USER MOD reduce.3.24.130724 H: found=0, std=0, add=917, rem=0, adj=28 USER MOD reduce.3.24.130724 removed 913 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 108 THR OG1 : rot 44:sc= -0.54! USER MOD Set 1.2: A 110 ASN :FLIP amide:sc= -9.12! C(o=-19!,f=-9.7!) USER MOD Set 2.1: A 94 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Set 2.2: A 95 THR OG1 : rot 60:sc= 0.116 USER MOD Set 3.1: A 37 LYS NZ :NH3+ -138:sc= -0.402 (180deg=-1.29) USER MOD Set 3.2: A 67 HIS : no HD1:sc= -0.199 K(o=-0.6,f=-3.6) USER MOD Set 4.1: A 40 HIS : no HD1:sc= -4.13! C(o=-3.3!,f=-3.9!) USER MOD Set 4.2: A 74 SER OG : rot -87:sc= 0.87 USER MOD Set 5.1: A 11 LYS NZ :NH3+ -128:sc= -0.657! (180deg=-2.68!) USER MOD Set 5.2: A 12 ASN : amide:sc= -1.59 K(o=-2.2,f=-5!) USER MOD Single : A 1 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 1 MET N :NH3+ -162:sc= -0.0786 (180deg=-0.514) USER MOD Single : A 2 CYS SG : rot -45:sc= -0.187 USER MOD Single : A 4 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 7 MET CE :methyl -164:sc= -0.103 (180deg=-0.194) USER MOD Single : A 19 LYS NZ :NH3+ -165:sc= 0.104 (180deg=0.0577) USER MOD Single : A 21 TYR OH : rot 180:sc= 0 USER MOD Single : A 24 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 29 ASN :FLIP amide:sc= -0.833 F(o=-3.2!,f=-0.83) USER MOD Single : A 31 THR OG1 : rot 180:sc= 0.0854 USER MOD Single : A 41 TYR OH : rot -177:sc= -1.1 USER MOD Single : A 45 CYS SG : rot -9:sc= -1.2! USER MOD Single : A 47 GLN :FLIP amide:sc= -1.61! C(o=-3.1!,f=-1.6!) USER MOD Single : A 57 LYS NZ :NH3+ -151:sc= -0.174 (180deg=-0.997) USER MOD Single : A 62 ASN :FLIP amide:sc= -1.09 F(o=-8.3!,f=-1.1) USER MOD Single : A 66 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 68 HIS : no HE2:sc= -2.27! C(o=-2.3!,f=-7.5!) USER MOD Single : A 70 THR OG1 : rot -158:sc= -11.6! USER MOD Single : A 77 TYR OH : rot -130:sc= -0.352 USER MOD Single : A 80 HIS : no HD1:sc= -0.0288 K(o=-0.029,f=-1.7!) USER MOD Single : A 82 SER OG : rot 180:sc= 0 USER MOD Single : A 83 CYS SG : rot -170:sc= -1.96 USER MOD Single : A 85 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 89 SER OG : rot 180:sc= 0 USER MOD Single : A 90 LYS NZ :NH3+ -160:sc= -0.412 (180deg=-1.64!) USER MOD Single : A 97 LYS NZ :NH3+ 160:sc= -0.0991 (180deg=-0.764) USER MOD Single : A 103 THR OG1 : rot 160:sc= -4.06! USER MOD Single : A 111 GLN : amide:sc= 0 X(o=0,f=-0.16) USER MOD Single : A 114 LYS NZ :NH3+ 150:sc= -0.204 (180deg=-1.29) USER MOD Single : A 118 GLN : amide:sc= 0 X(o=0,f=-0.35) USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 -13.675 -11.712 82.024 1.00 0.00 N ATOM 2 CA MET A 1 -12.332 -11.067 81.974 1.00 0.00 C ATOM 3 C MET A 1 -11.886 -10.710 83.395 1.00 0.00 C ATOM 4 O MET A 1 -12.553 -9.975 84.098 1.00 0.00 O ATOM 5 CB MET A 1 -12.408 -9.793 81.130 1.00 0.00 C ATOM 6 CG MET A 1 -13.242 -10.059 79.875 1.00 0.00 C ATOM 7 SD MET A 1 -12.555 -11.475 78.981 1.00 0.00 S ATOM 8 CE MET A 1 -12.980 -10.920 77.312 1.00 0.00 C ATOM 0 H1 MET A 1 -13.848 -12.222 81.135 1.00 0.00 H new ATOM 0 H2 MET A 1 -13.709 -12.381 82.819 1.00 0.00 H new ATOM 0 H3 MET A 1 -14.406 -10.983 82.153 1.00 0.00 H new ATOM 0 HA MET A 1 -11.615 -11.756 81.528 1.00 0.00 H new ATOM 0 HB2 MET A 1 -12.854 -8.986 81.711 1.00 0.00 H new ATOM 0 HB3 MET A 1 -11.405 -9.469 80.851 1.00 0.00 H new ATOM 0 HG2 MET A 1 -14.278 -10.257 80.149 1.00 0.00 H new ATOM 0 HG3 MET A 1 -13.245 -9.177 79.234 1.00 0.00 H