LEU A 63 15.364 6.868 3.824 1.00 0.90 H new ATOM 0 HD11 LEU A 63 15.383 6.799 1.371 1.00 1.58 H new ATOM 0 HD12 LEU A 63 17.018 6.596 2.045 1.00 1.58 H new ATOM 0 HD13 LEU A 63 16.130 5.185 1.423 1.00 1.58 H new ATOM 0 HD21 LEU A 63 13.406 6.004 2.641 1.00 1.61 H new ATOM 0 HD22 LEU A 63 14.079 4.358 2.726 1.00 1.61 H new ATOM 0 HD23 LEU A 63 13.624 5.212 4.220 1.00 1.61 H new ATOM 943 N ASN A 64 18.082 3.944 6.472 1.00 0.31 N ATOM 944 CA ASN A 64 18.980 2.947 7.037 1.00 0.28 C ATOM 945 C ASN A 64 18.469 1.551 6.736 1.00 0.25 C ATOM 946 O ASN A 64 17.293 1.367 6.433 1.00 0.27 O ATOM 947 CB ASN A 64 19.114 3.117 8.551 1.00 0.41 C ATOM 948 CG ASN A 64 19.564 4.501 8.950 1.00 0.53 C ATOM 949 OD1 ASN A 64 20.746 4.734 9.199 1.00 1.34 O ATOM 950 ND2 ASN A 64 18.623 5.427 9.019 1.00 0.95 N ATOM 0 H ASN A 64 17.181 4.016 6.945 1.00 0.31 H new ATOM 0 HA ASN A 64 19.960 3.088 6.581 1.00 0.28 H new ATOM 0 HB2 ASN A 64 18.154 2.903 9.022 1.00 0.41 H new ATOM 0 HB3 ASN A 64 19.826 2.385 8.932 1.00 0.41 H new ATOM 0 HD21 ASN A 64 18.865 6.381 9.288 1.00 0.95 H new ATOM 0 HD22 ASN A 64 17.655 5.188 8.803 1.00 0.95 H new ATOM 957 N PHE A 65 19.371 0.583 6.788 1.00 0.25 N ATOM 958 CA PHE A 65 19.032 -0.810 6.502 1.00 0.26 C ATOM 959 C PHE A 65 17.662 -1.190 7.069 1.00 0.27 C ATOM 960 O PHE A 65 16.914 -1.941 6.445 1.00 0.31 O ATOM 961 CB PHE A 65 20.106 -1.736 7.072 1.00 0.32 C ATOM 962 CG PHE A 65 19.853 -3.193 6.804 1.00 0.30 C ATOM 963 CD1 PHE A 65 20.053 -3.722 5.539 1.00 0.36 C ATOM 964 CD2 PHE A 65 19.409 -4.029 7.815 1.00 0.39 C ATOM 965 CE1 PHE A 65 19.819 -5.061 5.288 1.00 0.44 C ATOM 966 CE2 PHE A 65 19.171 -5.368 7.570 1.00 0.45 C ATOM 967 CZ PHE A 65 19.393 -5.888 6.310 1.00 0.45 C ATOM 0 H PHE A 65 20.351 0.734 7.027 1.00 0.25 H new ATOM 0 HA PHE A 65 18.986 -0.924 5.419 1.00 0.26 H new ATOM 0 HB2 PHE A 65 21.072 -1.461 6.649 1.00 0.32 H new ATOM 0 HB3 PHE A 65 20.173 -1.580 8.149 1.00 0.32 H new ATOM 0 HD1 PHE A 65 20.396 -3.081 4.740 1.00 0.36 H new ATOM 0 HD2 PHE A 65 19.247 -3.630 8.805 1.00 0.39 H new ATOM 0 HE1 PHE A 65 19.969 -5.460 4.296 1.00 0.44 H new ATOM 0 HE2 PHE A 65 18.812 -6.007 8.363 1.00 0.45 H new ATOM 0 HZ PHE A 65 19.234 -6.940 6.124 1.00 0.45 H new ATOM 977 N THR A 66 17.333 -0.660 8.243 1.00 0.28 N ATOM 978 CA THR A 66 16.053 -0.955 8.880 1.00 0.32 C ATOM 979 C THR A 66 14.879 -0.492 8.019 1.00 0.31 C ATOM 980 O THR A 66 13.881 -1.197 7.888 1.00 0.33 O ATOM 981 CB THR A 66 15.941 -0.283 10.260 1.00 0.38 C ATOM 982 OG1 THR A 66 17.155 -0.469 10.999 1.00 0.56 O ATOM 983 CG2 THR A 66 14.772 -0.857 11.046 1.00 0.52 C ATOM 0 H THR A 66 17.932 -0.026 8.771 1.00 0.28 H new ATOM 0 HA THR A 66 16.012 -2.038 8.999 1.00 0.32 H new ATOM 0 HB THR A 66 15.770 0.783 10.107 1.00 0.38 H new ATOM 0 HG1 THR A 66 17.074 -0.036 11.875 1.00 0.56 H new ATOM 0 HG21 THR A 66 14.712 -0.368 12.018 1.00 0.52 H new ATOM 0 HG22 THR A 66 13.846 -0.688 10.497 1.00 0.52 H new ATOM 0 HG23 THR A 66 14.919 -1.928 11.187 1.00 0.52 H new ATOM 991 N GLU A 67 15.004 0.700 7.443 1.00 0.30 N ATOM 992 CA GLU A 67 13.950 1.259 6.600 1.00 0.33 C ATOM 993 C GLU A 67 13.652 0.359 5.405 1.00 0.30 C ATOM 994 O GLU A 67 12.509 -0.055 5.200 1.00 0.33 O ATOM 995 CB GLU A 67 14.342 2.658 6.110 1.00 0.36 C ATOM 996 CG GLU A 67 14.749 3.602 7.231 1.00 0.42 C ATOM 997 CD GLU A 67 13.628 3.843 8.224 1.00 0.93 C ATOM 998 OE1 GLU A 67 12.834 4.782 8.006 1.00 1.22 O ATOM 999 OE2 GLU A 67 13.546 3.094 9.220 1.00 1.70 O ATOM 0 H GLU A 67 15.824 1.298 7.544 1.00 0.30 H new ATOM 0 HA GLU A 67 13.047 1.329 7.207 1.00 0.33 H new ATOM 0 HB2 GLU A 67 15.167 2.569 5.403 1.00 0.36 H new ATOM 0 HB3 GLU A 67 13.503 3.092 5.567 1.00 0.36 H new ATOM 0 HG2 GLU A 67 15.611 3.189 7.755 1.00 0.42 H new ATOM 0 HG3 GLU A 67 15.062 4.555 6.804 1.00 0.42 H new ATOM 1006 N PHE A 68 14.682 0.049 4.621 1.00 0.27 N ATOM 1007 CA PHE A 68 14.506 -0.793 3.443 1.00 0.26 C ATOM 1008 C PHE A 68 14.105 -2.208 3.830 1.00 0.27 C ATOM 1009 O PHE A 68 13.080 -2.711 3.375 1.00 0.31 O ATOM 1010 CB PHE A 68 15.780 -0.829 2.599 1.00 0.26 C ATOM 1011 CG PHE A 68 15.576 -1.448 1.239 1.00 0.27 C ATOM 1012 CD1 PHE A 68 14.469 -1.115 0.472 1.00 0.38 C ATOM 1013 CD2 PHE A 68 16.489 -2.357 0.728 1.00 0.35 C ATOM 1014 CE1 PHE A 68 14.278 -1.675 -0.775 1.00 0.44 C ATOM 1015 CE2 PHE A 68 16.301 -2.919 -0.521 1.00 0.37 C ATOM 1016 CZ PHE A 68 15.195 -2.577 -1.273 1.00 0.37 C ATOM 0 H PHE A 68 15.639 0.366 4.779 1.00 0.27 H new ATOM 0 HA PHE A 68 13.703 -0.355 2.850 1.00 0.26 H new ATOM 0 HB2 PHE A 68 16.155 0.187 2.476 1.00 0.26 H new ATOM 0 HB3 PHE A 68 16.547 -1.389 3.134 1.00 0.26 H new ATOM 0 HD1 PHE A 68 13.748 -0.409 0.855 1.00 0.38 H new ATOM 0 HD2 PHE A 68 17.356 -2.629 1.311 1.00 0.35 H new ATOM 0 HE1 PHE A 68 13.411 -1.407 -1.361 1.00 0.44 H new ATOM 0 HE2 PHE A 68 17.020 -3.626 -0.909 1.00 0.37 H new ATOM 0 HZ PHE A 68 15.048 -3.015 -2.249 1.00 0.37 H new ATOM 1026 N CYS A 69 14.911 -2.847 4.677 1.00 0.26 N ATOM 1027 CA CYS A 69 14.628 -4.208 5.113 1.00 0.28 C ATOM 1028 C CYS A 69 13.215 -4.284 5.657 1.00 0.29 C ATOM 1029 O CYS A 69 12.533 -5.297 5.511 1.00 0.34 O ATOM 1030 CB CYS A 69 15.610 -4.652 6.194 1.00 0.27 C ATOM 1031 SG CYS A 69 15.866 -6.438 6.275 1.00 0.49 S ATOM 0 H CYS A 69 15.761 -2.444 5.072 1.00 0.26 H new ATOM 0 HA CYS A 69 14.734 -4.871 4.255 1.00 0.28 H new ATOM 0 HB2 CYS A 69 16.570 -4.166 6.018 1.00 0.27 H new ATOM 0 HB3 CYS A 69 15.249 -4.304 7.162 1.00 0.27 H new ATOM 0 HG CYS A 69 16.550 -6.826 5.240 1.00 0.49 H new ATOM 1037 N GLY A 70 12.790 -3.201 6.297 1.00 0.31 N ATOM 1038 CA GLY A 70 11.457 -3.143 6.846 1.00 0.34 C ATOM 1039 C GLY A 70 10.419 -3.368 5.778 1.00 0.35 C ATOM 1040 O GLY A 70 9.540 -4.219 5.919 1.00 0.35 O ATOM 0 H GLY A 70 13.350 -2.361 6.444 1.00 0.31 H new ATOM 0 HA2 GLY A 70 11.349 -3.896 7.626 1.00 0.34 H new ATOM 0 HA3 GLY A 70 11.296 -2.172 7.315 1.00 0.34 H new ATOM 1044 N ILE A 71 10.537 -2.611 4.698 1.00 0.38 N ATOM 1045 CA ILE A 71 9.617 -2.734 3.585 1.00 0.41 C ATOM 1046 C ILE A 71 9.780 -4.073 2.898 1.00 0.41 C ATOM 1047 O ILE A 71 8.815 -4.643 2.388 1.00 0.45 O ATOM 1048 CB ILE A 71 9.842 -1.631 2.549 1.00 0.43 C ATOM 1049 CG1 ILE A 71 9.646 -0.264 3.203 1.00 0.46 C ATOM 1050 CG2 ILE A 71 8.902 -1.839 1.371 1.00 0.47 C ATOM 1051 CD1 ILE A 71 9.844 0.902 2.256 1.00 0.49 C ATOM 0 H ILE A 71 11.262 -1.905 4.571 1.00 0.38 H new ATOM 0 HA ILE A 71 8.611 -2.645 3.995 1.00 0.41 H new ATOM 0 HB ILE A 71 10.863 -1.673 2.171 1.00 0.43 H new ATOM 0 HG12 ILE A 71 8.641 -0.213 3.622 1.00 0.46 H new ATOM 0 HG13 ILE A 71 10.343 -0.167 4.035 1.00 0.46 H new ATOM 0 HG21 ILE A 71 9.063 -1.053 0.634 1.00 0.47 H new ATOM 0 HG22 ILE A 71 9.099 -2.809 0.915 1.00 0.47 H new ATOM 0 HG23 ILE A 71 7.870 -1.804 1.719 1.00 0.47 H new ATOM 0 HD11 ILE A 71 9.688 1.838 2.793 1.00 0.49 H new ATOM 0 HD12 ILE A 71 10.858 0.878 1.856 1.00 0.49 H new ATOM 0 HD13 ILE A 71 9.129 0.831 1.437 1.00 0.49 H new ATOM 1063 N MET A 72 11.006 -4.575 2.890 1.00 0.39 N ATOM 1064 CA MET A 72 11.279 -5.845 2.256 1.00 0.41 C ATOM 1065 C MET A 72 10.437 -6.897 2.934 1.00 0.42 C ATOM 1066 O MET A 72 9.706 -7.632 2.291 1.00 0.50 O ATOM 1067 CB MET A 72 12.760 -6.214 2.363 1.00 0.41 C ATOM 1068 CG MET A 72 13.694 -5.248 1.651 1.00 0.45 C ATOM 1069 SD MET A 72 13.478 -5.260 -0.137 1.00 0.78 S ATOM 1070 CE MET A 72 13.847 -6.970 -0.512 1.00 0.36 C ATOM 0 H MET A 72 11.817 -4.123 3.313 1.00 0.39 H new ATOM 0 HA MET A 72 11.035 -5.779 1.196 1.00 0.41 H new ATOM 0 HB2 MET A 72 13.037 -6.260 3.416 1.00 0.41 H new ATOM 0 HB3 MET A 72 12.905 -7.213 1.951 1.00 0.41 H new ATOM 0 HG2 MET A 72 13.522 -4.239 2.027 1.00 0.45 H new ATOM 0 HG3 MET A 72 14.726 -5.505 1.890 1.00 0.45 H new ATOM 0 HE1 MET A 72 14.339 -7.032 -1.483 1.00 0.36 H new ATOM 0 HE2 MET A 72 14.506 -7.377 0.255 1.00 0.36 H new ATOM 0 HE3 MET A 72 12.921 -7.545 -0.537 1.00 0.36 H new ATOM 1080 N ALA A 73 10.537 -6.920 4.254 1.00 0.41 N ATOM 1081 CA ALA A 73 9.792 -7.847 5.083 1.00 0.44 C ATOM 1082 C ALA A 73 8.311 -7.840 4.718 1.00 0.45 C ATOM 1083 O ALA A 73 7.697 -8.894 4.544 1.00 0.51 O ATOM 1084 CB ALA A 73 9.986 -7.455 6.535 1.00 0.46 C ATOM 0 H ALA A 73 11.142 -6.291 4.781 1.00 0.41 H new ATOM 0 HA ALA A 73 10.161 -8.859 4.919 1.00 0.44 H new ATOM 0 HB1 ALA A 73 9.432 -8.142 7.175 1.00 0.46 H new ATOM 0 HB2 ALA A 73 11.046 -7.500 6.786 1.00 0.46 H new ATOM 0 HB3 ALA A 73 9.620 -6.440 6.690 1.00 0.46 H new ATOM 1090 N LYS A 74 7.745 -6.642 4.604 1.00 0.42 N ATOM 1091 CA LYS A 74 6.335 -6.490 4.254 1.00 0.46 C ATOM 1092 C LYS A 74 6.036 -7.189 2.936 1.00 0.47 C ATOM 1093 O LYS A 74 5.147 -8.035 2.859 1.00 0.57 O ATOM 1094 CB LYS A 74 5.967 -5.008 4.141 1.00 0.50 C ATOM 1095 CG LYS A 74 6.711 -4.120 5.117 1.00 1.17 C ATOM 1096 CD LYS A 74 6.058 -2.756 5.261 1.00 1.08 C ATOM 1097 CE LYS A 74 5.936 -2.038 3.924 1.00 1.83 C ATOM 1098 NZ LYS A 74 5.382 -0.665 4.080 1.00 2.52 N ATOM 0 H LYS A 74 8.240 -5.762 4.749 1.00 0.42 H new ATOM 0 HA LYS A 74 5.739 -6.946 5.044 1.00 0.46 H new ATOM 0 HB2 LYS A 74 6.172 -4.668 3.126 1.00 0.50 H new ATOM 0 HB3 LYS A 74 4.895 -4.895 4.305 1.00 0.50 H new ATOM 0 HG2 LYS A 74 6.751 -4.607 6.091 1.00 1.17 H new ATOM 0 HG3 LYS A 74 7.740 -3.995 4.781 1.00 1.17 H new ATOM 0 HD2 LYS A 74 5.068 -2.873 5.701 1.00 1.08 H new ATOM 0 HD3 LYS A 74 6.643 -2.145 5.949 1.00 1.08 H new ATOM 0 HE2 LYS A 74 6.916 -1.982 3.451 1.00 1.83 H new ATOM 0 HE3 LYS A 74 5.294 -2.615 3.259 1.00 1.83 H new ATOM 0 HZ1 LYS A 74 5.315 -0.210 3.147 1.00 2.52 H new ATOM 0 HZ2 LYS A 74 4.436 -0.719 4.508 1.00 2.52 H new ATOM 0 HZ3 LYS A 74 6.008 -0.106 4.694 1.00 2.52 H new ATOM 1112 N GLN A 75 6.780 -6.825 