new ATOM 0 HE1 MET A 1 -12.642 -11.659 76.586 1.00 0.00 H new ATOM 0 HE2 MET A 1 -14.061 -10.801 77.232 1.00 0.00 H new ATOM 0 HE3 MET A 1 -12.494 -9.965 77.111 1.00 0.00 H new ATOM 20 N CYS A 2 -10.762 -11.223 83.824 1.00 0.00 N ATOM 21 CA CYS A 2 -10.272 -10.914 85.199 1.00 0.00 C ATOM 22 C CYS A 2 -8.749 -10.756 85.175 1.00 0.00 C ATOM 23 O CYS A 2 -8.042 -11.334 85.977 1.00 0.00 O ATOM 24 CB CYS A 2 -10.653 -12.058 86.143 1.00 0.00 C ATOM 25 SG CYS A 2 -10.768 -11.427 87.835 1.00 0.00 S ATOM 0 H CYS A 2 -10.162 -11.843 83.280 1.00 0.00 H new ATOM 0 HA CYS A 2 -10.727 -9.987 85.548 1.00 0.00 H new ATOM 0 HB2 CYS A 2 -11.605 -12.493 85.840 1.00 0.00 H new ATOM 0 HB3 CYS A 2 -9.908 -12.852 86.089 1.00 0.00 H new ATOM 0 HG CYS A 2 -9.749 -10.658 88.082 1.00 0.00 H new ATOM 31 N ASP A 3 -8.237 -9.979 84.260 1.00 0.00 N ATOM 32 CA ASP A 3 -6.761 -9.788 84.184 1.00 0.00 C ATOM 33 C ASP A 3 -6.244 -9.234 85.513 1.00 0.00 C ATOM 34 O ASP A 3 -5.090 -9.392 85.859 1.00 0.00 O ATOM 35 CB ASP A 3 -6.431 -8.803 83.062 1.00 0.00 C ATOM 36 CG ASP A 3 -6.681 -9.463 81.705 1.00 0.00 C ATOM 37 OD1 ASP A 3 -7.815 -9.830 81.446 1.00 0.00 O ATOM 38 OD2 ASP A 3 -5.734 -9.585 80.944 1.00 0.00 O ATOM 0 H ASP A 3 -8.777 -9.468 83.562 1.00 0.00 H new ATOM 0 HA ASP A 3 -6.284 -10.747 83.981 1.00 0.00 H new ATOM 0 HB2 ASP A 3 -7.044 -7.907 83.160 1.00 0.00 H new ATOM 0 HB3 ASP A 3 -5.391 -8.487 83.137 1.00 0.00 H new ATOM 43 N LYS A 4 -7.089 -8.583 86.257 1.00 0.00 N ATOM 44 CA LYS A 4 -6.654 -8.012 87.560 1.00 0.00 C ATOM 45 C LYS A 4 -6.121 -9.129 88.461 1.00 0.00 C ATOM 46 O LYS A 4 -4.948 -9.179 88.776 1.00 0.00 O ATOM 47 CB LYS A 4 -7.848 -7.333 88.235 1.00 0.00 C ATOM 48 CG LYS A 4 -8.351 -6.183 87.356 1.00 0.00 C ATOM 49 CD LYS A 4 -9.285 -5.277 88.171 1.00 0.00 C ATOM 50 CE LYS A 4 -8.458 -4.248 88.949 1.00 0.00 C ATOM 51 NZ LYS A 4 -9.361 -3.213 89.524 1.00 0.00 N ATOM 0 H LYS A 4 -8.067 -8.420 86.018 1.00 0.00 H new ATOM 0 HA LYS A 4 -5.863 -7.281 87.392 1.00 0.00 H new ATOM 0 HB2 LYS A 4 -8.647 -8.057 88.397 1.00 0.00 H new ATOM 0 HB3 LYS A 4 -7.558 -6.955 89.215 1.00 0.00 H new ATOM 0 HG2 LYS A 4 -7.507 -5.606 86.978 1.00 0.00 H new ATOM 0 HG3 LYS A 4 -8.879 -6.580 86.489 1.00 0.00 H new ATOM 0 HD2 LYS A 4 -9.984 -4.769 87.507 1.00 0.00 H new ATOM 0 HD3 LYS A 4 -9.879 -5.877 88.861 1.00 0.00 H new ATOM 0 HE2 LYS A 4 -7.901 -4.741 89.745 1.00 0.00 H new ATOM 0 HE3 LYS A 4 -7.726 -3.781 88.290 1.00 0.00 H new ATOM 0 HZ1 LYS A 4 -8.798 -2.516 90.052 1.00 0.00 H new ATOM 0 HZ2 LYS A 4 -9.874 -2.734 88.756 1.00 0.00 H new ATOM 0 HZ3 LYS A 4 -10.043 -3.665 90.166 1.00 0.00 H new ATOM 65 N GLU A 5 -6.972 -10.023 88.882 1.00 0.00 N ATOM 66 CA GLU A 5 -6.517 -11.134 89.766 1.00 0.00 C ATOM 67 C GLU A 5 -5.288 -11.824 89.157 1.00 0.00 C ATOM 68 O GLU A 5 -4.460 -12.367 89.862 1.00 0.00 O ATOM 69 CB GLU A 5 -7.656 -12.150 89.923 1.00 0.00 C ATOM 70 CG GLU A 5 -8.467 -11.827 91.181 1.00 0.00 C ATOM 71 CD GLU A 5 -8.935 -10.371 91.132 1.00 0.00 C ATOM 72 OE1 GLU A 5 -9.313 -9.925 90.061 1.00 0.00 O ATOM 73 OE2 GLU A 5 -8.910 -9.728 92.168 1.00 0.00 O ATOM 0 H GLU A 5 -7.966 -10.033 88.652 1.00 0.00 H new ATOM 0 HA GLU A 5 -6.245 -10.731 90.742 1.00 0.00 H new ATOM 0 HB2 GLU A 5 -8.302 -12.124 89.046 1.00 0.00 H new ATOM 0 HB3 GLU A 5 -7.249 -13.159 89.990 1.00 0.00 H new ATOM 0 HG2 GLU A 5 -9.327 -12.493 91.252 1.00 0.00 H new ATOM 0 HG3 GLU A 5 -7.859 -11.994 92.070 1.00 0.00 H new ATOM 80 N PHE A 6 -5.162 -11.817 87.859 1.00 0.00 N ATOM 81 CA PHE A 6 -3.990 -12.485 87.222 1.00 0.00 C ATOM 82 C PHE A 6 -2.707 -11.714 87.557 1.00 0.00 C ATOM 83 O PHE A 6 -1.834 -12.217 88.236 1.00 0.00 O ATOM 84 CB PHE A 6 -4.202 -12.536 85.700 1.00 0.00 C ATOM 85 CG PHE A 6 -2.895 -12.799 84.986 1.00 0.00 C ATOM 86 CD1 PHE A 6 -1.964 -13.701 85.521 1.00 0.00 C ATOM 87 CD2 PHE A 6 -2.619 -12.143 83.780 1.00 0.00 C ATOM 88 CE1 PHE A 6 -0.758 -13.939 84.850 1.00 0.00 C ATOM 89 CE2 PHE A 6 -1.413 -12.384 83.111 1.00 0.00 C ATOM 90 CZ PHE A 6 -0.484 -13.283 83.646 1.00 0.00 C ATOM 0 H PHE A 6 -5.818 -11.379 87.212 1.00 0.00 H new ATOM 0 HA PHE A 6 -3.894 -13.501 87.604 1.00 0.00 H new ATOM 0 HB2 PHE A 6 -4.920 -13.318 85.454 1.00 0.00 H new ATOM 0 HB3 PHE A 6 -4.627 -11.593 85.355 1.00 0.00 H new ATOM 0 HD1 PHE A 6 -2.177 -14.211 86.449 1.00 0.00 H new ATOM 0 HD2 PHE A 6 -3.337 -11.451 83.366 1.00 0.00 H new ATOM 0 HE1 PHE A 6 -0.038 -14.630 85.263 1.00 0.00 H new ATOM 0 HE2 PHE A 6 -1.200 -11.876 82.182 1.00 0.00 H new ATOM 0 HZ PHE A 6 0.445 -13.470 83.129 1.00 0.00 H new ATOM 100 N MET A 7 -2.576 -10.503 87.085 1.00 0.00 N ATOM 101 CA MET A 7 -1.336 -9.727 87.382 1.00 0.00 C ATOM 102 C MET A 7 -1.307 -9.333 88.865 1.00 0.00 C ATOM 103 O MET A 7 -0.269 -9.320 89.496 1.00 0.00 O ATOM 104 CB MET A 7 -1.282 -8.472 86.496 1.00 0.00 C ATOM 105 CG MET A 7 -2.008 -7.308 87.181 1.00 0.00 C ATOM 106 SD MET A 7 -2.143 -5.916 86.028 1.00 0.00 S ATOM 107 CE MET A 7 -3.632 -6.465 85.157 1.00 0.00 C ATOM 0 H MET A 7 -3.267 -10.020 86.511 1.00 0.00 H new ATOM 0 HA MET A 7 -0.465 -10.347 87.168 1.00 0.00 H new ATOM 0 HB2 MET A 7 -0.245 -8.199 86.302 1.00 0.00 H new ATOM 0 HB3 MET A 7 -1.743 -8.680 85.530 1.00 0.00 H new ATOM 0 HG2 MET A 7 -3.000 -7.624 87.504 1.00 0.00 H new ATOM 0 HG3 MET A 7 -1.464 -7.002 88.075 1.00 0.00 H new ATOM 0 HE1 MET A 7 -3.735 -5.909 84.225 1.00 0.00 H new ATOM 0 HE2 MET A 7 -3.553 -7.530 84.937 1.00 0.00 H new ATOM 0 HE3 MET A 7 -4.506 -6.288 85.783 1.00 0.00 H new ATOM 117 N TRP A 8 -2.437 -9.005 89.427 1.00 0.00 N ATOM 118 CA TRP A 8 -2.466 -8.612 90.864 1.00 0.00 C ATOM 119 C TRP A 8 -1.750 -9.681 91.693 1.00 0.00 C ATOM 120 O TRP A 8 -1.456 -9.489 92.855 1.00 0.00 O ATOM 121 CB TRP A 8 -3.922 -8.488 91.327 1.00 0.00 C ATOM 122 CG TRP A 8 -3.967 -7.977 92.730 1.00 0.00 C ATOM 123 CD1 TRP A 8 -3.929 -8.749 93.839 1.00 0.00 C ATOM 124 CD2 TRP A 8 -4.064 -6.598 93.193 1.00 0.00 C ATOM 125 NE1 TRP A 8 -3.996 -7.934 94.954 1.00 0.00 N ATOM 126 CE2 TRP A 8 -4.080 -6.600 94.608 1.00 0.00 C ATOM 127 CE3 TRP A 8 -4.139 -5.360 92.530 1.00 0.00 C ATOM 128 CZ2 TRP A 8 -4.166 -5.415 95.339 1.00 0.00 C ATOM 129 CZ3 TRP A 8 -4.226 -4.165 93.262 1.00 0.00 C ATOM 130 CH2 TRP A 8 -4.241 -4.193 94.665 1.00 0.00 C ATOM 0 H TRP A 8 -3.341 -8.992 88.954 1.00 0.00 H new ATOM 0 HA TRP A 8 -1.963 -7.654 90.995 1.00 0.00 H new ATOM 0 HB2 TRP A 8 -4.466 -7.813 90.667 1.00 0.00 H new ATOM 0 HB3 TRP A 8 -4.416 -9.458 91.268 1.00 0.00 H new ATOM 0 HD1 TRP A 8 -3.858 -9.827 93.852 1.00 0.00 H new ATOM 0 HE1 TRP A 8 -3.985 -8.276 95.915 1.00 0.00 H new ATOM 0 HE3 TRP A 8 -4.130 -5.328 91.451 1.00 0.00 H new ATOM 0 HZ2 TRP A 8 -4.175 -5.442 96.419 1.00 0.00 H new ATOM 0 HZ3 TRP A 8 -4.282 -3.220 92.743 1.00 0.00 H new ATOM 0 HH2 TRP A 8 -4.310 -3.271 95.223 1.00 0.00 H new ATOM 141 N ALA A 9 -1.466 -10.808 91.097 1.00 0.00 N ATOM 142 CA ALA A 9 -0.767 -11.895 91.837 1.00 0.00 C ATOM 