1.897 1.00 0.45 N ATOM 1113 CA GLN A 75 6.591 -7.429 0.580 1.00 0.50 C ATOM 1114 C GLN A 75 6.876 -8.930 0.604 1.00 0.52 C ATOM 1115 O GLN A 75 6.265 -9.693 -0.146 1.00 0.67 O ATOM 1116 CB GLN A 75 7.476 -6.737 -0.456 1.00 0.50 C ATOM 1117 CG GLN A 75 7.239 -5.239 -0.545 1.00 0.76 C ATOM 1118 CD GLN A 75 7.761 -4.643 -1.836 1.00 0.66 C ATOM 1119 OE1 GLN A 75 7.776 -5.303 -2.873 1.00 1.60 O ATOM 1120 NE2 GLN A 75 8.191 -3.388 -1.777 1.00 0.86 N ATOM 0 H GLN A 75 7.515 -6.119 1.939 1.00 0.45 H new ATOM 0 HA GLN A 75 5.546 -7.293 0.301 1.00 0.50 H new ATOM 0 HB2 GLN A 75 8.522 -6.918 -0.209 1.00 0.50 H new ATOM 0 HB3 GLN A 75 7.297 -7.185 -1.434 1.00 0.50 H new ATOM 0 HG2 GLN A 75 6.171 -5.038 -0.462 1.00 0.76 H new ATOM 0 HG3 GLN A 75 7.722 -4.748 0.299 1.00 0.76 H new ATOM 0 HE21 GLN A 75 8.159 -2.879 -0.894 1.00 0.86 H new ATOM 0 HE22 GLN A 75 8.553 -2.933 -2.615 1.00 0.86 H new ATOM 1129 N MET A 76 7.806 -9.354 1.459 1.00 0.55 N ATOM 1130 CA MET A 76 8.143 -10.768 1.580 1.00 0.66 C ATOM 1131 C MET A 76 6.896 -11.537 1.986 1.00 0.71 C ATOM 1132 O MET A 76 6.708 -12.698 1.623 1.00 0.83 O ATOM 1133 CB MET A 76 9.250 -10.983 2.619 1.00 0.87 C ATOM 1134 CG MET A 76 10.584 -10.352 2.246 1.00 1.02 C ATOM 1135 SD MET A 76 11.626 -11.431 1.248 1.00 1.03 S ATOM 1136 CE MET A 76 13.159 -10.499 1.239 1.00 0.64 C ATOM 0 H MET A 76 8.337 -8.739 2.076 1.00 0.55 H new ATOM 0 HA MET A 76 8.510 -11.129 0.619 1.00 0.66 H new ATOM 0 HB2 MET A 76 8.921 -10.574 3.574 1.00 0.87 H new ATOM 0 HB3 MET A 76 9.395 -12.054 2.764 1.00 0.87 H new ATOM 0 HG2 MET A 76 10.401 -9.427 1.699 1.00 1.02 H new ATOM 0 HG3 MET A 76 11.118 -10.083 3.157 1.00 1.02 H new ATOM 0 HE1 MET A 76 13.519 -10.401 0.215 1.00 0.64 H new ATOM 0 HE2 MET A 76 12.985 -9.508 1.659 1.00 0.64 H new ATOM 0 HE3 MET A 76 13.906 -11.021 1.837 1.00 0.64 H new ATOM 1146 N ARG A 77 6.049 -10.857 2.752 1.00 0.72 N ATOM 1147 CA ARG A 77 4.793 -11.421 3.222 1.00 0.89 C ATOM 1148 C ARG A 77 3.741 -11.360 2.117 1.00 1.01 C ATOM 1149 O ARG A 77 3.157 -12.379 1.746 1.00 1.33 O ATOM 1150 CB ARG A 77 4.322 -10.645 4.459 1.00 1.00 C ATOM 1151 CG ARG A 77 2.832 -10.751 4.739 1.00 1.14 C ATOM 1152 CD ARG A 77 2.449 -12.135 5.238 1.00 1.55 C ATOM 1153 NE ARG A 77 3.044 -12.432 6.538 1.00 2.06 N ATOM 1154 CZ ARG A 77 2.600 -13.385 7.352 1.00 2.78 C ATOM 1155 NH1 ARG A 77 1.566 -14.137 6.998 1.00 3.07 N ATOM 1156 NH2 ARG A 77 3.192 -13.589 8.521 1.00 3.66 N ATOM 0 H ARG A 77 6.216 -9.900 3.063 1.00 0.72 H new ATOM 0 HA ARG A 77 4.942 -12.467 3.491 1.00 0.89 H new ATOM 0 HB2 ARG A 77 4.869 -11.007 5.330 1.00 1.00 H new ATOM 0 HB3 ARG A 77 4.582 -9.594 4.334 1.00 1.00 H new ATOM 0 HG2 ARG A 77 2.548 -10.005 5.481 1.00 1.14 H new ATOM 0 HG3 ARG A 77 2.274 -10.525 3.830 1.00 1.14 H new ATOM 0 HD2 ARG A 77 1.364 -12.206 5.311 1.00 1.55 H new ATOM 0 HD3 ARG A 77 2.770 -12.883 4.513 1.00 1.55 H new ATOM 0 HE ARG A 77 3.845 -11.877 6.839 1.00 2.06 H new ATOM 0 HH11 ARG A 77 1.109 -13.985 6.099 1.00 3.07 H new ATOM 0 HH12 ARG A 77 1.228 -14.867 7.625 1.00 3.07 H new ATOM 0 HH21 ARG A 77 3.989 -13.015 8.796 1.00 3.66 H new ATOM 0 HH22 ARG A 77 2.851 -14.320 9.145 1.00 3.66 H new ATOM 1170 N GLU A 78 3.515 -10.156 1.593 1.00 0.98 N ATOM 1171 CA GLU A 78 2.543 -9.945 0.524 1.00 1.32 C ATOM 1172 C GLU A 78 2.557 -8.488 0.065 1.00 1.57 C ATOM 1173 O GLU A 78 3.219 -8.145 -0.914 1.00 2.39 O ATOM 1174 CB GLU A 78 1.139 -10.333 0.994 1.00 1.93 C ATOM 1175 CG GLU A 78 0.117 -10.402 -0.129 1.00 2.70 C ATOM 1176 CD GLU A 78 -1.259 -10.808 0.362 1.00 3.57 C ATOM 1177 OE1 GLU A 78 -2.038 -9.913 0.753 1.00 4.06 O ATOM 1178 OE2 GLU A 78 -1.558 -12.021 0.356 1.00 4.10 O ATOM 0 H GLU A 78 3.995 -9.308 1.894 1.00 0.98 H new ATOM 0 HA GLU A 78 2.820 -10.579 -0.319 1.00 1.32 H new ATOM 0 HB2 GLU A 78 1.186 -11.302 1.490 1.00 1.93 H new ATOM 0 HB3 GLU A 78 0.801 -9.610 1.737 1.00 1.93 H new ATOM 0 HG2 GLU A 78 0.053 -9.430 -0.617 1.00 2.70 H new ATOM 0 HG3 GLU A 78 0.456 -11.115 -0.881 1.00 2.70 H new ATOM 1185 N THR A 79 1.827 -7.639 0.786 1.00 1.76 N ATOM 1186 CA THR A 79 1.753 -6.213 0.469 1.00 2.69 C ATOM 1187 C THR A 79 1.267 -5.975 -0.959 1.00 2.91 C ATOM 1188 O THR A 79 2.030 -6.105 -1.917 1.00 3.44 O ATOM 1189 CB THR A 79 3.119 -5.526 0.656 1.00 3.44 C ATOM 1190 OG1 THR A 79 3.613 -5.769 1.979 1.00 4.01 O ATOM 1191 CG2 THR A 79 3.012 -4.027 0.419 1.00 4.21 C ATOM 0 H THR A 79 1.275 -7.916 1.598 1.00 1.76 H new ATOM 0 HA THR A 79 1.033 -5.779 1.163 1.00 2.69 H new ATOM 0 HB THR A 79 3.811 -5.944 -0.075 1.00 3.44 H new ATOM 0 HG1 THR A 79 3.888 -4.921 2.387 1.00 4.01 H new ATOM 0 HG21 THR A 79 3.990 -3.566 0.557 1.00 4.21 H new ATOM 0 HG22 THR A 79 2.665 -3.843 -0.598 1.00 4.21 H new ATOM 0 HG23 THR A 79 2.304 -3.596 1.127 1.00 4.21 H new ATOM 1199 N ASP A 80 -0.007 -5.616 -1.093 1.00 3.08 N ATOM 1200 CA ASP A 80 -0.593 -5.350 -2.403 1.00 3.79 C ATOM 1201 C ASP A 80 -1.811 -4.447 -2.278 1.00 4.66 C ATOM 1202 O ASP A 80 -2.476 -4.142 -3.268 1.00 5.42 O ATOM 1203 CB ASP A 80 -0.979 -6.658 -3.096 1.00 4.27 C ATOM 1204 CG ASP A 80 -2.057 -7.416 -2.345 1.00 4.67 C ATOM 1205 OD1 ASP A 80 -3.251 -7.148 -2.591 1.00 5.14 O ATOM 1206 OD2 ASP A 80 -1.706 -8.276 -1.511 1.00 4.80 O ATOM 0 H ASP A 80 -0.652 -5.503 -0.311 1.00 3.08 H new ATOM 0 HA ASP A 80 0.156 -4.840 -3.009 1.00 3.79 H new ATOM 0 HB2 ASP A 80 -1.328 -6.441 -4.106 1.00 4.27 H new ATOM 0 HB3 ASP A 80 -0.095 -7.289 -3.192 1.00 4.27 H new ATOM 1211 N THR A 81 -2.093 -4.021 -1.054 1.00 4.85 N ATOM 1212 CA THR A 81 -3.228 -3.151 -0.785 1.00 5.90 C ATOM 1213 C THR A 81 -3.028 -2.415 0.539 1.00 6.28 C ATOM 1214 O THR A 81 -3.782 -2.601 1.495 1.00 7.09 O ATOM 1215 CB THR A 81 -4.544 -3.951 -0.745 1.00 6.58 C ATOM 1216 OG1 THR A 81 -4.690 -4.713 -1.950 1.00 7.04 O ATOM 1217 CG2 THR A 81 -5.745 -3.030 -0.582 1.00 7.08 C ATOM 0 H THR A 81 -1.547 -4.266 -0.228 1.00 4.85 H new ATOM 0 HA THR A 81 -3.293 -2.424 -1.595 1.00 5.90 H new ATOM 0 HB THR A 81 -4.503 -4.621 0.114 1.00 6.58 H new ATOM 0 HG1 THR A 81 -4.152 -4.307 -2.661 1.00 7.04 H new ATOM 0 HG21 THR A 81 -6.658 -3.624 -0.557 1.00 7.08 H new ATOM 0 HG22 THR A 81 -5.651 -2.470 0.349 1.00 7.08 H new ATOM 0 HG23 THR A 81 -5.787 -2.335 -1.421 1.00 7.08 H new ATOM 1225 N GLU A 82 -1.991 -1.587 0.583 1.00 5.98 N ATOM 1226 CA GLU A 82 -1.667 -0.817 1.779 1.00 6.71 C ATOM 1227 C GLU A 82 -2.755 0.211 2.086 1.00 7.44 C ATOM 1228 O GLU A 82 -2.932 0.617 3.236 1.00 8.25 O ATOM 1229 CB GLU A 82 -0.318 -0.117 1.596 1.00 6.70 C ATOM 1230 CG GLU A 82 0.138 0.665 2.817 1.00 7.23 C ATOM 1231 CD GLU A 82 1.448 1.392 2.585 1.00 7.93 C ATOM 1232 OE1 GLU A 82 1.412 2.529 2.072 1.00 8.16 O ATOM 1233 OE2 GLU A 82 2.510 0.823 2.914 1.00 8.46 O ATOM 0 H GLU A 82 -1.357 -1.431 -0.200 1.00 5.98 H new ATOM 0 HA GLU A 82 -1.607 -1.505 2.622 1.00 6.71 H new ATOM 0 HB2 GLU A 82 0.438 -0.863 1.351 1.00 6.70 H new ATOM 0 HB3 GLU A 82 -0.384 0.561 0.745 1.00 6.70 H new ATOM 0 HG2 GLU A 82 -0.631 1.387 3.090 1.00 7.23 H new ATOM 0 HG3 GLU A 82 0.249 -0.017 3.660 1.00 7.23 H new ATOM 1240 N GLU A 83 -3.481 0.628 1.053 1.00 7.37 N ATOM 1241 CA GLU A 83 -4.550 1.607 1.219 1.00 8.31 C ATOM 1242 C GLU A 83 -5.601 1.102 2.203 1.00 8.90 C ATOM 1243 O GLU A 83 -6.100 1.859 3.039 1.00 9.79 O ATOM 1244 CB GLU A 83 -5.200 1.920 -0.132 1.00 8.42 C ATOM 1245 CG GLU A 83 -5.721 0.692 -0.859 1.00 8.14 C ATOM 1246 CD GLU A 83 -6.393 1.036 -2.173 1.00 8.51 C ATOM 1247 OE1 GLU A 83 -7.610 1.318 -2.163 1.00 9.06 O ATOM 1248 OE2 GLU A 83 -5.703 1.023 -3.215 1.00 8.45 O ATOM 0 H GLU A 83 -3.349 0.304 0.095 1.00 7.37 H new ATOM 0 HA GLU A 83 -4.114 2.521 1.621 1.00 8.31 H new ATOM 0 HB2 GLU A 83 -6.024 2.616 0.024 1.00 8.42 H new ATOM 0 HB3 GLU A 83 -4.472 2.425 -0.767 1.00 8.42 H new ATOM 0 HG2 GLU A 83 -4.894 0.007 -1.046 1.00 8.14 H new ATOM 0 HG3 GLU A 83 -6.430 0.168 -0.218 1.00 8.14 H new ATOM 1255 N GLU A 84 -5.929 -0.182 2.101 1.00 8.58 N ATOM 1256 CA GLU A 84 -6.914 -0.793 2.984 1.00 9.37 C ATOM 1257 C GLU A 84 -6.414 -0.798 4.424 1.00 9.77 C ATOM 1258 O GLU A 84 -7.201 -0.755 5.370 1.00 10.65 O ATOM 1259 CB GLU A 84 -7.215 -2.222 2.528 1.00 9.24 C ATOM 1260 CG GLU A 84 -8.215 -2.949 3.410 1.00 9.88 C ATOM 1261 CD GLU A 84 -8.458 -4.377 2.961 1.00 10.30 C ATOM 1262 OE1 GLU A 84 -7.660 -5.262 3.337 1.00 10.41 O ATOM 1263 OE2 GLU A 84 -9.444 -4.610 2.231 1.00 10.72 O ATOM 0 H GLU A 84 -5.526 -0.820 1.414 1.00 8.58 H new ATOM 0 HA GLU A 84 -7.831 -0.205 2.938 1.00 9.37 H new ATOM 0 HB2 GLU A 84 -7.597 -2.195 1.508 1.00 9.24 H new ATOM 0 HB3 GLU A 84 -6.285 -2.790 2.505 1.00 9.24 H new ATOM 0 HG2 GLU A 84 -7.853 -2.952 4.438 1.00 9.88 H new ATOM 0 HG3 GLU A 84 -9.160 -2.405 3.407 1.00 9.88 H new ATOM 1270 N MET A 85 -5.095 -0.841 4.580 1.00 9.28 N ATOM 1271 CA MET A 85 -4.481 -0.852 5.900 1.00 9.90 C ATOM 1272 C MET A 85 -4.700 0.485 6.594 1.00 10.59 C ATOM 1273 O MET A 85 -4.954 0.538 7.797 1.00 11.45 O ATOM 1274 CB MET A 85 -2.988 -1.159 5.788 1.00 9.48 C ATOM 1275 CG MET A 85 -2.697 -2.472 5.077 1.00 8.93 C ATOM 1276 SD MET A 85 -0.940 -2.717 4.751 1.00 8.96 S ATOM 1277 CE MET A 85 -0.275 -2.654 6.411 1.00 9.60 C ATOM 0 H MET A 85 -4.431 -0.869 3.806 1.00 9.28 H new ATOM 0 HA MET A 85 -4.950 -1.633 6.498 1.00 9.90 H new ATOM 0 HB2 MET A 85 -2.496 -0.347 5.253 1.00 9.48 H new ATOM 0 HB3 MET A 85 -2.554 -1.191 6.788 1.00 9.48 H new ATOM 0 HG2 MET A 85 -3.068 -3.298 5.684 1.00 8.93 H new ATOM 0 HG3 MET A 85 -3.244 -2.498 4.134 1.00 8.93 H new ATOM 0 HE1 MET A 85 0.741 -3.048 6.411 1.00 9.60 H new ATOM 0 HE2 MET A 85 -0.264 -1.621 6.759 1.00 9.60 H new ATOM 0 HE3 MET A 85 -0.897 -3.254 7.075 1.00 9.60 H new ATOM 1287 N ARG A 86 -4.600 1.567 5.824 