143 C ALA A 9 0.737 -11.631 91.823 1.00 0.00 C ATOM 144 O ALA A 9 1.391 -11.673 92.844 1.00 0.00 O ATOM 145 CB ALA A 9 -1.063 -13.241 91.174 1.00 0.00 C ATOM 0 H ALA A 9 -1.690 -11.022 90.125 1.00 0.00 H new ATOM 0 HA ALA A 9 -1.120 -11.920 92.868 1.00 0.00 H new ATOM 0 HB1 ALA A 9 -0.550 -14.035 91.717 1.00 0.00 H new ATOM 0 HB2 ALA A 9 -2.137 -13.426 91.189 1.00 0.00 H new ATOM 0 HB3 ALA A 9 -0.713 -13.223 90.142 1.00 0.00 H new ATOM 151 N LEU A 10 1.293 -11.339 90.677 1.00 0.00 N ATOM 152 CA LEU A 10 2.755 -11.052 90.610 1.00 0.00 C ATOM 153 C LEU A 10 3.153 -10.154 91.778 1.00 0.00 C ATOM 154 O LEU A 10 4.222 -10.261 92.341 1.00 0.00 O ATOM 155 CB LEU A 10 3.074 -10.259 89.344 1.00 0.00 C ATOM 156 CG LEU A 10 2.640 -11.006 88.075 1.00 0.00 C ATOM 157 CD1 LEU A 10 2.063 -9.995 87.074 1.00 0.00 C ATOM 158 CD2 LEU A 10 3.858 -11.698 87.444 1.00 0.00 C ATOM 0 H LEU A 10 0.799 -11.287 89.786 1.00 0.00 H new ATOM 0 HA LEU A 10 3.286 -12.004 90.629 1.00 0.00 H new ATOM 0 HB2 LEU A 10 2.572 -9.292 89.385 1.00 0.00 H new ATOM 0 HB3 LEU A 10 4.145 -10.061 89.300 1.00 0.00 H new ATOM 0 HG LEU A 10 1.888 -11.753 88.329 1.00 0.00 H new ATOM 0 HD11 LEU A 10 1.752 -10.516 86.169 1.00 0.00 H new ATOM 0 HD12 LEU A 10 1.203 -9.494 87.518 1.00 0.00 H new ATOM 0 HD13 LEU A 10 2.824 -9.256 86.824 1.00 0.00 H new ATOM 0 HD21 LEU A 10 3.549 -12.228 86.543 1.00 0.00 H new ATOM 0 HD22 LEU A 10 4.608 -10.950 87.186 1.00 0.00 H new ATOM 0 HD23 LEU A 10 4.282 -12.407 88.155 1.00 0.00 H new ATOM 170 N LYS A 11 2.304 -9.221 92.080 1.00 0.00 N ATOM 171 CA LYS A 11 2.596 -8.221 93.146 1.00 0.00 C ATOM 172 C LYS A 11 2.234 -8.721 94.554 1.00 0.00 C ATOM 173 O LYS A 11 3.046 -8.664 95.457 1.00 0.00 O ATOM 174 CB LYS A 11 1.769 -6.981 92.841 1.00 0.00 C ATOM 175 CG LYS A 11 2.091 -5.859 93.842 1.00 0.00 C ATOM 176 CD LYS A 11 0.829 -5.033 94.091 1.00 0.00 C ATOM 177 CE LYS A 11 -0.219 -5.900 94.808 1.00 0.00 C ATOM 178 NZ LYS A 11 -1.305 -6.267 93.855 1.00 0.00 N ATOM 0 H LYS A 11 1.399 -9.103 91.625 1.00 0.00 H new ATOM 0 HA LYS A 11 3.668 -8.022 93.146 1.00 0.00 H new ATOM 0 HB2 LYS A 11 1.974 -6.641 91.826 1.00 0.00 H new ATOM 0 HB3 LYS A 11 0.707 -7.224 92.887 1.00 0.00 H new ATOM 0 HG2 LYS A 11 2.454 -6.283 94.778 1.00 0.00 H new ATOM 0 HG3 LYS A 11 2.886 -5.223 93.451 1.00 0.00 H new ATOM 0 HD2 LYS A 11 1.068 -4.158 94.696 1.00 0.00 H new ATOM 0 HD3 LYS A 11 0.429 -4.667 93.145 1.00 0.00 H new ATOM 0 HE2 LYS A 11 0.250 -6.801 95.204 1.00 0.00 H new ATOM 0 HE3 LYS A 11 -0.635 -5.357 95.657 1.00 0.00 H new ATOM 0 HZ1 LYS A 11 -2.227 -6.024 94.270 1.00 0.00 H new ATOM 0 HZ2 LYS A 11 -1.177 -5.744 92.965 1.00 0.00 H new ATOM 0 HZ3 LYS A 11 -1.269 -7.289 93.665 1.00 0.00 H new ATOM 192 N ASN A 12 1.024 -9.158 94.771 1.00 0.00 N ATOM 193 CA ASN A 12 0.633 -9.588 96.146 1.00 0.00 C ATOM 194 C ASN A 12 1.268 -10.936 96.489 1.00 0.00 C ATOM 195 O ASN A 12 0.778 -11.678 97.320 1.00 0.00 O ATOM 196 CB ASN A 12 -0.889 -9.699 96.207 1.00 0.00 C ATOM 197 CG ASN A 12 -1.453 -8.563 97.057 1.00 0.00 C ATOM 198 OD1 ASN A 12 -2.017 -7.622 96.538 1.00 0.00 O ATOM 199 ND2 ASN A 12 -1.316 -8.610 98.351 1.00 0.00 N ATOM 0 H ASN A 12 0.294 -9.236 94.063 1.00 0.00 H new ATOM 0 HA ASN A 12 0.985 -8.853 96.870 1.00 0.00 H new ATOM 0 HB2 ASN A 12 -1.307 -9.656 95.201 1.00 0.00 H new ATOM 0 HB3 ASN A 12 -1.177 -10.661 96.631 1.00 0.00 H new ATOM 0 HD21 ASN A 12 -1.683 -7.855 98.930 1.00 0.00 H new ATOM 0 HD22 ASN A 