1.00 10.35 N ATOM 1288 CA ARG A 86 -4.808 2.902 6.365 1.00 11.19 C ATOM 1289 C ARG A 86 -6.241 3.049 6.864 1.00 11.96 C ATOM 1290 O ARG A 86 -6.479 3.551 7.963 1.00 12.88 O ATOM 1291 CB ARG A 86 -4.515 3.963 5.314 1.00 10.99 C ATOM 1292 CG ARG A 86 -4.176 5.305 5.925 1.00 11.99 C ATOM 1293 CD ARG A 86 -4.050 6.380 4.869 1.00 12.13 C ATOM 1294 NE ARG A 86 -5.286 6.550 4.109 1.00 12.84 N ATOM 1295 CZ ARG A 86 -5.428 7.422 3.114 1.00 13.32 C ATOM 1296 NH1 ARG A 86 -4.415 8.200 2.758 1.00 13.18 N ATOM 1297 NH2 ARG A 86 -6.586 7.512 2.472 1.00 14.09 N ATOM 0 H ARG A 86 -4.377 1.543 4.829 1.00 10.35 H new ATOM 0 HA ARG A 86 -4.121 3.042 7.200 1.00 11.19 H new ATOM 0 HB2 ARG A 86 -3.685 3.632 4.689 1.00 10.99 H new ATOM 0 HB3 ARG A 86 -5.381 4.073 4.662 1.00 10.99 H new ATOM 0 HG2 ARG A 86 -4.949 5.586 6.641 1.00 11.99 H new ATOM 0 HG3 ARG A 86 -3.241 5.227 6.480 1.00 11.99 H new ATOM 0 HD2 ARG A 86 -3.784 7.324 5.343 1.00 12.13 H new ATOM 0 HD3 ARG A 86 -3.238 6.125 4.188 1.00 12.13 H new ATOM 0 HE ARG A 86 -6.086 5.967 4.355 1.00 12.84 H new ATOM 0 HH11 ARG A 86 -3.523 8.131 3.247 1.00 13.18 H new ATOM 0 HH12 ARG A 86 -4.528 8.867 1.995 1.00 13.18 H new ATOM 0 HH21 ARG A 86 -7.366 6.913 2.741 1.00 14.09 H new ATOM 0 HH22 ARG A 86 -6.696 8.180 1.709 1.00 14.09 H new ATOM 1311 N GLU A 87 -7.192 2.606 6.043 1.00 11.71 N ATOM 1312 CA GLU A 87 -8.603 2.670 6.401 1.00 12.58 C ATOM 1313 C GLU A 87 -8.842 1.963 7.729 1.00 13.20 C ATOM 1314 O GLU A 87 -9.673 2.388 8.531 1.00 14.14 O ATOM 1315 CB GLU A 87 -9.459 2.033 5.305 1.00 12.36 C ATOM 1316 CG GLU A 87 -9.351 2.734 3.962 1.00 12.89 C ATOM 1317 CD GLU A 87 -10.146 2.038 2.875 1.00 13.23 C ATOM 1318 OE1 GLU A 87 -11.349 2.339 2.733 1.00 13.47 O ATOM 1319 OE2 GLU A 87 -9.564 1.189 2.165 1.00 13.40 O ATOM 0 H GLU A 87 -7.008 2.199 5.126 1.00 11.71 H new ATOM 0 HA GLU A 87 -8.888 3.717 6.503 1.00 12.58 H new ATOM 0 HB2 GLU A 87 -9.164 0.990 5.186 1.00 12.36 H new ATOM 0 HB3 GLU A 87 -10.502 2.035 5.623 1.00 12.36 H new ATOM 0 HG2 GLU A 87 -9.703 3.761 4.063 1.00 12.89 H new ATOM 0 HG3 GLU A 87 -8.303 2.784 3.665 1.00 12.89 H new ATOM 1326 N ALA A 88 -8.107 0.877 7.952 1.00 12.78 N ATOM 1327 CA ALA A 88 -8.224 0.118 9.190 1.00 13.49 C ATOM 1328 C ALA A 88 -7.731 0.948 10.371 1.00 14.13 C ATOM 1329 O ALA A 88 -8.288 0.882 11.467 1.00 15.06 O ATOM 1330 CB ALA A 88 -7.444 -1.183 9.089 1.00 13.06 C ATOM 0 H ALA A 88 -7.425 0.504 7.291 1.00 12.78 H new ATOM 0 HA ALA A 88 -9.275 -0.122 9.353 1.00 13.49 H new ATOM 0 HB1 ALA A 88 -7.541 -1.739 10.022 1.00 13.06 H new ATOM 0 HB2 ALA A 88 -7.839 -1.781 8.267 1.00 13.06 H new ATOM 0 HB3 ALA A 88 -6.392 -0.963 8.905 1.00 13.06 H new ATOM 1336 N PHE A 89 -6.684 1.735 10.131 1.00 13.73 N ATOM 1337 CA PHE A 89 -6.114 2.596 11.162 1.00 14.46 C ATOM 1338 C PHE A 89 -7.082 3.728 11.482 1.00 15.32 C ATOM 1339 O PHE A 89 -7.029 4.335 12.551 1.00 16.24 O ATOM 1340 CB PHE A 89 -4.770 3.163 10.690 1.00 14.00 C ATOM 1341 CG PHE A 89 -4.326 4.390 11.437 1.00 14.89 C ATOM 1342 CD1 PHE A 89 -3.804 4.290 12.717 1.00 15.30 C ATOM 1343 CD2 PHE A 89 -4.437 5.643 10.857 1.00 15.46 C ATOM 1344 CE1 PHE A 89 -3.400 5.420 13.404 1.00 16.22 C ATOM 1345 CE2 PHE A 89 -4.035 6.776 11.539 1.00 16.38 C ATOM 1346 CZ PHE A 89 -3.515 6.664 12.813 1.00 16.75 C ATOM 0 H PHE A 89 -6.213 1.793 9.228 1.00 13.73 H new ATOM 0 HA PHE A 89 -5.946 2.009 12.065 1.00 14.46 H new ATOM 0 HB2 PHE A 89 -4.006 2.392 10.792 1.00 14.00 H new ATOM 0 HB3 PHE A 89 -4.841 3.402 9.629 1.00 14.00 H new ATOM 0 HD1 PHE A 89 -3.712 3.320 13.183 1.00 15.30 H new ATOM 0 HD2 PHE A 89 -4.842 5.736 9.860 1.00 15.46 H new ATOM 0 HE1 PHE A 89 -2.995 5.331 14.401 1.00 16.22 H new ATOM 0 HE2 PHE A 89 -4.128 7.747 11.076 1.00 16.38 H new ATOM 0 HZ PHE A 89 -3.198 7.548 13.347 1.00 16.75 H new ATOM 1356 N LYS A 90 -7.973 3.986 10.538 1.00 15.11 N ATOM 1357 CA LYS A 90 -8.965 5.020 10.662 1.00 16.01 C ATOM 1358 C LYS A 90 -10.119 4.535 11.530 1.00 16.75 C ATOM 1359 O LYS A 90 -10.583 5.240 12.425 1.00 17.70 O ATOM 1360 CB LYS A 90 -9.432 5.358 9.265 1.00 15.74 C ATOM 1361 CG LYS A 90 -10.911 5.351 9.146 1.00 15.19 C ATOM 1362 CD LYS A 90 -11.364 5.791 7.768 1.00 15.14 C ATOM 1363 CE LYS A 90 -12.155 4.698 7.069 1.00 14.45 C ATOM 1364 NZ LYS A 90 -13.356 4.294 7.850 1.00 14.90 N ATOM 0 H LYS A 90 -8.021 3.473 9.658 1.00 15.11 H new ATOM 0 HA LYS A 90 -8.554 5.908 11.143 1.00 16.01 H new ATOM 0 HB2 LYS A 90 -9.052 6.341 8.986 1.00 15.74 H new ATOM 0 HB3 LYS A 90 -9.010 4.641 8.560 1.00 15.74 H new ATOM 0 HG2 LYS A 90 -11.288 4.349 9.350 1.00 15.19 H new ATOM 0 HG3 LYS A 90 -11.340 6.013 9.899 1.00 15.19 H new ATOM 0 HD2 LYS A 90 -11.978 6.688 7.854 1.00 15.14 H new ATOM 0 HD3 LYS A 90 -10.495 6.056 7.165 1.00 15.14 H new ATOM 0 HE2 LYS A 90 -12.464 5.047 6.084 1.00 14.45 H new ATOM 0 HE3 LYS A 90 -11.515 3.830 6.913 1.00 14.45 H new ATOM 0 HZ1 LYS A 90 -14.175 4.220 7.214 1.00 14.90 H new ATOM 0 HZ2 LYS A 90 -13.183 3.373 8.301 1.00 14.90 H new ATOM 0 HZ3 LYS A 90 -13.550 5.007 8.582 1.00 14.90 H new ATOM 1378 N ILE A 91 -10.574 3.323 11.245 1.00 16.40 N ATOM 1379 CA ILE A 91 -11.671 2.722 11.989 1.00 17.17 C ATOM 1380 C ILE A 91 -11.353 2.641 13.481 1.00 17.84 C ATOM 1381 O ILE A 91 -12.196 2.960 14.321 1.00 18.78 O ATOM 1382 CB ILE A 91 -12.007 1.311 11.461 1.00 16.77 C ATOM 1383 CG1 ILE A 91 -12.430 1.383 9.992 1.00 16.16 C ATOM 1384 CG2 ILE A 91 -13.103 0.673 12.305 1.00 17.75 C ATOM 1385 CD1 ILE A 91 -12.639 0.026 9.350 1.00 16.20 C ATOM 0 H ILE A 91 -10.198 2.735 10.501 1.00 16.40 H new ATOM 0 HA ILE A 91 -12.538 3.367 11.845 1.00 17.17 H new ATOM 0 HB ILE A 91 -11.115 0.689 11.534 1.00 16.77 H new ATOM 0 HG12 ILE A 91 -13.354 1.957 9.917 1.00 16.16 H new ATOM 0 HG13 ILE A 91 -11.670 1.927 9.431 1.00 16.16 H new ATOM 0 HG21 ILE A 91 -13.327 -0.321 11.919 1.00 17.75 H new ATOM 0 HG22 ILE A 91 -12.766 0.593 13.339 1.00 17.75 H new ATOM 0 HG23 ILE A 91 -14.001 1.290 12.262 1.00 17.75 H new ATOM 0 HD11 ILE A 91 -12.937 0.158 8.310 1.00 16.20 H new ATOM 0 HD12 ILE A 91 -11.710 -0.543 9.392 1.00 16.20 H new ATOM 0 HD13 ILE A 91 -13.420 -0.514 9.886 1.00 16.20 H new ATOM 1397 N PHE A 92 -10.135 2.215 13.808 1.00 17.43 N ATOM 1398 CA PHE A 92 -9.718 2.095 15.203 1.00 18.14 C ATOM 1399 C PHE A 92 -9.447 3.466 15.817 1.00 18.80 C ATOM 1400 O PHE A 92 -9.352 3.599 17.038 1.00 19.63 O ATOM 1401 CB PHE A 92 -8.473 1.210 15.320 1.00 17.63 C ATOM 1402 CG PHE A 92 -8.752 -0.249 15.089 1.00 17.41 C ATOM 1403 CD1 PHE A 92 -9.550 -0.964 15.967 1.00 17.64 C ATOM 1404 CD2 PHE A 92 -8.210 -0.907 13.996 1.00 17.12 C ATOM 1405 CE1 PHE A 92 -9.803 -2.307 15.760 1.00 17.60 C ATOM 1406 CE2 PHE A 92 -8.459 -2.250 13.783 1.00 17.07 C ATOM 1407 CZ PHE A 92 -9.281 -2.944 14.656 1.00 17.34 C ATOM 0 H PHE A 92 -9.422 1.948 13.129 1.00 17.43 H new ATOM 0 HA PHE A 92 -10.534 1.629 15.755 1.00 18.14 H new ATOM 0 HB2 PHE A 92 -7.728 1.548 14.600 1.00 17.63 H new ATOM 0 HB3 PHE A 92 -8.039 1.336 16.312 1.00 17.63 H new ATOM 0 HD1 PHE A 92 -9.980 -0.466 16.824 1.00 17.64 H new ATOM 0 HD2 PHE A 92 -7.585 -0.364 13.302 1.00 17.12 H new ATOM 0 HE1 PHE A 92 -10.410 -2.857 16.464 1.00 17.60 H new ATOM 0 HE2 PHE A 92 -8.014 -2.756 12.939 1.00 17.07 H new ATOM 0 HZ PHE A 92 -9.512 -3.983 14.471 1.00 17.34 H new ATOM 1417 N ASP A 93 -9.324 4.481 14.968 1.00 18.51 N ATOM 1418 CA ASP A 93 -9.072 5.841 15.435 1.00 19.23 C ATOM 1419 C ASP A 93 -10.358 6.660 15.429 1.00 19.92 C ATOM 1420 O ASP A 93 -10.813 7.114 14.379 1.00 19.65 O ATOM 1421 CB ASP A 93 -8.015 6.519 14.560 1.00 18.69 C ATOM 1422 CG ASP A 93 -7.616 7.883 15.088 1.00 19.57 C ATOM 1423 OD1 ASP A 93 -7.671 8.085 16.320 1.00 20.02 O ATOM 1424 OD2 ASP A 93 -7.242 8.750 14.270 1.00 19.89 O ATOM 0 H ASP A 93 -9.394 4.389 13.955 1.00 18.51 H new ATOM 0 HA ASP A 93 -8.700 5.786 16.458 1.00 19.23 H new ATOM 0 HB2 ASP A 93 -7.132 5.882 14.502 1.00 18.69 H new ATOM 0 HB3 ASP A 93 -8.400 6.623 13.545 1.00 18.69 H new ATOM 1429 N ARG A 94 -10.937 6.843 16.611 1.00 20.90 N ATOM 1430 CA ARG A 94 -12.178 7.598 16.752 1.00 21.70 C ATOM 1431 C ARG A 94 -11.992 9.052 16.326 1.00 22.13 C ATOM 1432 O ARG A 94 -12.766 9.577 15.526 1.00 22.63 O ATOM 1433 CB ARG A 94 -12.671 7.544 18.199 1.00 22.67 C ATOM 1434 CG ARG A 94 -12.588 6.161 18.827 1.00 22.53 C ATOM 1435 CD ARG A 94 -13.467 5.154 18.101 1.00 22.13 C ATOM 1436 NE ARG A 94 -14.862 5.579 18.043 1.00 22.41 N ATOM 1437 CZ ARG A 94 -15.816 4.893 17.421 1.00 22.68 C ATOM 1438 NH1 ARG A 94 -15.525 3.757 16.803 1.00 22.72 N ATOM 1439 NH2 ARG A 94 -17.063 5.344 17.415 1.00 23.01 N ATOM 0 H ARG A 94 -10.566 6.478 17.488 1.00 20.90 H new ATOM 0 HA ARG A 94 -12.922 7.140 16.099 1.00 21.70 H new ATOM 0 HB2 ARG A 94 -12.085 8.240 18.799 1.00 22.67 H new ATOM 0 HB3 ARG A 94 -13.705 7.886 18.233 1.00 22.67 H new ATOM 0 HG2 ARG A 94 -11.554 5.817 18.812 1.00 22.53 H new ATOM 0 HG3 ARG A 94 -12.890 6.219 19.873 1.00 22.53 H new ATOM 0 HD2 ARG A 94 -13.091 5.010 17.088 1.00 22.13 H new ATOM 0 HD3 ARG A 94 -13.404 4.190 18.605 1.00 22.13 H new ATOM 0 HE ARG A 94 -15.119 6.451 18.505 1.00 22.41 H new ATOM 0 HH11 ARG A 94 -14.567 3.407 16.804 1.00 22.72 H new ATOM 0 HH12 ARG A 94 -16.259 3.233 16.327 1.00 22.72 H new ATOM 0 HH21 ARG A 94 -17.291 6.218 17.888 1.00 23.01 H new ATOM 0 HH22 ARG A 94 -17.794 4.817 16.937 1.00 23.01 H new ATOM 1453 N ASP A 95 -10.963 9.699 16.867 1.00 22.06 N ATOM 1454 CA ASP A 95 -10.684 11.095 16.544 1.00 22.57 C ATOM 1455 C ASP A 95 -9.879 11.208 15.255 1.00 21.80 C ATOM 1456 O ASP A 95 -9.392 10.211 14.723 1.00 20.81 O ATOM 1457 CB ASP A 95 -9.911 11.765 17.683 1.00 23.28 C ATOM 1458 CG ASP A 95 -10.220 11.159 19.036 1.00 23.89 C ATOM 1459 OD1 ASP A 95 -11.338 11.381 19.546 1.00 24.00 O ATOM 1460 OD2 ASP A 95 -9.341 10.462 19.585 1.00 24.34 O ATOM 0 H ASP A 95 -10.310 9.280 17.529 1.00 22.06 H new ATOM 0 HA ASP A 95 -11.640 11.600 16.408 1.00 22.57 H new ATOM 0 HB2 ASP A 95 -8.842 11.683 17.488 1.00 23.28 H new ATOM 0 HB3 ASP A 95 -10.150 12.828 17.703 1.00 23.28 H new ATOM 1465 N GLY A 96 -9.751 12.434 14.757 1.00 22.31 N ATOM 1466 CA GLY A 96 -8.997 12.672 13.541 1.00 21.77 C ATOM 1467 C GLY A 96 -7.604 13.202 13.825 1.00 21.93 C ATOM 1468 O GLY A 96 -6.871 13.563 12.905 1.00 21.68 O ATOM 0 H GLY A 96 -10.158 13.270 15.177 1.00 22.31 H new ATOM 0 HA2 GLY A 96 -8.922 11.744 12.974 1.00 21.77 H new ATOM 0 HA3 GLY A 96 -9.535 13.385 12.916 1.00 21.77 H new ATOM 1472 N ASP A 97 -7.247 13.254 15.108 1.00 22.44 N ATOM 1473 CA ASP A 97 -5.939 13.751 15.530 1.00 22.79 C ATOM 1474 C ASP A 97 -4.808 13.094 14.742 1.00 21.82 C ATOM 1475 O ASP A 97 -3.855 13.761 14.337 1.00 22.02 O ATOM 1476 CB ASP A 97 -5.739 13.514 17.030 1.00 23.40 C ATOM 1477 CG ASP A 97 -5.642 12.041 17.383 1.00 22.73 C ATOM 1478 OD1 ASP A 97 -6.679 11.346 17.333 1.00 22.66 O ATOM 1479 OD2 ASP A 97 -4.528 11.585 17.714 1.00 22.35 O ATOM 0 H ASP A 97 -7.849 12.956 15.876 1.00 22.44 H new ATOM 0 HA ASP A 97 -5.912 14.822 15.328 1.00 22.79 H new ATOM 0 HB2 ASP A 97 -4.831 14.022 17.356 1.00 23.40 H new ATOM 0 HB3 ASP A 97 -6.569 13.961 17.578 1.00 23.40 H new ATOM 1484 N GLY A 98 -4.917 11.787 14.527 1.00 20.85 N ATOM 1485 CA GLY A 98 -3.896 11.071 13.784 1.00 19.90 C ATOM 1486 C GLY A 98 -3.243 9.970 14.596 1.00 19.67 C ATOM 1487 O GLY A 98 -2.306 9.322 14.131 1.00 18.98 O ATOM 0 H GLY A 98 -5.693 11.211 14.854 1.00 20.85 H new ATOM 0 HA2 GLY A 98 -4.341 10.640 12.887 1.00 19.90 H new ATOM 0 HA3 GLY A 98 -3.132 11.775 13.454 1.00 19.90 H new ATOM 1491 N PHE A 99 -3.730 9.764 15.816 1.00 20.36 N ATOM 1492 CA PHE A 99 -3.191 8.727 16.686 1.00 20.37 C ATOM 1493 C PHE A 99 -4.313 8.046 17.466 1.00 20.60 C ATOM 1494 O PHE A 99 -5.379 8.629 17.678 1.00 21.08 O ATOM 1495 CB PHE A 99 -2.151 9.299 17.656 1.00 21.34 C ATOM 1496 CG PHE A 99 -1.156 10.226 17.014 1.00 21.51 C ATOM 1497 CD1 PHE A 99 -1.439 11.574 16.866 1.00 21.92 C ATOM 1498 CD2 PHE A 99 0.062 9.746 16.562 1.00 21.38 C ATOM 1499 CE1 PHE A 99 -0.524 12.427 16.277 1.00 22.21 C ATOM 1500 CE2 PHE A 99 0.980 10.594 15.973 1.00 21.65 C ATOM 1501 CZ PHE A 99 0.687 11.936 15.830 1.00 22.08 C ATOM 0 H PHE A 99 -4.496 10.301 16.223 1.00 20.36 H new ATOM 0 HA PHE A 99 -2.698 7.988 16.054 1.00 20.37 H new ATOM 0 HB2 PHE A 99 -2.668 9.834 18.452 1.00 21.34 H new ATOM 0 HB3 PHE A 99 -1.614 8.474 18.123 1.00 21.34 H new ATOM 0 HD1 PHE A 99 -2.384 11.963 17.214 1.00 21.92 H new ATOM 0 HD2 PHE A 99 0.297 8.697 16.671 1.00 21.38 H new ATOM 0 HE1 PHE A 99 -0.756 13.476 16.167 1.00 22.21 H new ATOM 0 HE2 PHE A 99 1.926 10.208 15.625 1.00 21.65 H new ATOM 0 HZ PHE A 99 1.403 12.600 15.370 1.00 22.08 H new ATOM 1511 N ILE A 100 -4.070 6.809 17.892 1.00 20.36 N ATOM 1512 CA ILE A 100 -5.065 6.051 18.638 1.00 20.66 C ATOM 1513 C ILE A 100 -4.606 5.791 20.069 1.00 21.62 C ATOM 1514 O ILE A 100 -3.418 5.596 20.327 1.00 21.77 O ATOM 1515 CB ILE A 100 -5.365 4.700 17.959 1.00 19.72 C ATOM 1516 CG1 ILE A 100 -5.631 4.905 16.467 1.00 18.71 C ATOM 1517 CG2 ILE A 100 -6.553 4.023 18.629 1.00 20.15 C ATOM 1518 CD1 ILE A 100 -5.828 3.614 15.699 1.00 17.74 C ATOM 0 H ILE A 100 -3.193 6.313 17.733 1.00 20.36 H new ATOM 0 HA ILE A 100 -5.972 6.656 18.655 1.00 20.66 H new ATOM 0 HB ILE A 100 -4.495 4.052 18.068 1.00 19.72 H new ATOM 0 HG12 ILE A 100 -6.518 5.527 16.348 1.00 18.71 H new ATOM 0 HG13 ILE A 100 -4.796 5.453 16.030 1.00 18.71 H new ATOM 0 HG21 ILE A 100 -6.753 3.070 18.139 1.00 20.15 H new ATOM 0 HG22 ILE A 100 -6.327 3.849 19.681 1.00 20.15 H new ATOM 0 HG23 ILE A 100 -7.431 4.664 18.547 1.00 20.15 H new ATOM 0 HD11 ILE A 100 -6.012 3.840 14.649 1.00 17.74 H new ATOM 0 HD12 ILE A 100 -4.933 2.998 15.787 1.00 17.74 H new ATOM 0 HD13 ILE A 100 -6.681 3.074 16.109 1.00 17.74 H new ATOM 1530 N SER A 101 -5.561 5.790 20.993 1.00 22.35 N ATOM 1531 CA SER A 101 -5.271 5.552 22.401 1.00 23.35 C ATOM 1532 C SER A 101 -5.923 4.253 22.867 1.00 23.43 C ATOM 1533 O SER A 101 -6.904 3.809 22.272 1.00 22.96 O ATOM 1534 CB SER A 101 -5.769 6.722 23.252 1.00 24.38 C ATOM 1535 OG SER A 101 -5.119 7.929 22.891 1.00 24.61 O ATOM 0 H SER A 101 -6.547 5.952 20.790 1.00 22.35 H new ATOM 0 HA SER A 101 -4.191 5.465 22.520 1.00 23.35 H new ATOM 0 HB2 SER A 101 -6.846 6.834 23.127 1.00 24.38 H new ATOM 0 HB3 SER A 101 -5.591 6.511 24.306 1.00 24.38 H new ATOM 0 HG SER A 101 -5.456 8.661 23.448 1.00 24.61 H new ATOM 1541 N PRO A 102 -5.390 3.617 23.928 1.00 24.11 N ATOM 1542 CA PRO A 102 -5.941 2.363 24.450 1.00 24.36 C ATOM 1543 C PRO A 102 -7.463 2.397 24.548 1.00 24.64 C ATOM 1544 O PRO A 102 -8.136 1.396 24.294 1.00 24.44 O ATOM 1545 CB PRO A 102 -5.312 2.260 25.838 1.00 25.42 C ATOM 1546 CG PRO A 102 -4.007 2.968 25.710 1.00 25.38 C ATOM 1547 CD PRO A 102 -4.223 4.073 24.709 1.00 24.81 C ATOM 0 HA PRO A 102 -5.721 1.514 23.803 1.00 24.36 H new ATOM 0 HB2 PRO A 102 -5.943 2.725 26.595 1.00 25.42 H new ATOM 0 HB3 PRO A 102 -5.172 1.220 26.134 1.00 25.42 H new ATOM 0 HG2 PRO A 102 -3.687 3.371 26.671 1.00 25.38 H new ATOM 0 HG3 PRO A 102 -3.226 2.286 25.374 1.00 25.38 H new ATOM 0 HD2 PRO A 102 -4.418 5.026 25.201 1.00 24.81 H new ATOM 0 HD3 PRO A 102 -3.348 4.215 24.075 1.00 24.81 H new ATOM 1555 N ALA A 103 -7.999 3.559 24.908 1.00 25.18 N ATOM 1556 CA ALA A 103 -9.442 3.735 25.040 1.00 25.58 C ATOM 1557 C ALA A 103 -10.146 3.539 23.703 1.00 24.70 C ATOM 1558 O ALA A 103 -11.091 2.759 23.592 1.00 24.78 O ATOM 1559 CB ALA A 103 -9.750 5.117 25.593 1.00 26.36 C ATOM 0 H ALA A 103 -7.454 4.396 25.114 1.00 25.18 H new ATOM 0 HA ALA A 103 -9.813 2.979 25.732 1.00 25.58 H new ATOM 0 HB1 ALA A 103 -10.829 5.239 25.688 1.00 26.36 H new ATOM 0 HB2 ALA A 103 -9.285 5.229 26.572 1.00 26.36 H new ATOM 0 HB3 ALA A 103 -9.357 5.876 24.916 1.00 26.36 H new ATOM 1565 N GLU A 104 -9.680 4.260 22.692 1.00 23.94 N ATOM 1566 CA GLU A 104 -10.255 4.181 21.356 1.00 23.10 C ATOM 1567 C GLU A 104 -10.066 2.791 20.752 1.00 22.34 C ATOM 1568 O GLU A 104 -10.950 2.271 20.071 1.00 22.06 O ATOM 1569 CB GLU A 104 -9.598 5.221 20.448 1.00 22.54 C ATOM 1570 CG GLU A 104 -9.818 6.657 20.893 1.00 23.20 C ATOM 1571 CD GLU A 104 -9.062 7.651 20.032 1.00 22.77 C ATOM 1572 OE1 GLU A 104 -9.495 7.896 18.886 1.00 22.70 O ATOM 1573 OE2 GLU A 104 -8.035 8.185 20.501 1.00 22.57 O ATOM 0 H GLU A 104 -8.899 4.911 22.773 1.00 23.94 H new ATOM 0 HA GLU A 104 -11.324 4.379 21.437 1.00 23.10 H new ATOM 0 HB2 GLU A 104 -8.527 5.025 20.404 1.00 22.54 H new ATOM 0 HB3 GLU A 104 -9.985 5.102 19.436 1.00 22.54 H new ATOM 0 HG2 GLU A 104 -10.883 6.886 20.858 1.00 23.20 H new ATOM 0 HG3 GLU A 104 -9.503 6.765 21.931 1.00 23.20 H new ATOM 1580 N LEU A 105 -8.911 2.195 21.021 1.00 22.13 N ATOM 1581 CA LEU A 105 -8.580 0.880 20.486 1.00 21.50 C ATOM 1582 C LEU A 105 -9.575 -0.186 20.940 1.00 22.09 C ATOM 1583 O LEU A 105 -10.109 -0.929 20.117 1.00 21.66 O ATOM 1584 CB LEU A 105 -7.159 0.486 20.902 1.00 21.47 C ATOM 1585 CG LEU A 105 -6.542 -0.660 20.096 1.00 20.64 C ATOM 1586 CD1 LEU A 105 -5.024 -0.605 20.162 1.00 20.35 C ATOM 1587 CD2 LEU A 105 -7.047 -1.998 20.605 1.00 20.76 C ATOM 0 H LEU A 105 -8.185 2.604 21.609 1.00 22.13 H new ATOM 0 HA LEU A 105 -8.637 0.942 19.399 1.00 21.50 H new ATOM 0 HB2 LEU A 105 -6.515 1.361 20.812 1.00 21.47 H new ATOM 0 HB3 LEU A 105 -7.170 0.205 21.955 1.00 21.47 H new ATOM 0 HG LEU A 105 -6.844 -0.549 19.055 1.00 20.64 H new ATOM 0 HD11 LEU A 105 -4.605 -1.428 19.583 1.00 20.35 H new ATOM 0 HD12 LEU A 105 -4.676 0.343 19.751 1.00 20.35 H new ATOM 0 HD13 LEU A 105 -4.702 -0.690 21.200 1.00 20.35 H new ATOM 0 HD21 LEU A 105 -6.599 -2.802 20.021 1.00 20.76 H new ATOM 0 HD22 LEU A 105 -6.774 -2.115 21.654 1.00 20.76 H new ATOM 0 HD23 LEU A 105 -8.132 -2.039 20.506 1.00 20.76 H new ATOM 1599 N ARG A 106 -9.824 -0.260 22.244 1.00 23.15 N ATOM 1600 CA ARG A 106 -10.746 -1.258 22.781 1.00 23.87 C ATOM 1601 C ARG A 106 -12.173 -1.031 22.289 1.00 23.93 C ATOM 1602 O ARG A 106 -12.811 -1.953 21.787 1.00 24.00 O ATOM 1603 CB ARG A 106 -10.718 -1.271 24.313 1.00 25.01 C ATOM 1604 CG ARG A 106 -11.007 0.077 24.954 1.00 25.84 C ATOM 1605 CD ARG A 106 -11.796 -0.083 26.244 1.00 26.70 C ATOM 1606 NE ARG A 106 -11.962 1.189 26.944 1.00 27.44 N ATOM 1607 CZ ARG A 106 -13.101 1.576 27.512 1.00 28.28 C ATOM 1608 NH1 ARG A 106 -14.172 0.796 27.462 1.00 28.51 N ATOM 1609 NH2 ARG A 106 -13.168 2.747 28.133 1.00 28.96 N ATOM 0 H ARG A 106 -9.405 0.353 22.944 1.00 23.15 H new ATOM 0 HA ARG A 106 -10.410 -2.228 22.416 1.00 23.87 H new ATOM 0 HB2 ARG A 106 -11.449 -1.995 24.672 1.00 25.01 H new ATOM 0 HB3 ARG A 106 -9.738 -1.615 24.644 1.00 25.01 H new ATOM 0 HG2 ARG A 106 -10.069 0.593 25.160 1.00 25.84 H new ATOM 0 HG3 ARG A 106 -11.567 0.701 24.257 1.00 25.84 H new ATOM 0 HD2 ARG A 106 -12.776 -0.504 26.020 1.00 26.70 H new ATOM 0 HD3 ARG A 106 -11.286 -0.792 26.896 1.00 26.70 H new ATOM 0 HE ARG A 106 -11.159 1.816 27.000 1.00 27.44 H new ATOM 0 HH11 ARG A 106 -14.125 -0.105 26.987 1.00 28.51 H new ATOM 0 HH12 ARG A 106 -15.043 1.097 27.899 1.00 28.51 H new ATOM 0 HH21 ARG A 106 -12.346 3.350 28.175 1.00 28.96 H new ATOM 0 HH22 ARG A 106 -14.041 3.044 28.569 1.00 28.96 H new ATOM 1623 N PHE A 107 -12.666 0.196 22.426 1.00 24.01 N ATOM 1624 CA PHE A 107 -14.024 0.527 22.007 1.00 24.21 C ATOM 1625 C PHE A 107 -14.324 -0.002 20.607 1.00 23.32 C ATOM 1626 O PHE A 107 -15.419 -0.500 