12 -0.842 -9.402 98.785 1.00 0.00 H new ATOM 206 N GLY A 13 2.370 -11.239 95.882 1.00 0.00 N ATOM 207 CA GLY A 13 3.062 -12.514 96.185 1.00 0.00 C ATOM 208 C GLY A 13 2.111 -13.701 96.044 1.00 0.00 C ATOM 209 O GLY A 13 2.445 -14.804 96.427 1.00 0.00 O ATOM 0 H GLY A 13 2.827 -10.654 95.182 1.00 0.00 H new ATOM 0 HA2 GLY A 13 3.910 -12.641 95.511 1.00 0.00 H new ATOM 0 HA3 GLY A 13 3.462 -12.483 97.198 1.00 0.00 H new ATOM 213 N ASP A 14 0.945 -13.515 95.485 1.00 0.00 N ATOM 214 CA ASP A 14 0.033 -14.677 95.324 1.00 0.00 C ATOM 215 C ASP A 14 0.668 -15.618 94.308 1.00 0.00 C ATOM 216 O ASP A 14 0.057 -16.065 93.359 1.00 0.00 O ATOM 217 CB ASP A 14 -1.328 -14.218 94.826 1.00 0.00 C ATOM 218 CG ASP A 14 -1.766 -12.970 95.599 1.00 0.00 C ATOM 219 OD1 ASP A 14 -1.746 -13.016 96.819 1.00 0.00 O ATOM 220 OD2 ASP A 14 -2.116 -11.991 94.961 1.00 0.00 O ATOM 0 H ASP A 14 0.591 -12.623 95.139 1.00 0.00 H new ATOM 0 HA ASP A 14 -0.113 -15.180 96.280 1.00 0.00 H new ATOM 0 HB2 ASP A 14 -1.281 -13.999 93.759 1.00 0.00 H new ATOM 0 HB3 ASP A 14 -2.061 -15.014 94.956 1.00 0.00 H new ATOM 225 N LEU A 15 1.913 -15.894 94.521 1.00 0.00 N ATOM 226 CA LEU A 15 2.685 -16.780 93.619 1.00 0.00 C ATOM 227 C LEU A 15 1.830 -17.982 93.214 1.00 0.00 C ATOM 228 O LEU A 15 1.932 -18.495 92.118 1.00 0.00 O ATOM 229 CB LEU A 15 3.941 -17.228 94.381 1.00 0.00 C ATOM 230 CG LEU A 15 4.856 -18.103 93.510 1.00 0.00 C ATOM 231 CD1 LEU A 15 4.327 -19.539 93.464 1.00 0.00 C ATOM 232 CD2 LEU A 15 4.950 -17.536 92.085 1.00 0.00 C ATOM 0 H LEU A 15 2.448 -15.530 95.310 1.00 0.00 H new ATOM 0 HA LEU A 15 2.970 -16.259 92.705 1.00 0.00 H new ATOM 0 HB2 LEU A 15 4.492 -16.351 94.720 1.00 0.00 H new ATOM 0 HB3 LEU A 15 3.647 -17.784 95.271 1.00 0.00 H new ATOM 0 HG LEU A 15 5.852 -18.104 93.952 1.00 0.00 H new ATOM 0 HD11 LEU A 15 4.984 -20.149 92.844 1.00 0.00 H new ATOM 0 HD12 LEU A 15 4.298 -19.949 94.474 1.00 0.00 H new ATOM 0 HD13 LEU A 15 3.322 -19.543 93.042 1.00 0.00 H new ATOM 0 HD21 LEU A 15 5.602 -18.169 91.484 1.00 0.00 H new ATOM 0 HD22 LEU A 15 3.956 -17.510 91.638 1.00 0.00 H new ATOM 0 HD23 LEU A 15 5.358 -16.526 92.121 1.00 0.00 H new ATOM 244 N ASP A 16 0.978 -18.428 94.087 1.00 0.00 N ATOM 245 CA ASP A 16 0.113 -19.585 93.766 1.00 0.00 C ATOM 246 C ASP A 16 -0.815 -19.230 92.600 1.00 0.00 C ATOM 247 O ASP A 16 -1.251 -20.086 91.857 1.00 0.00 O ATOM 248 CB ASP A 16 -0.725 -19.923 94.994 1.00 0.00 C ATOM 249 CG ASP A 16 0.194 -20.228 96.179 1.00 0.00 C ATOM 250 OD1 ASP A 16 0.972 -21.161 96.074 1.00 0.00 O ATOM 251 OD2 ASP A 16 0.098 -19.528 97.174 1.00 0.00 O ATOM 0 H ASP A 16 0.844 -18.035 95.019 1.00 0.00 H new ATOM 0 HA ASP A 16 0.729 -20.439 93.484 1.00 0.00 H new ATOM 0 HB2 ASP A 16 -1.383 -19.089 95.237 1.00 0.00 H new ATOM 0 HB3 ASP A 16 -1.363 -20.782 94.786 1.00 0.00 H new ATOM 256 N GLU A 17 -1.134 -17.973 92.450 1.00 0.00 N ATOM 257 CA GLU A 17 -2.055 -17.558 91.349 1.00 0.00 C ATOM 258 C GLU A 17 -1.303 -17.466 90.012 1.00 0.00 C ATOM 259 O GLU A 17 -1.752 -17.987 89.010 1.00 0.00 O ATOM 260 CB GLU A 17 -2.678 -16.205 91.697 1.00 0.00 C ATOM 261 CG GLU A 17 -3.884 -16.426 92.613 1.00 0.00 C ATOM 262 CD GLU A 17 -5.055 -16.969 91.794 1.00 0.00 C ATOM 263 OE1 GLU A 17 -5.666 -16.190 91.081 1.00 0.00 O ATOM 264 OE2 GLU A 17 -5.319 -18.156 91.891 1.00 0.00 O ATOM 0 H GLU A 17 -0.797 -17.214 93.042 1.00 0.00 H new ATOM 0 HA GLU A 17 -2.840 -18.307 91.243 1.00 0.00 H new ATOM 0 HB2 GLU A 17 -1.943 -15.569 92.191 1.00 0.00 H new ATOM 0 HB3 GLU A 17 -2.987 -15.689 90.788 1.00 0.00 H new ATOM 0 HG2 GLU A 17 -3.627 -17.126 93.408 1.00 0.00 H new ATOM 0 HG3 GLU A 17 -4.166 -15.489 93.093 1.00 0.00 H new ATOM 271 N VAL A 18 -0.162 -16.829 89.973 1.00 0.00 N ATOM 272 CA VAL A 18 0.579 -16.751 88.676 1.00 0.00 C ATOM 273 C VAL A 18 1.001 -18.168 88.312 1.00 0.00 C ATOM 274 O VAL A 18 1.152 -18.524 87.160 1.00 0.00 O ATOM 275 CB VAL A 18 1.837 -15.883 88.831 1.00 0.00 C ATOM 276 CG1 VAL A 18 1.594 -14.488 88.257 1.00 0.00 C ATOM 277 CG2 VAL A 18 2.204 -15.783 90.312 1.00 0.00 C ATOM 0 H VAL A 18 0.284 -16.367 90.766 1.00 0.00 H new ATOM 0 HA VAL A 18 -0.055 -16.310 87.907 1.00 0.00 H new ATOM 0 HB VAL A 18 2.659 -16.343 88.283 1.00 0.00 H new ATOM 0 HG11 VAL A 18 2.494 -13.885 88.374 1.00 0.00 H new ATOM 0 HG12 VAL A 18 1.346 -14.568 87.199 1.00 0.00 H new ATOM 0 HG13 VAL A 18 0.768 -14.015 88.788 1.00 0.00 H new ATOM 0 HG21 VAL A 18 3.096 -15.168 90.425 1.00 0.00 H new ATOM 0 HG22 VAL A 18 1.379 -15.330 90.862 1.00 0.00 H new ATOM 0 HG23 VAL A 18 2.399 -16.780 90.707 1.00 0.00 H new ATOM 287 N LYS A 19 1.185 -18.971 89.314 1.00 0.00 N ATOM 288 CA LYS A 19 1.598 -20.383 89.114 1.00 0.00 C ATOM 289 C LYS A 19 0.562 -21.116 88.257 1.00 0.00 C ATOM 290 O LYS A 19 0.895 -21.951 87.440 1.00 0.00 O ATOM 291 CB LYS A 19 1.694 -21.018 90.510 1.00 0.00 C ATOM 292 CG LYS A 19 2.101 -22.498 90.442 1.00 0.00 C ATOM 293 CD LYS A 19 3.603 -22.639 90.163 1.00 0.00 C ATOM 294 CE LYS A 19 4.439 -21.870 91.203 1.00 0.00 C ATOM 295 NZ LYS A 19 5.726 -22.589 91.426 1.00 0.00 N ATOM 0 H LYS A 19 1.063 -18.701 90.290 1.00 0.00 H new ATOM 0 HA LYS A 19 2.555 -20.446 88.596 1.00 0.00 H new ATOM 0 HB2 LYS A 19 2.421 -20.469 91.109 1.00 0.00 H new ATOM 0 HB3 LYS A 19 0.732 -20.929 91.016 1.00 0.00 H new ATOM 0 HG2 LYS A 19 1.854 -22.991 91.382 1.00 0.00 H new ATOM 0 HG3 LYS A 19 1.533 -23.000 89.659 1.00 0.00 H new ATOM 0 HD2 LYS A 19 3.881 -23.693 90.177 1.00 0.00 H new ATOM 0 HD3 LYS A 19 3.826 -22.264 89.164 1.00 0.00 H new ATOM 0 HE2 LYS A 19 4.631 -20.855 90.854 1.00 0.00 H new ATOM 0 HE3 LYS A 19 3.888 -21.786 92.140 1.00 0.00 H new ATOM 0 HZ1 LYS A 19 6.178 -22.232 92.292 1.00 0.00 H new ATOM 0 HZ2 LYS A 19 5.542 -23.608 91.527 1.00 0.00 H new ATOM 0 HZ3 LYS A 19 6.358 -22.430 90.615 1.00 0.00 H new ATOM 309 N ASP A 20 -0.688 -20.816 88.454 1.00 0.00 N ATOM 310 CA ASP A 20 -1.771 -21.495 87.683 1.00 0.00 C ATOM 311 C ASP A 20 -1.786 -21.055 86.207 1.00 0.00 C ATOM 312 O ASP A 20 -1.951 -21.864 85.311 1.00 0.00 O ATOM 313 CB ASP A 20 -3.123 -21.147 88.320 1.00 0.00 C ATOM 314 CG ASP A 20 -4.168 -22.189 87.911 1.00 0.00 C ATOM 315 OD1 ASP A 20 -4.249 -23.211 88.573 1.00 0.00 O ATOM 316 OD2 ASP A 20 -4.871 -21.946 86.944 1.00 0.00 O ATOM 0 H ASP A 20 -1.013 -20.120 89.125 1.00 0.00 H new ATOM 0 HA ASP A 20 -1.587 -22.569 87.713 1.00 0.00 H new ATOM 0 HB2 ASP A 20 -3.028 -21.119 89.406 1.00 0.00 H new ATOM 0 HB3 ASP A 20 -3.441 -20.154 88.002 1.00 0.00 H new ATOM 321 N TYR A 21 -1.659 -19.781 85.948 1.00 0.00 N ATOM 322 CA TYR A 21 -1.722 -19.296 84.534 1.00 0.00 C ATOM 323 C TYR A 21 -0.648 -19.955 83.662 1.00 0.00 C ATOM 324 O TYR A 21 -0.961 -20.606 82.687 1.00 0.00 O ATOM 325 CB TYR A 21 -1.544 -17.778 84.505 1.00 0.00 C ATOM 326 CG TYR A 21 -2.849 -17.118 84.876 1.00 0.00 C ATOM 327 CD1 TYR A 21 -3.313 -17.187 86.194 1.00 0.00 C ATOM 328 CD2 TYR A 21 -3.597 -16.444 83.904 