20.347 1.00 23.61 O ATOM 1627 CB PHE A 107 -14.242 2.042 22.048 1.00 24.45 C ATOM 1628 CG PHE A 107 -15.687 2.442 21.932 1.00 25.01 C ATOM 1629 CD1 PHE A 107 -16.268 2.636 20.689 1.00 25.30 C ATOM 1630 CD2 PHE A 107 -16.462 2.625 23.066 1.00 25.33 C ATOM 1631 CE1 PHE A 107 -17.595 3.006 20.579 1.00 25.91 C ATOM 1632 CE2 PHE A 107 -17.789 2.996 22.962 1.00 25.94 C ATOM 1633 CZ PHE A 107 -18.360 3.179 21.721 1.00 26.22 C ATOM 0 H PHE A 107 -12.145 0.978 22.824 1.00 24.01 H new ATOM 0 HA PHE A 107 -14.709 0.046 22.705 1.00 24.21 H new ATOM 0 HB2 PHE A 107 -13.838 2.434 22.981 1.00 24.45 H new ATOM 0 HB3 PHE A 107 -13.679 2.505 21.238 1.00 24.45 H new ATOM 0 HD1 PHE A 107 -15.677 2.496 19.796 1.00 25.30 H new ATOM 0 HD2 PHE A 107 -16.024 2.476 24.042 1.00 25.33 H new ATOM 0 HE1 PHE A 107 -18.035 3.160 19.605 1.00 25.91 H new ATOM 0 HE2 PHE A 107 -18.379 3.143 23.854 1.00 25.94 H new ATOM 0 HZ PHE A 107 -19.401 3.456 21.639 1.00 26.22 H new ATOM 1643 N VAL A 108 -13.348 0.105 19.710 1.00 22.31 N ATOM 1644 CA VAL A 108 -13.521 -0.361 18.337 1.00 21.42 C ATOM 1645 C VAL A 108 -13.335 -1.875 18.222 1.00 21.31 C ATOM 1646 O VAL A 108 -14.121 -2.554 17.563 1.00 21.31 O ATOM 1647 CB VAL A 108 -12.542 0.346 17.379 1.00 20.36 C ATOM 1648 CG1 VAL A 108 -12.799 -0.074 15.940 1.00 19.77 C ATOM 1649 CG2 VAL A 108 -12.652 1.855 17.524 1.00 20.26 C ATOM 0 H VAL A 108 -12.432 0.509 19.908 1.00 22.31 H new ATOM 0 HA VAL A 108 -14.544 -0.113 18.052 1.00 21.42 H new ATOM 0 HB VAL A 108 -11.528 0.047 17.644 1.00 20.36 H new ATOM 0 HG11 VAL A 108 -12.097 0.437 15.281 1.00 19.77 H new ATOM 0 HG12 VAL A 108 -12.666 -1.152 15.846 1.00 19.77 H new ATOM 0 HG13 VAL A 108 -13.818 0.192 15.660 1.00 19.77 H new ATOM 0 HG21 VAL A 108 -11.954 2.338 16.840 1.00 20.26 H new ATOM 0 HG22 VAL A 108 -13.668 2.170 17.287 1.00 20.26 H new ATOM 0 HG23 VAL A 108 -12.413 2.140 18.548 1.00 20.26 H new ATOM 1659 N MET A 109 -12.292 -2.397 18.863 1.00 21.33 N ATOM 1660 CA MET A 109 -11.998 -3.828 18.826 1.00 21.35 C ATOM 1661 C MET A 109 -13.190 -4.682 19.244 1.00 22.24 C ATOM 1662 O MET A 109 -13.420 -5.748 18.676 1.00 22.21 O ATOM 1663 CB MET A 109 -10.805 -4.142 19.719 1.00 21.65 C ATOM 1664 CG MET A 109 -9.473 -3.838 19.064 1.00 20.93 C ATOM 1665 SD MET A 109 -9.088 -4.973 17.714 1.00 20.76 S ATOM 1666 CE MET A 109 -9.180 -6.554 18.554 1.00 21.25 C ATOM 0 H MET A 109 -11.634 -1.848 19.416 1.00 21.33 H new ATOM 0 HA MET A 109 -11.765 -4.077 17.791 1.00 21.35 H new ATOM 0 HB2 MET A 109 -10.889 -3.567 20.641 1.00 21.65 H new ATOM 0 HB3 MET A 109 -10.834 -5.196 19.996 1.00 21.65 H new ATOM 0 HG2 MET A 109 -9.484 -2.817 18.683 1.00 20.93 H new ATOM 0 HG3 MET A 109 -8.683 -3.890 19.814 1.00 20.93 H new ATOM 0 HE1 MET A 109 -8.622 -7.300 17.988 1.00 21.25 H new ATOM 0 HE2 MET A 109 -8.752 -6.461 19.552 1.00 21.25 H new ATOM 0 HE3 MET A 109 -10.222 -6.864 18.634 1.00 21.25 H new ATOM 1676 N ILE A 110 -13.941 -4.230 20.240 1.00 23.11 N ATOM 1677 CA ILE A 110 -15.094 -4.987 20.707 1.00 24.06 C ATOM 1678 C ILE A 110 -16.232 -4.920 19.695 1.00 23.82 C ATOM 1679 O ILE A 110 -17.125 -5.769 19.689 1.00 24.33 O ATOM 1680 CB ILE A 110 -15.590 -4.485 22.074 1.00 25.05 C ATOM 1681 CG1 ILE A 110 -14.405 -4.236 23.011 1.00 25.40 C ATOM 1682 CG2 ILE A 110 -16.549 -5.499 22.681 1.00 26.06 C ATOM 1683 CD1 ILE A 110 -14.765 -3.458 24.259 1.00 26.28 C ATOM 0 H ILE A 110 -13.775 -3.354 20.735 1.00 23.11 H new ATOM 0 HA ILE A 110 -14.772 -6.022 20.819 1.00 24.06 H new ATOM 0 HB ILE A 110 -16.120 -3.542 21.935 1.00 25.05 H new ATOM 0 HG12 ILE A 110 -13.977 -5.195 23.303 1.00 25.40 H new ATOM 0 HG13 ILE A 110 -13.631 -3.694 22.467 1.00 25.40 H new ATOM 0 HG21 ILE A 110 -16.896 -5.137 23.649 1.00 26.06 H new ATOM 0 HG22 ILE A 110 -17.403 -5.635 22.017 1.00 26.06 H new ATOM 0 HG23 ILE A 110 -16.036 -6.452 22.813 1.00 26.06 H new ATOM 0 HD11 ILE A 110 -13.874 -3.322 24.872 1.00 26.28 H new ATOM 0 HD12 ILE A 110 -15.165 -2.484 23.978 1.00 26.28 H new ATOM 0 HD13 ILE A 110 -15.516 -4.008 24.827 1.00 26.28 H new ATOM 1695 N ASN A 111 -16.192 -3.904 18.838 1.00 23.14 N ATOM 1696 CA ASN A 111 -17.210 -3.726 17.810 1.00 22.94 C ATOM 1697 C ASN A 111 -16.923 -4.629 16.618 1.00 22.38 C ATOM 1698 O ASN A 111 -17.827 -5.258 16.066 1.00 22.72 O ATOM 1699 CB ASN A 111 -17.257 -2.265 17.362 1.00 22.34 C ATOM 1700 CG ASN A 111 -17.746 -1.342 18.460 1.00 23.08 C ATOM 1701 OD1 ASN A 111 -18.529 -1.742 19.321 1.00 23.74 O ATOM 1702 ND2 ASN A 111 -17.287 -0.097 18.435 1.00 23.04 N ATOM 0 H ASN A 111 -15.463 -3.190 18.836 1.00 23.14 H new ATOM 0 HA ASN A 111 -18.179 -3.998 18.229 1.00 22.94 H new ATOM 0 HB2 ASN A 111 -16.262 -1.953 17.044 1.00 22.34 H new ATOM 0 HB3 ASN A 111 -17.912 -2.174 16.495 1.00 22.34 H new ATOM 0 HD21 ASN A 111 -17.582 0.570 19.148 1.00 23.04 H new ATOM 0 HD22 ASN A 111 -16.639 0.193 17.703 1.00 23.04 H new ATOM 1709 N LEU A 112 -15.653 -4.686 16.232 1.00 21.58 N ATOM 1710 CA LEU A 112 -15.223 -5.510 15.111 1.00 21.04 C ATOM 1711 C LEU A 112 -14.958 -6.936 15.577 1.00 21.87 C ATOM 1712 O LEU A 112 -15.586 -7.885 15.108 1.00 21.84 O ATOM 1713 CB LEU A 112 -13.956 -4.924 14.478 1.00 20.05 C ATOM 1714 CG LEU A 112 -14.154 -3.637 13.668 1.00 19.21 C ATOM 1715 CD1 LEU A 112 -14.675 -2.511 14.547 1.00 19.02 C ATOM 1716 CD2 LEU A 112 -12.850 -3.228 13.000 1.00 18.68 C ATOM 0 H LEU A 112 -14.900 -4.167 16.683 1.00 21.58 H new ATOM 0 HA LEU A 112 -16.017 -5.524 14.365 1.00 21.04 H new ATOM 0 HB2 LEU A 112 -13.234 -4.726 15.270 1.00 20.05 H new ATOM 0 HB3 LEU A 112 -13.515 -5.678 13.826 1.00 20.05 H new ATOM 0 HG LEU A 112 -14.898 -3.834 12.896 1.00 19.21 H new ATOM 0 HD11 LEU A 112 -14.806 -1.611 13.946 1.00 19.02 H new ATOM 0 HD12 LEU A 112 -15.632 -2.801 14.980 1.00 19.02 H new ATOM 0 HD13 LEU A 112 -13.961 -2.313 15.346 1.00 19.02 H new ATOM 0 HD21 LEU A 112 -13.005 -2.313 12.428 1.00 18.68 H new ATOM 0 HD22 LEU A 112 -12.090 -3.055 13.762 1.00 18.68 H new ATOM 0 HD23 LEU A 112 -12.519 -4.022 12.331 1.00 18.68 H new ATOM 1728 N GLY A 113 -14.019 -7.073 16.506 1.00 22.70 N ATOM 1729 CA GLY A 113 -13.679 -8.377 17.040 1.00 23.62 C ATOM 1730 C GLY A 113 -14.518 -8.744 18.248 1.00 23.76 C ATOM 1731 O GLY A 113 -15.745 -8.814 18.162 1.00 24.44 O ATOM 0 H GLY A 113 -13.485 -6.299 16.900 1.00 22.70 H new ATOM 0 HA2 GLY A 113 -13.815 -9.131 16.264 1.00 23.62 H new ATOM 0 HA3 GLY A 113 -12.625 -8.390 17.316 1.00 23.62 H new ATOM 1735 N GLU A 114 -13.858 -8.983 19.379 1.00 23.22 N ATOM 1736 CA GLU A 114 -14.531 -9.346 20.599 1.00 23.41 C ATOM 1737 C GLU A 114 -14.038 -8.476 21.761 1.00 24.22 C ATOM 1738 O GLU A 114 -13.006 -7.813 21.653 1.00 24.14 O ATOM 1739 CB GLU A 114 -14.256 -10.825 20.868 1.00 22.59 C ATOM 1740 CG GLU A 114 -14.297 -11.197 22.330 1.00 21.89 C ATOM 1741 CD GLU A 114 -15.705 -11.429 22.844 1.00 21.84 C ATOM 1742 OE1 GLU A 114 -16.402 -12.304 22.288 1.00 21.76 O ATOM 1743 OE2 GLU A 114 -16.110 -10.737 23.801 1.00 21.97 O ATOM 0 H GLU A 114 -12.843 -8.927 19.463 1.00 23.22 H new ATOM 0 HA GLU A 114 -15.604 -9.182 20.503 1.00 23.41 H new ATOM 0 HB2 GLU A 114 -14.990 -11.425 20.330 1.00 22.59 H new ATOM 0 HB3 GLU A 114 -13.276 -11.082 20.465 1.00 22.59 H new ATOM 0 HG2 GLU A 114 -13.706 -12.099 22.486 1.00 21.89 H new ATOM 0 HG3 GLU A 114 -13.829 -10.404 22.914 1.00 21.89 H new ATOM 1750 N LYS A 115 -14.785 -8.484 22.863 1.00 25.07 N ATOM 1751 CA LYS A 115 -14.425 -7.716 24.050 1.00 25.94 C ATOM 1752 C LYS A 115 -12.984 -7.991 24.475 1.00 25.87 C ATOM 1753 O LYS A 115 -12.637 -9.116 24.835 1.00 26.08 O ATOM 1754 CB LYS A 115 -15.380 -8.052 25.198 1.00 27.05 C ATOM 1755 CG LYS A 115 -15.062 -7.320 26.491 1.00 27.83 C ATOM 1756 CD LYS A 115 -16.020 -7.720 27.601 1.00 28.38 C ATOM 1757 CE LYS A 115 -15.669 -7.039 28.914 1.00 29.16 C ATOM 1758 NZ LYS A 115 -16.606 -7.420 30.005 1.00 29.75 N ATOM 0 H LYS A 115 -15.649 -9.018 22.957 1.00 25.07 H new ATOM 0 HA LYS A 115 -14.508 -6.657 23.805 1.00 25.94 H new ATOM 0 HB2 LYS A 115 -16.398 -7.809 24.895 1.00 27.05 H new ATOM 0 HB3 LYS A 115 -15.349 -9.126 25.382 1.00 27.05 H new ATOM 0 HG2 LYS A 115 -14.038 -7.540 26.794 1.00 27.83 H new ATOM 0 HG3 LYS A 115 -15.121 -6.244 26.327 1.00 27.83 H new ATOM 0 HD2 LYS A 115 -17.039 -7.458 27.315 1.00 28.38 H new ATOM 0 HD3 LYS A 115 -15.994 -8.802 27.733 1.00 28.38 H new ATOM 0 HE2 LYS A 115 -14.651 -7.305 29.200 1.00 29.16 H new ATOM 0 HE3 LYS A 115 -15.690 -5.958 28.779 1.00 29.16 H new ATOM 0 HZ1 LYS A 115 -16.332 -6.935 30.883 1.00 29.75 H new ATOM 0 HZ2 LYS A 115 -17.574 -7.143 29.744 1.00 29.75 H new ATOM 0 HZ3 LYS A 115 -16.568 -8.449 30.152 1.00 29.75 H new ATOM 1772 N VAL A 116 -12.152 -6.954 24.428 1.00 25.67 N ATOM 1773 CA VAL A 116 -10.750 -7.073 24.815 1.00 25.69 C ATOM 1774 C VAL A 116 -10.450 -6.235 26.047 1.00 26.53 C ATOM 1775 O VAL A 116 -11.048 -5.178 26.254 1.00 26.78 O ATOM 1776 CB VAL A 116 -9.796 -6.620 23.692 1.00 24.51 C ATOM 1777 CG1 VAL A 116 -9.535 -7.749 22.709 1.00 23.77 C ATOM 1778 CG2 VAL A 116 -10.349 -5.395 22.981 1.00 24.02 C ATOM 0 H VAL A 116 -12.426 -6.019 24.125 1.00 25.67 H new ATOM 0 HA VAL A 116 -10.585 -8.130 25.024 1.00 25.69 H new ATOM 0 HB VAL A 116 -8.843 -6.348 24.146 1.00 24.51 H new ATOM 0 HG11 VAL A 116 -8.859 -7.402 21.927 1.00 23.77 H new ATOM 0 HG12 VAL A 116 -9.082 -8.590 23.233 1.00 23.77 H new ATOM 0 HG13 VAL A 116 -10.477 -8.066 22.260 1.00 23.77 H new ATOM 0 HG21 VAL A 116 -9.661 -5.091 22.192 1.00 24.02 H new ATOM 0 HG22 VAL A 116 -11.319 -5.634 22.545 1.00 24.02 H new ATOM 0 HG23 VAL A 116 -10.464 -4.580 23.696 1.00 24.02 H new ATOM 1788 N THR A 117 -9.520 -6.713 26.862 1.00 27.04 N ATOM 1789 CA THR A 117 -9.121 -5.996 28.063 1.00 27.90 C ATOM 1790 C THR A 117 -8.105 -4.919 27.711 1.00 27.38 C ATOM 1791 O THR A 117 -7.238 -5.127 26.863 1.00 26.61 O ATOM 1792 CB THR A 117 -8.511 -6.946 29.111 1.00 28.88 C ATOM 1793 OG1 THR A 117 -7.379 -7.625 28.558 1.00 28.45 O ATOM 1794 CG2 THR A 117 -9.539 -7.964 29.581 1.00 29.54 C ATOM 0 H THR A 117 -9.028 -7.594 26.713 1.00 27.04 H new ATOM 0 HA THR A 117 -10.015 -5.541 28.490 1.00 27.90 H new ATOM 0 HB THR A 117 -8.194 -6.351 29.967 1.00 28.88 H new ATOM 0 HG1 THR A 117 -6.997 -8.226 29.231 1.00 28.45 H new ATOM 0 HG21 THR A 117 -9.086 -8.624 30.321 1.00 29.54 H new ATOM 0 HG22 THR A 117 -10.387 -7.445 30.029 1.00 29.54 H new ATOM 0 HG23 THR A 117 -9.882 -8.553 28.731 1.00 29.54 H new ATOM 1802 N ASP A 118 -8.223 -3.765 28.360 1.00 27.85 N ATOM 1803 CA ASP A 118 -7.313 -2.653 28.110 1.00 27.53 C ATOM 1804 C ASP A 118 -5.859 -3.088 28.259 1.00 27.56 C ATOM 1805 O ASP A 118 -4.951 -2.401 27.799 1.00 27.11 O ATOM 1806 CB ASP A 118 -7.607 -1.499 29.071 1.00 28.39 C ATOM 1807 CG ASP A 118 -9.021 -0.970 28.927 1.00 28.44 C ATOM 1808 OD1 ASP A 118 -9.922 -1.489 29.620 1.00 28.40 O ATOM 1809 OD2 ASP A 118 -9.227 -0.038 28.121 1.00 28.58 O ATOM 0 H ASP A 118 -8.939 -3.576 29.062 1.00 27.85 H new ATOM 0 HA ASP A 118 -7.470 -2.318 27.085 1.00 27.53 H new ATOM 0 HB2 ASP A 118 -7.451 -1.835 30.096 1.00 28.39 H new ATOM 0 HB3 ASP A 118 -6.899 -0.690 28.890 1.00 28.39 H new ATOM 1814 N GLU A 119 -5.648 -4.237 28.895 1.00 28.18 N ATOM 1815 CA GLU A 119 -4.303 -4.757 29.115 1.00 28.39 C ATOM 1816 C GLU A 119 -3.743 -5.435 27.865 1.00 27.39 C ATOM 1817 O GLU A 119 -2.665 -5.076 27.391 1.00 26.99 O ATOM 1818 CB GLU A 119 -4.307 -5.746 30.282 1.00 29.53 C ATOM 1819 CG GLU A 119 -4.780 -5.138 31.593 1.00 30.59 C ATOM 1820 CD GLU A 119 -4.789 -6.140 32.731 1.00 31.58 C ATOM 1821 OE1 GLU A 119 -3.743 -6.291 33.397 1.00 32.06 O ATOM 1822 OE2 GLU A 119 -5.841 -6.774 32.955 1.00 31.92 O ATOM 0 H GLU A 119 -6.393 -4.826 29.267 1.00 28.18 H new ATOM 0 HA GLU A 119 -3.659 -3.910 29.352 1.00 28.39 H new ATOM 0 HB2 GLU A 119 -4.949 -6.590 30.030 1.00 29.53 H new ATOM 0 HB3 GLU A 119 -3.300 -6.141 30.417 1.00 29.53 H new ATOM 0 HG2 GLU A 119 -4.133 -4.301 31.856 1.00 30.59 H new ATOM 0 HG3 GLU A 119 -5.784 -4.735 31.461 1.00 30.59 H new ATOM 1829 N GLU A 120 -4.474 -6.413 27.333 1.00 27.04 N ATOM 1830 CA GLU A 120 -4.026 -7.142 26.150 1.00 26.15 C ATOM 1831 C GLU A 120 -3.764 -6.205 24.973 1.00 24.97 C ATOM 1832 O GLU A 120 -2.756 -6.343 24.274 1.00 24.41 O ATOM 1833 CB GLU A 120 -5.038 -8.222 25.763 1.00 26.05 C ATOM 1834 CG GLU A 120 -6.402 -7.688 25.366 1.00 25.61 C ATOM 1835 CD GLU A 120 -7.337 -8.787 24.904 1.00 25.53 C ATOM 1836 OE1 GLU A 120 -7.124 -9.321 23.795 1.00 24.93 O ATOM 1837 OE2 GLU A 120 -8.286 -9.110 25.648 1.00 26.13 O ATOM 0 H GLU A 120 -5.375 -6.717 27.701 1.00 27.04 H new ATOM 0 HA GLU A 120 -3.082 -7.624 26.403 1.00 26.15 H new ATOM 0 HB2 GLU A 120 -4.633 -8.802 24.934 1.00 26.05 H new ATOM 0 HB3 GLU A 120 -5.159 -8.907 26.602 1.00 26.05 H new ATOM 0 HG2 GLU A 120 -6.847 -7.168 26.214 1.00 25.61 H new ATOM 0 HG3 GLU A 120 -6.285 -6.955 24.568 1.00 25.61 H new ATOM 1844 N ILE A 121 -4.658 -5.246 24.755 1.00 24.65 N ATOM 1845 CA ILE A 121 -4.487 -4.310 23.654 1.00 23.60 C ATOM 1846 C ILE A 121 -3.383 -3.304 23.956 1.00 23.80 C ATOM 1847 O ILE A 121 -2.656 -2.889 23.054 1.00 23.05 O ATOM 1848 CB ILE A 121 -5.791 -3.564 23.309 1.00 23.30 C ATOM 1849 CG1 ILE A 121 -6.308 -2.779 24.512 1.00 24.33 C ATOM 1850 CG2 ILE A 121 -6.843 -4.548 22.821 1.00 22.99 C ATOM 1851 CD1 ILE A 121 -7.274 -1.675 24.147 1.00 24.19 C ATOM 0 H ILE A 121 -5.496 -5.099 25.318 1.00 24.65 H new ATOM 0 HA ILE A 121 -4.203 -4.905 22.786 1.00 23.60 H new ATOM 0 HB ILE A 121 -5.578 -2.852 22.511 1.00 23.30 H new ATOM 0 HG12 ILE A 121 -6.799 -3.467 25.200 1.00 24.33 H new ATOM 0 HG13 ILE A 121 -5.461 -2.347 25.044 1.00 24.33 H new ATOM 0 HG21 ILE A 121 -7.760 -4.010 22.580 1.00 22.99 H new ATOM 0 HG22 ILE A 121 -6.478 -5.059 21.930 1.00 22.99 H new ATOM 0 HG23 ILE A 121 -7.046 -5.280 23.602 1.00 22.99 H new ATOM 0 HD11 ILE A 121 -7.598 -1.162 25.052 1.00 24.19 H new ATOM 0 HD12 ILE A 121 -6.781 -0.964 23.484 1.00 24.19 H new ATOM 0 HD13 ILE A 121 -8.140 -2.102 23.642 1.00 24.19 H new ATOM 1863 N ASP A 122 -3.258 -2.909 25.224 1.00 24.87 N ATOM 1864 CA ASP A 122 -2.211 -1.972 25.613 1.00 25.26 C ATOM 1865 C ASP A 122 -0.856 -2.539 25.223 1.00 25.13 C ATOM 1866 O ASP A 122 0.041 -1.808 24.803 1.00 24.95 O ATOM 1867 CB ASP A 122 -2.250 -1.698 27.118 1.00 26.55 C ATOM 1868 CG ASP A 122 -1.116 -0.800 27.571 1.00 27.08 C ATOM 1869 OD1 ASP A 122 -1.238 0.433 27.421 1.00 27.39 O ATOM 1870 OD2 ASP A 122 -0.105 -1.332 28.077 1.00 27.28 O ATOM 0 H ASP A 122 -3.860 -3.219 25.987 1.00 24.87 H new ATOM 0 HA ASP A 122 -2.378 -1.028 25.094 1.00 25.26 H new ATOM 0 HB2 ASP A 122 -3.202 -1.234 27.376 1.00 26.55 H new ATOM 0 HB3 ASP A 122 -2.199 -2.643 27.658 1.00 26.55 H new ATOM 1875 N GLU A 123 -0.718 -3.855 25.368 1.00 25.32 N ATOM 1876 CA GLU A 123 0.513 -4.540 25.006 1.00 25.30 C ATOM 1877 C GLU A 123 0.731 -4.434 23.506 1.00 24.05 C ATOM 1878 O GLU A 123 1.831 -4.132 23.048 1.00 23.89 O ATOM 1879 CB GLU A 123 0.458 -6.010 25.427 1.00 25.91 C ATOM 1880 CG GLU A 123 0.372 -6.212 26.932 1.00 27.23 C ATOM 1881 CD GLU A 123 1.587 -5.675 27.662 1.00 27.86 C ATOM 1882 OE1 GLU A 123 2.584 -6.419 27.782 1.00 27.98 O ATOM 1883 OE2 GLU A 123 1.543 -4.512 28.113 1.00 28.28 O ATOM 0 H GLU A 123 -1.447 -4.466 25.735 1.00 25.32 H new ATOM 0 HA GLU A 123 1.345 -4.067 25.528 1.00 25.30 H new ATOM 0 HB2 GLU A 123 -0.405 -6.482 24.956 1.00 25.91 H new ATOM 0 HB3 GLU A 123 1.345 -6.520 25.051 1.00 25.91 H new ATOM 0 HG2 GLU A 123 -0.523 -5.718 27.311 1.00 27.23 H new ATOM 0 HG3 GLU A 123 0.264 -7.275 27.147 1.00 27.23 H new ATOM 1890 N MET A 124 -0.332 -4.689 22.745 1.00 23.22 N ATOM 1891 CA MET A 124 -0.270 -4.603 21.295 1.00 21.99 C ATOM 1892 C MET A 124 0.178 -3.209 20.866 1.00 21.54 C ATOM 1893 O MET A 124 0.849 -3.045 19.848 1.00 20.82 O ATOM 1894 CB MET A 124 -1.638 -4.919 20.702 1.00 21.32 C ATOM 1895 CG MET A 124 -1.613 -5.149 19.207 1.00 20.01 C ATOM 1896 SD MET A 124 -2.534 -3.900 18.289 1.00 19.35 S ATOM 1897 CE MET A 124 -4.193 -4.168 18.912 1.00 19.76 C ATOM 0 H MET A 124 -1.245 -4.957 23.113 1.00 23.22 H new ATOM 0 HA MET A 124 0.455 -5.329 20.928 1.00 21.99 H new ATOM 0 HB2 MET A 124 -2.040 -5.806 21.191 1.00 21.32 H new ATOM 0 HB3 MET A 124 -2.319 -4.097 20.923 1.00 21.32 H new ATOM 0 HG2 MET A 124 -0.579 -5.156 18.863 1.00 20.01 H new ATOM 0 HG3 MET A 124 -2.028 -6.133 18.989 1.00 20.01 H new ATOM 0 HE1 MET A 124 -4.915 -3.729 18.224 1.00 19.76 H new ATOM 0 HE2 MET A 124 -4.380 -5.238 19.001 1.00 19.76 H new ATOM 0 HE3 MET A 124 -4.294 -3.700 19.891 1.00 19.76 H new ATOM 1907 N ILE A 125 -0.204 -2.211 21.657 1.00 22.08 N ATOM 1908 CA ILE A 125 0.156 -0.829 21.379 1.00 21.89 C ATOM 1909 C ILE A 125 1.636 -0.588 21.647 1.00 22.49 C ATOM 1910 O ILE A 125 2.322 0.047 20.848 1.00 22.09 O ATOM 1911 CB ILE A 125 -0.682 0.142 22.236 1.00 22.46 C ATOM 1912 CG1 ILE A 125 -2.148 0.098 21.797 1.00 21.89 C ATOM 1913 CG2 ILE A 125 -0.131 1.559 22.141 1.00 22.55 C ATOM 1914 CD1 ILE A 125 -3.064 0.969 22.631 1.00 22.55 C ATOM 0 H ILE A 125 -0.766 -2.337 22.499 1.00 22.08 H new ATOM 0 HA ILE A 125 -0.051 -0.644 20.325 1.00 21.89 H new ATOM 0 HB ILE A 125 -0.621 -0.171 23.278 1.00 22.46 H new ATOM 0 HG12 ILE A 125 -2.215 0.411 20.755 1.00 21.89 H new ATOM 0 HG13 ILE A 125 -2.500 -0.932 21.844 1.00 21.89 H new ATOM 0 HG21 ILE A 125 -0.737 2.227 22.753 1.00 22.55 H new ATOM 0 HG22 ILE A 125 0.899 1.574 22.498 1.00 22.55 H new ATOM 0 HG23 ILE A 125 -0.160 1.892 21.103 1.00 22.55 H new ATOM 0 HD11 ILE A 125 -4.085 0.884 22.259 1.00 22.55 H new ATOM 0 HD12 ILE A 125 -3.029 0.643 23.671 1.00 22.55 H new ATOM 0 HD13 ILE A 125 -2.739 2.007 22.565 1.00 22.55 H new ATOM 1926 N ARG A 126 2.118 -1.095 22.776 1.00 23.53 N ATOM 1927 CA ARG A 126 3.520 -0.936 23.148 1.00 24.28 C ATOM 1928 C ARG A 126 4.423 -1.657 22.151 1.00 23.77 C ATOM 1929 O ARG A 126 5.531 -1.204 21.862 1.00 23.91 O ATOM 1930 CB ARG A 126 3.756 -1.470 24.565 1.00 25.52 C ATOM 1931 CG ARG A 126 5.171 -1.251 25.078 1.00 26.44 C ATOM 1932 CD ARG A 126 6.068 -2.441 24.775 1.00 27.30 C ATOM 1933 NE ARG A 126 7.447 -2.209 25.197 1.00 28.16 N ATOM 1934 CZ ARG A 126 8.433 -3.079 25.002 1.00 28.99 C ATOM 1935 NH1 ARG A 126 8.191 -4.237 24.403 1.00 29.08 N ATOM 1936 NH2 ARG A 126 9.663 -2.791 25.407 1.00 29.80 N ATOM 0 H ARG A 126 1.560 -1.619 23.450 1.00 23.53 H new ATOM 0 HA ARG A 126 3.766 0.126 23.129 1.00 24.28 H new ATOM 0 HB2 ARG A 126 3.054 -0.988 25.246 1.00 25.52 H new ATOM 0 HB3 ARG A 126 3.535 -2.537 24.582 1.00 25.52 H new ATOM 0 HG2 ARG A 126 5.589 -0.354 24.621 1.00 26.44 H new ATOM 0 HG3 ARG A 126 5.146 -1.079 26.154 1.00 26.44 H new ATOM 0 HD2 ARG A 126 5.679 -3.326 25.279 1.00 27.30 H new ATOM 0 HD3 ARG A 126 6.046 -2.648 23.705 1.00 27.30 H new ATOM 0 HE ARG A 126 7.666 -1.331 25.667 1.00 28.16 H new ATOM 0 HH11 ARG A 126 7.246 -4.462 24.091 1.00 29.08 H new ATOM 0 HH12 ARG A 126 8.949 -4.903 24.255 1.00 29.08 H new ATOM 0 HH21 ARG A 126 9.853 -1.901 25.868 1.00 29.80 H new ATOM 0 HH22 ARG A 126 10.419 -3.459 25.257 1.00 29.80 H new ATOM 1950 N GLU A 127 3.938 -2.779 21.631 1.00 23.26 N ATOM 1951 CA GLU A 127 4.695 -3.566 20.664 1.00 22.80 C ATOM 1952 C GLU A 127 4.874 -2.802 19.356 1.00 21.68 C ATOM 1953 O GLU A 127 5.861 -2.994 18.644 1.00 21.50 O ATOM 1954 CB GLU A 127 3.988 -4.898 20.399 1.00 22.59 C ATOM 1955 CG GLU A 127 4.031 -5.856 21.577 1.00 23.70 C ATOM 1956 