1.00 0.00 C ATOM 329 CE1 TYR A 21 -4.526 -16.581 86.541 1.00 0.00 C ATOM 330 CE2 TYR A 21 -4.809 -15.838 84.251 1.00 0.00 C ATOM 331 CZ TYR A 21 -5.274 -15.907 85.569 1.00 0.00 C ATOM 332 OH TYR A 21 -6.471 -15.309 85.911 1.00 0.00 O ATOM 0 H TYR A 21 -1.515 -19.055 86.650 1.00 0.00 H new ATOM 0 HA TYR A 21 -2.697 -19.567 84.129 1.00 0.00 H new ATOM 0 HB2 TYR A 21 -0.760 -17.478 85.201 1.00 0.00 H new ATOM 0 HB3 TYR A 21 -1.229 -17.456 83.513 1.00 0.00 H new ATOM 0 HD1 TYR A 21 -2.735 -17.708 86.943 1.00 0.00 H new ATOM 0 HD2 TYR A 21 -3.239 -16.392 82.887 1.00 0.00 H new ATOM 0 HE1 TYR A 21 -4.885 -16.634 87.558 1.00 0.00 H new ATOM 0 HE2 TYR A 21 -5.386 -15.317 83.502 1.00 0.00 H new ATOM 0 HH TYR A 21 -6.862 -14.883 85.120 1.00 0.00 H new ATOM 342 N VAL A 22 0.607 -19.788 83.976 1.00 0.00 N ATOM 343 CA VAL A 22 1.654 -20.410 83.122 1.00 0.00 C ATOM 344 C VAL A 22 1.533 -21.930 83.213 1.00 0.00 C ATOM 345 O VAL A 22 2.065 -22.653 82.394 1.00 0.00 O ATOM 346 CB VAL A 22 3.046 -19.945 83.555 1.00 0.00 C ATOM 347 CG1 VAL A 22 3.355 -20.453 84.957 1.00 0.00 C ATOM 348 CG2 VAL A 22 4.092 -20.483 82.574 1.00 0.00 C ATOM 0 H VAL A 22 0.949 -19.255 84.776 1.00 0.00 H new ATOM 0 HA VAL A 22 1.511 -20.102 82.086 1.00 0.00 H new ATOM 0 HB VAL A 22 3.072 -18.855 83.558 1.00 0.00 H new ATOM 0 HG11 VAL A 22 4.348 -20.116 85.255 1.00 0.00 H new ATOM 0 HG12 VAL A 22 2.615 -20.064 85.656 1.00 0.00 H new ATOM 0 HG13 VAL A 22 3.324 -21.543 84.964 1.00 0.00 H new ATOM 0 HG21 VAL A 22 5.084 -20.152 82.882 1.00 0.00 H new ATOM 0 HG22 VAL A 22 4.059 -21.572 82.568 1.00 0.00 H new ATOM 0 HG23 VAL A 22 3.879 -20.108 81.573 1.00 0.00 H new ATOM 358 N ALA A 23 0.805 -22.426 84.178 1.00 0.00 N ATOM 359 CA ALA A 23 0.634 -23.898 84.272 1.00 0.00 C ATOM 360 C ALA A 23 0.057 -24.350 82.942 1.00 0.00 C ATOM 361 O ALA A 23 0.172 -25.489 82.535 1.00 0.00 O ATOM 362 CB ALA A 23 -0.343 -24.241 85.398 1.00 0.00 C ATOM 0 H ALA A 23 0.328 -21.880 84.896 1.00 0.00 H new ATOM 0 HA ALA A 23 1.583 -24.391 84.485 1.00 0.00 H new ATOM 0 HB1 ALA A 23 -0.462 -25.323 85.459 1.00 0.00 H new ATOM 0 HB2 ALA A 23 0.046 -23.864 86.344 1.00 0.00 H new ATOM 0 HB3 ALA A 23 -1.310 -23.781 85.194 1.00 0.00 H new ATOM 368 N LYS A 24 -0.544 -23.424 82.254 1.00 0.00 N ATOM 369 CA LYS A 24 -1.127 -23.710 80.931 1.00 0.00 C ATOM 370 C LYS A 24 -0.031 -24.245 80.012 1.00 0.00 C ATOM 371 O LYS A 24 0.185 -25.435 79.919 1.00 0.00 O ATOM 372 CB LYS A 24 -1.680 -22.398 80.378 1.00 0.00 C ATOM 373 CG LYS A 24 -2.149 -22.579 78.928 1.00 0.00 C ATOM 374 CD LYS A 24 -3.670 -22.482 78.864 1.00 0.00 C ATOM 375 CE LYS A 24 -4.283 -23.689 79.582 1.00 0.00 C ATOM 376 NZ LYS A 24 -5.740 -23.759 79.282 1.00 0.00 N ATOM 0 H LYS A 24 -0.655 -22.459 82.567 1.00 0.00 H new ATOM 0 HA LYS A 24 -1.921 -24.453 81.001 1.00 0.00 H new ATOM 0 HB2 LYS A 24 -2.512 -22.059 80.995 1.00 0.00 H new ATOM 0 HB3 LYS A 24 -0.913 -21.625 80.424 1.00 0.00 H new ATOM 0 HG2 LYS A 24 -1.699 -21.816 78.292 1.00 0.00 H new ATOM 0 HG3 LYS A 24 -1.820 -23.546 78.547 1.00 0.00 H new ATOM 0 HD2 LYS A 24 -4.007 -21.556 79.331 1.00 0.00 H new ATOM 0 HD3 LYS A 24 -4.001 -22.455 77.826 1.00 0.00 H new ATOM 0 HE2 LYS A 24 -3.790 -24.606 79.259 1.00 0.00 H new ATOM 0 HE3 LYS A 24 -4.126 -23.604 80.657 1.00 0.00 H new ATOM 0 HZ1 LYS A 24 -6.156 -24.578 79.769 1.00 0.00 H new ATOM 0 HZ2 LYS A 24 -6.204 -22.888 79.611 1.00 0.00 H new ATOM 0 HZ3 LYS A 24 -5.879 -23.859 78.256 1.00 