CD GLU A 127 3.295 -7.152 21.302 1.00 23.91 C ATOM 1957 OE1 GLU A 127 3.908 -8.072 20.722 1.00 24.13 O ATOM 1958 OE2 GLU A 127 2.104 -7.248 21.669 1.00 23.95 O ATOM 0 H GLU A 127 3.023 -3.165 21.863 1.00 23.26 H new ATOM 0 HA GLU A 127 5.682 -3.761 21.084 1.00 22.80 H new ATOM 0 HB2 GLU A 127 2.948 -4.702 20.139 1.00 22.59 H new ATOM 0 HB3 GLU A 127 4.447 -5.378 19.535 1.00 22.59 H new ATOM 0 HG2 GLU A 127 5.070 -6.077 21.823 1.00 23.70 H new ATOM 0 HG3 GLU A 127 3.593 -5.372 22.450 1.00 23.70 H new ATOM 1965 N ALA A 128 3.917 -1.932 19.047 1.00 21.01 N ATOM 1966 CA ALA A 128 3.966 -1.142 17.822 1.00 19.97 C ATOM 1967 C ALA A 128 4.491 0.264 18.087 1.00 20.40 C ATOM 1968 O ALA A 128 4.934 0.954 17.169 1.00 19.88 O ATOM 1969 CB ALA A 128 2.586 -1.073 17.187 1.00 19.05 C ATOM 0 H ALA A 128 3.098 -1.756 19.629 1.00 21.01 H new ATOM 0 HA ALA A 128 4.654 -1.634 17.134 1.00 19.97 H new ATOM 0 HB1 ALA A 128 2.635 -0.481 16.273 1.00 19.05 H new ATOM 0 HB2 ALA A 128 2.244 -2.080 16.949 1.00 19.05 H new ATOM 0 HB3 ALA A 128 1.888 -0.609 17.883 1.00 19.05 H new ATOM 1975 N ASP A 129 4.444 0.682 19.346 1.00 21.43 N ATOM 1976 CA ASP A 129 4.907 2.010 19.726 1.00 22.05 C ATOM 1977 C ASP A 129 6.424 2.049 19.862 1.00 22.75 C ATOM 1978 O ASP A 129 6.989 1.505 20.811 1.00 23.69 O ATOM 1979 CB ASP A 129 4.248 2.444 21.035 1.00 22.95 C ATOM 1980 CG ASP A 129 4.860 3.710 21.598 1.00 23.80 C ATOM 1981 OD1 ASP A 129 4.469 4.806 21.147 1.00 23.96 O ATOM 1982 OD2 ASP A 129 5.730 3.605 22.488 1.00 24.38 O ATOM 0 H ASP A 129 4.090 0.121 20.121 1.00 21.43 H new ATOM 0 HA ASP A 129 4.622 2.705 18.936 1.00 22.05 H new ATOM 0 HB2 ASP A 129 3.183 2.602 20.867 1.00 22.95 H new ATOM 0 HB3 ASP A 129 4.340 1.642 21.768 1.00 22.95 H new ATOM 1987 N PHE A 130 7.079 2.696 18.902 1.00 22.35 N ATOM 1988 CA PHE A 130 8.533 2.812 18.909 1.00 23.04 C ATOM 1989 C PHE A 130 8.981 4.090 19.613 1.00 24.02 C ATOM 1990 O PHE A 130 9.824 4.051 20.510 1.00 25.05 O ATOM 1991 CB PHE A 130 9.074 2.792 17.477 1.00 22.22 C ATOM 1992 CG PHE A 130 8.809 1.504 16.751 1.00 21.35 C ATOM 1993 CD1 PHE A 130 9.667 0.426 16.890 1.00 21.23 C ATOM 1994 CD2 PHE A 130 7.701 1.374 15.929 1.00 20.73 C ATOM 1995 CE1 PHE A 130 9.425 -0.760 16.224 1.00 20.51 C ATOM 1996 CE2 PHE A 130 7.454 0.191 15.259 1.00 20.01 C ATOM 1997 CZ PHE A 130 8.317 -0.878 15.406 1.00 19.90 C ATOM 0 H PHE A 130 6.625 3.148 18.109 1.00 22.35 H new ATOM 0 HA PHE A 130 8.934 1.959 19.457 1.00 23.04 H new ATOM 0 HB2 PHE A 130 8.627 3.613 16.917 1.00 22.22 H new ATOM 0 HB3 PHE A 130 10.149 2.971 17.501 1.00 22.22 H new ATOM 0 HD1 PHE A 130 10.535 0.513 17.526 1.00 21.23 H new ATOM 0 HD2 PHE A 130 7.023 2.206 15.811 1.00 20.73 H new ATOM 0 HE1 PHE A 130 10.101 -1.594 16.342 1.00 20.51 H new ATOM 0 HE2 PHE A 130 6.587 0.102 14.621 1.00 20.01 H new ATOM 0 HZ PHE A 130 8.126 -1.804 14.883 1.00 19.90 H new ATOM 2007 N ASP A 131 8.413 5.221 19.201 1.00 23.76 N ATOM 2008 CA ASP A 131 8.758 6.512 19.791 1.00 24.71 C ATOM 2009 C ASP A 131 8.540 6.509 21.302 1.00 25.78 C ATOM 2010 O ASP A 131 9.492 6.618 22.074 1.00 26.78 O ATOM 2011 CB ASP A 131 7.941 7.633 19.143 1.00 24.21 C ATOM 2012 CG ASP A 131 6.560 7.177 18.711 1.00 23.32 C ATOM 2013 OD1 ASP A 131 5.635 7.201 19.550 1.00 23.46 O ATOM 2014 OD2 ASP A 131 6.405 6.798 17.531 1.00 22.53 O ATOM 0 H ASP A 131 7.712 5.270 18.461 1.00 23.76 H new ATOM 0 HA ASP A 131 9.817 6.690 19.602 1.00 24.71 H new ATOM 0 HB2 ASP A 131 7.842 8.459 19.847 1.00 24.21 H new ATOM 0 HB3 ASP A 131 8.480 8.016 18.277 1.00 24.21 H new ATOM 2019 N GLY A 132 7.283 6.383 21.718 1.00 25.60 N ATOM 2020 CA GLY A 132 6.971 6.374 23.136 1.00 26.62 C ATOM 2021 C GLY A 132 6.092 7.538 23.546 1.00 26.95 C ATOM 2022 O GLY A 132 6.577 8.528 24.093 1.00 27.86 O ATOM 0 H GLY A 132 6.477 6.287 21.100 1.00 25.60 H new ATOM 0 HA2 GLY A 132 6.471 5.439 23.388 1.00 26.62 H new ATOM 0 HA3 GLY A 132 7.898 6.404 23.709 1.00 26.62 H new ATOM 2026 N ASP A 133 4.795 7.420 23.279 1.00 26.26 N ATOM 2027 CA ASP A 133 3.844 8.470 23.626 1.00 26.58 C ATOM 2028 C ASP A 133 2.484 7.880 23.991 1.00 26.27 C ATOM 2029 O ASP A 133 1.534 8.611 24.270 1.00 26.65 O ATOM 2030 CB ASP A 133 3.691 9.453 22.463 1.00 26.12 C ATOM 2031 CG ASP A 133 3.024 8.823 21.256 1.00 24.90 C ATOM 2032 OD1 ASP A 133 3.357 7.665 20.931 1.00 24.32 O ATOM 2033 OD2 ASP A 133 2.170 9.489 20.636 1.00 24.55 O ATOM 0 H ASP A 133 4.379 6.608 22.824 1.00 26.26 H new ATOM 0 HA ASP A 133 4.232 9.001 24.495 1.00 26.58 H new ATOM 0 HB2 ASP A 133 3.105 10.311 22.791 1.00 26.12 H new ATOM 0 HB3 ASP A 133 4.673 9.828 22.177 1.00 26.12 H new ATOM 2038 N GLY A 134 2.399 6.551 23.988 1.00 25.66 N ATOM 2039 CA GLY A 134 1.154 5.884 24.323 1.00 25.42 C ATOM 2040 C GLY A 134 0.085 6.068 23.262 1.00 24.43 C ATOM 2041 O GLY A 134 -1.108 5.972 23.554 1.00 24.42 O ATOM 0 H GLY A 134 3.171 5.925 23.759 1.00 25.66 H new ATOM 0 HA2 GLY A 134 1.343 4.819 24.461 1.00 25.42 H new ATOM 0 HA3 GLY A 134 0.786 6.268 25.274 1.00 25.42 H new ATOM 2045 N MET A 135 0.510 6.332 22.029 1.00 23.66 N ATOM 2046 CA MET A 135 -0.425 6.528 20.924 1.00 22.72 C ATOM 2047 C MET A 135 0.043 5.778 19.679 1.00 21.56 C ATOM 2048 O MET A 135 1.237 5.523 19.512 1.00 21.55 O ATOM 2049 CB MET A 135 -0.577 8.019 20.614 1.00 23.01 C ATOM 2050 CG MET A 135 -0.759 8.883 21.853 1.00 24.25 C ATOM 2051 SD MET A 135 -1.202 10.586 21.460 1.00 24.43 S ATOM 2052 CE MET A 135 -2.947 10.407 21.095 1.00 23.79 C ATOM 0 H MET A 135 1.493 6.415 21.770 1.00 23.66 H new ATOM 0 HA MET A 135 -1.394 6.129 21.223 1.00 22.72 H new ATOM 0 HB2 MET A 135 0.304 8.360 20.070 1.00 23.01 H new ATOM 0 HB3 MET A 135 -1.434 8.159 19.955 1.00 23.01 H new ATOM 0 HG2 MET A 135 -1.534 8.447 22.483 1.00 24.25 H new ATOM 0 HG3 MET A 135 0.164 8.877 22.433 1.00 24.25 H new ATOM 0 HE1 MET A 135 -3.229 11.111 20.313 1.00 23.79 H new ATOM 0 HE2 MET A 135 -3.145 9.390 20.757 1.00 23.79 H new ATOM 0 HE3 MET A 135 -3.529 10.610 21.994 1.00 23.79 H new ATOM 2062 N ILE A 136 -0.902 5.434 18.805 1.00 20.64 N ATOM 2063 CA ILE A 136 -0.585 4.707 17.579 1.00 19.48 C ATOM 2064 C ILE A 136 -0.866 5.543 16.337 1.00 18.80 C ATOM 2065 O ILE A 136 -1.948 6.102 16.186 1.00 18.85 O ATOM 2066 CB ILE A 136 -1.388 3.395 17.469 1.00 18.91 C ATOM 2067 CG1 ILE A 136 -1.017 2.432 18.603 1.00 19.65 C ATOM 2068 CG2 ILE A 136 -1.158 2.746 16.107 1.00 17.71 C ATOM 2069 CD1 ILE A 136 0.426 1.973 18.572 1.00 19.77 C ATOM 0 H ILE A 136 -1.892 5.647 18.924 1.00 20.64 H new ATOM 0 HA ILE A 136 0.480 4.481 17.633 1.00 19.48 H new ATOM 0 HB ILE A 136 -2.448 3.630 17.564 1.00 18.91 H new ATOM 0 HG12 ILE A 136 -1.212 2.919 19.558 1.00 19.65 H new ATOM 0 HG13 ILE A 136 -1.667 1.558 18.552 1.00 19.65 H new ATOM 0 HG21 ILE A 136 -1.731 1.821 16.043 1.00 17.71 H new ATOM 0 HG22 ILE A 136 -1.481 3.428 15.320 1.00 17.71 H new ATOM 0 HG23 ILE A 136 -0.098 2.525 15.983 1.00 17.71 H new ATOM 0 HD11 ILE A 136 0.610 1.295 19.405 1.00 19.77 H new ATOM 0 HD12 ILE A 136 0.623 1.456 17.633 1.00 19.77 H new ATOM 0 HD13 ILE A 136 1.085 2.837 18.655 1.00 19.77 H new ATOM 2081 N ASN A 137 0.113 5.600 15.446 1.00 18.27 N ATOM 2082 CA ASN A 137 -0.017 6.341 14.200 1.00 17.67 C ATOM 2083 C ASN A 137 0.013 5.379 13.020 1.00 16.40 C ATOM 2084 O ASN A 137 0.489 4.255 13.157 1.00 16.12 O ATOM 2085 CB ASN A 137 1.093 7.388 14.068 1.00 18.25 C ATOM 2086 CG ASN A 137 2.431 6.888 14.573 1.00 18.20 C ATOM 2087 OD1 ASN A 137 3.221 6.325 13.819 1.00 18.03 O ATOM 2088 ND2 ASN A 137 2.692 7.097 15.858 1.00 18.49 N ATOM 0 H ASN A 137 1.014 5.137 15.565 1.00 18.27 H new ATOM 0 HA ASN A 137 -0.973 6.865 14.206 1.00 17.67 H new ATOM 0 HB2 ASN A 137 1.190 7.679 13.022 1.00 18.25 H new ATOM 0 HB3 ASN A 137 0.811 8.283 14.623 1.00 18.25 H new ATOM 0 HD21 ASN A 137 3.578 6.786 16.256 1.00 18.49 H new ATOM 0 HD22 ASN A 137 2.006 7.569 16.447 1.00 18.49 H new ATOM 2095 N TYR A 138 -0.525 5.809 11.879 1.00 15.73 N ATOM 2096 CA TYR A 138 -0.565 4.976 10.675 1.00 14.51 C ATOM 2097 C TYR A 138 0.719 4.157 10.493 1.00 14.21 C ATOM 2098 O TYR A 138 0.709 3.113 9.841 1.00 13.35 O ATOM 2099 CB TYR A 138 -0.803 5.857 9.445 1.00 14.11 C ATOM 2100 CG TYR A 138 -0.615 5.142 8.125 1.00 12.93 C ATOM 2101 CD1 TYR A 138 -1.417 4.064 7.772 1.00 12.24 C ATOM 2102 CD2 TYR A 138 0.367 5.551 7.230 1.00 12.60 C ATOM 2103 CE1 TYR A 138 -1.246 3.414 6.565 1.00 11.18 C ATOM 2104 CE2 TYR A 138 0.543 4.905 6.021 1.00 11.56 C ATOM 2105 CZ TYR A 138 -0.265 3.838 5.694 1.00 10.81 C ATOM 2106 OH TYR A 138 -0.092 3.194 4.491 1.00 9.80 O ATOM 0 H TYR A 138 -0.941 6.733 11.762 1.00 15.73 H new ATOM 0 HA TYR A 138 -1.387 4.269 10.791 1.00 14.51 H new ATOM 0 HB2 TYR A 138 -1.816 6.256 9.488 1.00 14.11 H new ATOM 0 HB3 TYR A 138 -0.123 6.708 9.485 1.00 14.11 H new ATOM 0 HD1 TYR A 138 -2.186 3.729 8.452 1.00 12.24 H new ATOM 0 HD2 TYR A 138 1.002 6.387 7.483 1.00 12.60 H new ATOM 0 HE1 TYR A 138 -1.878 2.578 6.305 1.00 11.18 H new ATOM 0 HE2 TYR A 138 1.310 5.235 5.336 1.00 11.56 H new ATOM 0 HH TYR A 138 0.708 3.543 4.045 1.00 9.80 H new ATOM 2116 N GLU A 139 1.818 4.614 11.085 1.00 15.05 N ATOM 2117 CA GLU A 139 3.089 3.907 10.970 1.00 15.05 C ATOM 2118 C GLU A 139 3.140 2.730 11.940 1.00 15.40 C ATOM 2119 O GLU A 139 3.359 1.585 11.533 1.00 14.88 O ATOM 2120 CB GLU A 139 4.262 4.854 11.231 1.00 16.02 C ATOM 2121 CG GLU A 139 4.422 5.940 10.177 1.00 15.89 C ATOM 2122 CD GLU A 139 3.281 6.940 10.187 1.00 16.64 C ATOM 2123 OE1 GLU A 139 3.340 7.900 10.984 1.00 16.91 O ATOM 2124 OE2 GLU A 139 2.329 6.762 9.398 1.00 17.06 O ATOM 0 H GLU A 139 1.855 5.465 11.646 1.00 15.05 H new ATOM 0 HA GLU A 139 3.171 3.525 9.952 1.00 15.05 H new ATOM 0 HB2 GLU A 139 4.128 5.324 12.205 1.00 16.02 H new ATOM 0 HB3 GLU A 139 5.182 4.272 11.282 1.00 16.02 H new ATOM 0 HG2 GLU A 139 5.362 6.466 10.343 1.00 15.89 H new ATOM 0 HG3 GLU A 139 4.486 5.478 9.192 1.00 15.89 H new ATOM 2131 N GLU A 140 2.928 3.013 13.223 1.00 16.39 N ATOM 2132 CA GLU A 140 2.945 1.970 14.242 1.00 16.95 C ATOM 2133 C GLU A 140 1.869 0.932 13.942 1.00 16.22 C ATOM 2134 O GLU A 140 2.042 -0.257 14.205 1.00 16.37 O ATOM 2135 CB GLU A 140 2.715 2.558 15.639 1.00 18.12 C ATOM 2136 CG GLU A 140 3.317 3.940 15.846 1.00 18.79 C ATOM 2137 CD GLU A 140 3.692 4.194 17.291 1.00 20.10 C ATOM 2138 OE1 GLU A 140 2.865 3.898 18.176 1.00 20.52 O ATOM 2139 OE2 GLU A 140 4.812 4.688 17.538 1.00 20.75 O ATOM 0 H GLU A 140 2.744 3.951 13.579 1.00 16.39 H new ATOM 0 HA GLU A 140 3.927 1.497 14.224 1.00 16.95 H new ATOM 0 HB2 GLU A 140 1.642 2.611 15.826 1.00 18.12 H new ATOM 0 HB3 GLU A 140 3.135 1.878 16.380 1.00 18.12 H new ATOM 0 HG2 GLU A 140 4.203 4.045 15.219 1.00 18.79 H new ATOM 0 HG3 GLU A 140 2.604 4.697 15.520 1.00 18.79 H new ATOM 2146 N PHE A 141 0.759 1.401 13.383 1.00 15.58 N ATOM 2147 CA PHE A 141 -0.356 0.531 13.038 1.00 14.98 C ATOM 2148 C PHE A 141 0.047 -0.463 11.954 1.00 14.05 C ATOM 2149 O PHE A 141 -0.096 -1.672 12.126 1.00 14.12 O ATOM 2150 CB PHE A 141 -1.545 1.372 12.567 1.00 14.62 C ATOM 2151 CG PHE A 141 -2.747 0.558 12.181 1.00 14.16 C ATOM 2152 CD1 PHE A 141 -2.878 0.063 10.894 1.00 13.21 C ATOM 2153 CD2 PHE A 141 -3.743 0.290 13.104 1.00 14.81 C ATOM 2154 CE1 PHE A 141 -3.980 -0.686 10.536 1.00 12.98 C ATOM 2155 CE2 PHE A 141 -4.849 -0.459 12.752 1.00 14.61 C ATOM 2156 CZ PHE A 141 -4.967 -0.948 11.466 1.00 13.73 C ATOM 0 H PHE A 141 0.608 2.385 13.159 1.00 15.58 H new ATOM 0 HA PHE A 141 -0.644 -0.032 13.926 1.00 14.98 H new ATOM 0 HB2 PHE A 141 -1.826 2.064 13.361 1.00 14.62 H new ATOM 0 HB3 PHE A 141 -1.236 1.975 11.713 1.00 14.62 H new ATOM 0 HD1 PHE A 141 -2.109 0.266 10.163 1.00 13.21 H new ATOM 0 HD2 PHE A 141 -3.654 0.671 14.111 1.00 14.81 H new ATOM 0 HE1 PHE A 141 -4.071 -1.067 9.530 1.00 12.98 H new ATOM 0 HE2 PHE A 141 -5.620 -0.662 13.481 1.00 14.61 H new ATOM 0 HZ PHE A 141 -5.830 -1.535 11.188 1.00 13.73 H new ATOM 2166 N VAL A 142 0.545 0.058 10.836 1.00 13.29 N ATOM 2167 CA VAL A 142 0.976 -0.778 9.720 1.00 12.40 C ATOM 2168 C VAL A 142 1.898 -1.901 10.192 1.00 12.96 C ATOM 2169 O VAL A 142 1.843 -3.020 9.676 1.00 12.60 O ATOM 2170 CB VAL A 142 1.695 0.061 8.640 1.00 11.84 C ATOM 2171 CG1 VAL A 142 2.520 -0.821 7.713 1.00 11.29 C ATOM 2172 CG2 VAL A 142 0.686 0.872 7.842 1.00 11.16 C ATOM 0 H VAL A 142 0.660 1.059 10.679 1.00 13.29 H new ATOM 0 HA VAL A 142 0.079 -1.219 9.286 1.00 12.40 H new ATOM 0 HB VAL A 142 2.377 0.745 9.145 1.00 11.84 H new ATOM 0 HG11 VAL A 142 3.013 -0.201 6.964 1.00 11.29 H new ATOM 0 HG12 VAL A 142 3.272 -1.356 8.293 1.00 11.29 H new ATOM 0 HG13 VAL A 142 1.867 -1.538 7.216 1.00 11.29 H new ATOM 0 HG21 VAL A 142 1.207 1.458 7.085 1.00 11.16 H new ATOM 0 HG22 VAL A 142 -0.020 0.198 7.357 1.00 11.16 H new ATOM 0 HG23 VAL A 142 0.147 1.542 8.512 1.00 11.16 H new ATOM 2182 N TRP A 143 2.733 -1.602 11.179 1.00 13.99 N ATOM 2183 CA TRP A 143 3.669 -2.589 11.707 1.00 14.75 C ATOM 2184 C TRP A 143 2.954 -3.728 12.439 1.00 15.22 C ATOM 2185 O TRP A 143 3.194 -4.899 12.153 1.00 15.27 O ATOM 2186 CB TRP A 143 4.667 -1.923 12.658 1.00 15.86 C ATOM 2187 CG TRP A 143 5.707 -2.864 13.180 1.00 16.76 C ATOM 2188 CD1 TRP A 143 6.939 -3.119 12.649 1.00 16.94 C ATOM 2189 CD2 TRP A 143 5.593 -3.682 14.341 1.00 17.71 C ATOM 2190 NE1 TRP A 143 7.597 -4.053 13.417 1.00 17.96 N ATOM 2191 CE2 TRP A 143 6.788 -4.413 14.464 1.00 18.43 C ATOM 2192 CE3 TRP A 143 4.591 -3.861 15.287 1.00 18.11 C ATOM 2193 CZ2 TRP A 143 7.001 -5.316 15.503 1.00 19.50 C ATOM 2194 CZ3 TRP A 143 4.797 -4.756 16.319 1.00 19.15 C ATOM 2195 CH2 TRP A 143 5.997 -5.475 16.420 1.00 19.83 C ATOM 0 H TRP A 143 2.782 -0.688 11.629 1.00 13.99 H new ATOM 0 HA TRP A 143 4.197 -3.014 10.854 1.00 14.75 H new ATOM 0 HB2 TRP A 143 5.159 -1.100 12.139 1.00 15.86 H new ATOM 0 HB3 TRP A 143 4.124 -1.490 13.498 1.00 15.86 H new ATOM 0 HD1 TRP A 143 7.338 -2.656 11.758 1.00 16.94 H new ATOM 0 HE1 TRP A 143 8.533 -4.417 13.237 1.00 17.96 H new ATOM 0 HE3 TRP A 143 3.665 -3.309 15.217 1.00 18.11 H new ATOM 0 HZ2 TRP A 143 7.924 -5.870 15.582 1.00 19.50 H new ATOM 0 HZ3 TRP A 143 4.024 -4.904 17.058 1.00 19.15 H new ATOM 0 HH2 TRP A 143 6.132 -6.168 17.237 1.00 19.83 H new ATOM 2206 N MET A 144 2.077 -3.382 13.379 1.00 15.69 N ATOM 2207 CA MET A 144 1.370 -4.386 14.174 1.00 16.33 C ATOM 2208 C MET A 144 0.295 -5.127 13.381 1.00 15.63 C ATOM 2209 O MET A 144 -0.046 -6.263 13.711 1.00 16.10 O ATOM 2210 CB MET A 144 0.753 -3.741 15.418 1.00 17.12 C ATOM 2211 CG MET A 144 -0.420 -2.817 15.128 1.00 16.59 C ATOM 2212 SD MET A 144 -0.793 -1.729 16.518 1.00 17.69 S ATOM 2213 CE MET A 144 -2.258 -0.892 15.920 1.00 17.05 C ATOM 0 H MET A 144 1.839 -2.417 13.609 1.00 15.69 H new ATOM 0 HA MET A 144 2.112 -5.127 14.472 1.00 16.33 H new ATOM 0 HB2 MET A 144 0.421 -4.529 16.095 1.00 17.12 H new ATOM 0 HB3 MET A 144 1.525 -3.176 15.941 1.00 17.12 H new ATOM 0 HG2 MET A 144 -0.196 -2.215 14.248 1.00 16.59 H new ATOM 0 HG3 MET A 144 -1.300 -3.414 14.890 1.00 16.59 H new ATOM 0 HE1 MET A 144 -2.850 -0.545 16.767 1.00 17.05 H new ATOM 0 HE2 MET A 144 -1.965 -0.039 15.308 1.00 17.05 H new ATOM 0 HE3 MET A 144 -2.852 -1.582 15.320 1.00 17.05 H new ATOM 2223 N ILE A 145 -0.239 -4.497 12.342 1.00 14.62 N ATOM 2224 CA ILE A 145 -1.277 -5.134 11.538 1.00 14.03 C ATOM 2225 C ILE A 145 -0.690 -6.177 10.592 1.00 13.62 C ATOM 2226 O ILE A 145 -1.310 -7.206 10.328 1.00 13.74 O ATOM 2227 CB ILE A 145 -2.088 -4.109 10.722 1.00 13.14 C ATOM 2228 CG1 ILE A 145 -3.210 -4.823 9.973 1.00 12.79 C ATOM 2229 CG2 ILE A 145 -1.188 -3.366 9.751 1.00 12.26 C ATOM 2230 CD1 ILE A 145 -4.298 -3.898 9.473 1.00 12.37 C ATOM 0 H ILE A 145 0.024 -3.559 12.039 1.00 14.62 H new ATOM 0 HA ILE A 145 -1.947 -5.626 12.243 1.00 14.03 H new ATOM 0 HB ILE A 145 -2.524 -3.379 11.404 1.00 13.14 H new ATOM 0 HG12 ILE A 145 -2.784 -5.359 9.125 1.00 12.79 H new ATOM 0 HG13 ILE A 145 -3.655 -5.570 10.631 1.00 12.79 H new ATOM 0 HG21 ILE A 145 -1.779 -2.647 9.184 1.00 12.26 H new ATOM 0 HG22 ILE A 145 -0.411 -2.840 10.305 1.00 12.26 H new ATOM 0 HG23 ILE A 145 -0.727 -4.077 9.065 1.00 12.26 H new ATOM 0 HD11 ILE A 145 -5.059 -4.479 8.952 1.00 12.37 H new ATOM 0 HD12 ILE A 145 -4.752 -3.381 10.318 1.00 12.37 H new ATOM 0 HD13 ILE A 145 -3.868 -3.167 8.789 1.00 12.37 H new ATOM 2242 N SER A 146 0.509 -5.906 10.089 1.00 13.30 N ATOM 2243 CA SER A 146 1.180 -6.826 9.177 1.00 13.04 C ATOM 2244 C SER A 146 1.486 -8.141 9.882 1.00 14.17 C ATOM 2245 O SER A 146 1.804 -9.145 9.247 1.00 14.26 O ATOM 2246 CB SER A 146 2.473 -6.204 8.646 1.00 12.74 C ATOM 2247 OG SER A 146 3.123 -7.074 7.737 1.00 12.48 O ATOM 0 H SER A 146 1.036 -5.058 10.297 1.00 13.30 H new ATOM 0 HA SER A 146 0.515 -7.023 8.336 1.00 13.04 H new ATOM 0 HB2 SER A 146 2.249 -5.259 8.152 1.00 12.74 H new ATOM 0 HB3 SER A 146 3.140 -5.979 9.478 1.00 12.74 H new ATOM 0 HG SER A 146 2.785 -7.986 7.858 1.00 12.48 H new ATOM 2253 N GLN A 147 1.384 -8.116 11.206 1.00 15.13 N ATOM 2254 CA GLN A 147 1.647 -9.291 12.025 1.00 16.31 C ATOM 2255 C GLN A 147 0.416 -10.188 12.100 1.00 16.62 C ATOM 2256 O GLN A 147 0.524 -11.414 12.060 1.00 17.39 O ATOM 2257 CB GLN A 147 2.061 -8.853 13.430 1.00 17.27 C ATOM 2258 CG GLN A 147 3.059 -7.709 13.434 1.00 17.07 C ATOM 2259 CD GLN A 147 4.396 -8.100 12.829 1.00 17.24 C ATOM 2260 OE1 GLN A 147 4.801 -9.261 12.893 1.00 17.61 O ATOM 2261 NE2 GLN A 147 5.087 -7.132 12.240 1.00 17.09 N ATOM 0 H GLN A 147 1.119 -7.287 11.738 1.00 15.13 H new ATOM 0 HA GLN A 147 2.456 -9.861 11.567 1.00 16.31 H new ATOM 0 HB2 GLN A 147 1.173 -8.553 13.986 1.00 17.27 H new ATOM 0 HB3 GLN A 147 2.493 -9.704 13.956 1.00 17.27 H new ATOM 0 HG2 GLN A 147 2.645 -6.868 12.878 1.00 17.07 H new ATOM 0 HG3 GLN A 147 3.213 -7.369 14.458 1.00 17.07 H new ATOM 0 HE21 GLN A 147 4.713 -6.184 12.210 1.00 17.09 H new ATOM 0 HE22 GLN A 147 5.992 -7.336 11.817 1.00 17.09 H new ATOM 2270 N LYS A 148 -0.754 -9.565 12.210 1.00 16.13 N ATOM 2271 CA LYS A 148 -2.011 -10.299 12.293 1.00 16.53 C ATOM 2272 C LYS A 148 -2.261 -11.102 11.020 1.00 16.32 C ATOM 2273 O LYS A 148 -2.796 -10.523 10.051 1.00 16.11 O ATOM 2274 CB LYS A 148 -3.168 -9.333 12.538 1.00 16.16 C ATOM 2275 CG LYS A 148 -3.002 -8.489 13.791 1.00 16.47 C ATOM 2276 CD LYS A 148 -4.116 -7.463 13.924 1.00 16.26 C ATOM 2277 CE LYS A 148 -3.935 -6.604 15.165 1.00 16.41 C ATOM 2278 NZ LYS A 148 -3.967 -7.417 16.412 1.00 16.72 N ATOM 2279 OXT LYS A 148 -1.921 -12.303 11.003 1.00 16.50 O ATOM 0 H LYS A 148 -0.857 -8.551 12.244 1.00 16.13 H new ATOM 0 HA LYS A 148 -1.943 -10.996 13.128 1.00 16.53 H new ATOM 0 HB2 LYS A 148 -3.268 -8.673 11.676 1.00 16.16 H new ATOM 0 HB3 LYS A 148 -4.095 -9.901 12.613 1.00 16.16 H new ATOM 0 HG2 LYS A 148 -2.995 -9.136 14.668 1.00 16.47 H new ATOM 0 HG3 LYS A 148 -2.039 -7.980 13.763 1.00 16.47 H new ATOM 0 HD2 LYS A 148 -4.134 -6.827 13.039 1.00 16.26 H new ATOM 0 HD3 LYS A 148 -5.078 -7.973 13.970 1.00 16.26 H new ATOM 0 HE2 LYS A 148 -2.986 -6.072 15.103 1.00 16.41 H new ATOM 0 HE3 LYS A 148 -4.721 -5.850 15.203 1.00 16.41 H new ATOM 0 HZ1 LYS A 148 -4.062 -6.788 17.234 1.00 16.72 H new ATOM 0 HZ2 LYS A 148 -4.776 -8.070 16.380 1.00 16.72 H new ATOM 0 HZ3 LYS A 148 -3.085 -7.962 16.494 1.00 16.72 H new TER 2293 LYS A 148 HETATM 2294 CA CA A 149 -7.551 9.315 18.276 1.00 22.19 CA HETATM 2295 CA CA A 150 3.535 5.916 19.362 1.00 22.24 CA