0.00 H new ATOM 390 N GLY A 25 0.666 -23.374 79.335 1.00 0.00 N ATOM 391 CA GLY A 25 1.752 -23.842 78.427 1.00 0.00 C ATOM 392 C GLY A 25 2.750 -22.713 78.160 1.00 0.00 C ATOM 393 O GLY A 25 2.652 -22.003 77.181 1.00 0.00 O ATOM 0 H GLY A 25 0.532 -22.363 79.371 1.00 0.00 H new ATOM 0 HA2 GLY A 25 2.267 -24.692 78.874 1.00 0.00 H new ATOM 0 HA3 GLY A 25 1.324 -24.187 77.486 1.00 0.00 H new ATOM 397 N GLU A 26 3.713 -22.565 79.028 1.00 0.00 N ATOM 398 CA GLU A 26 4.760 -21.505 78.865 1.00 0.00 C ATOM 399 C GLU A 26 4.179 -20.242 78.219 1.00 0.00 C ATOM 400 O GLU A 26 3.993 -20.166 77.019 1.00 0.00 O ATOM 401 CB GLU A 26 5.925 -22.034 78.019 1.00 0.00 C ATOM 402 CG GLU A 26 5.403 -22.891 76.866 1.00 0.00 C ATOM 403 CD GLU A 26 6.586 -23.348 76.014 1.00 0.00 C ATOM 404 OE1 GLU A 26 7.007 -22.582 75.163 1.00 0.00 O ATOM 405 OE2 GLU A 26 7.057 -24.452 76.232 1.00 0.00 O ATOM 0 H GLU A 26 3.824 -23.143 79.861 1.00 0.00 H new ATOM 0 HA GLU A 26 5.125 -21.243 79.858 1.00 0.00 H new ATOM 0 HB2 GLU A 26 6.505 -21.199 77.626 1.00 0.00 H new ATOM 0 HB3 GLU A 26 6.597 -22.623 78.643 1.00 0.00 H new ATOM 0 HG2 GLU A 26 4.862 -23.754 77.253 1.00 0.00 H new ATOM 0 HG3 GLU A 26 4.700 -22.320 76.260 1.00 0.00 H new ATOM 412 N ASP A 27 3.920 -19.243 79.014 1.00 0.00 N ATOM 413 CA ASP A 27 3.382 -17.957 78.484 1.00 0.00 C ATOM 414 C ASP A 27 3.901 -16.838 79.381 1.00 0.00 C ATOM 415 O ASP A 27 3.156 -15.993 79.836 1.00 0.00 O ATOM 416 CB ASP A 27 1.853 -17.973 78.523 1.00 0.00 C ATOM 417 CG ASP A 27 1.326 -19.063 77.591 1.00 0.00 C ATOM 418 OD1 ASP A 27 1.785 -19.123 76.463 1.00 0.00 O ATOM 419 OD2 ASP A 27 0.468 -19.819 78.020 1.00 0.00 O ATOM 0 H ASP A 27 4.060 -19.262 80.024 1.00 0.00 H new ATOM 0 HA ASP A 27 3.700 -17.809 77.452 1.00 0.00 H new ATOM 0 HB2 ASP A 27 1.507 -18.153 79.541 1.00 0.00 H new ATOM 0 HB3 ASP A 27 1.462 -17.002 78.220 1.00 0.00 H new ATOM 424 N VAL A 28 5.174 -16.856 79.670 1.00 0.00 N ATOM 425 CA VAL A 28 5.758 -15.828 80.578 1.00 0.00 C ATOM 426 C VAL A 28 6.433 -14.702 79.780 1.00 0.00 C ATOM 427 O VAL A 28 7.640 -14.556 79.787 1.00 0.00 O ATOM 428 CB VAL A 28 6.780 -16.514 81.483 1.00 0.00 C ATOM 429 CG1 VAL A 28 6.044 -17.444 82.453 1.00 0.00 C ATOM 430 CG2 VAL A 28 7.750 -17.339 80.630 1.00 0.00 C ATOM 0 H VAL A 28 5.838 -17.543 79.314 1.00 0.00 H new ATOM 0 HA VAL A 28 4.963 -15.378 81.173 1.00 0.00 H new ATOM 0 HB VAL A 28 7.338 -15.762 82.040 1.00 0.00 H new ATOM 0 HG11 VAL A 28 6.767 -17.938 83.103 1.00 0.00 H new ATOM 0 HG12 VAL A 28 5.350 -16.862 83.059 1.00 0.00 H new ATOM 0 HG13 VAL A 28 5.491 -18.195 81.888 1.00 0.00 H new ATOM 0 HG21 VAL A 28 8.478 -17.828 81.277 1.00 0.00 H new ATOM 0 HG22 VAL A 28 7.194 -18.094 80.074 1.00 0.00 H new ATOM 0 HG23 VAL A 28 8.268 -16.683 79.931 1.00 0.00 H new ATOM 440 N ASN A 29 5.658 -13.895 79.112 1.00 0.00 N ATOM 441 CA ASN A 29 6.230 -12.768 78.332 1.00 0.00 C ATOM 442 C ASN A 29 5.084 -11.996 77.682 1.00 0.00 C ATOM 443 O ASN A 29 5.208 -11.475 76.590 1.00 0.00 O ATOM 444 CB ASN A 29 7.168 -13.303 77.252 1.00 0.00 C ATOM 445 CG ASN A 29 6.539 -14.519 76.581 1.00 0.00 C ATOM 446 OD1 ASN A 29 6.639 -15.685 77.152 1.00 0.00 O flip ATOM 447 ND2 ASN A 29 5.952 -14.409 75.523 1.00 0.00 N flip ATOM 0 H ASN A 29 4.642 -13.971 79.074 1.00 0.00 H new ATOM 0 HA ASN A 29 6.797 -12.112 78.993 1.00 0.00 H new ATOM 0 HB2 ASN A 29 7.365 -12.528 76.511 1.00 0.00 H new ATOM 0 HB3 ASN A 29 8.128 -13.574 77.692 1.00 0.00 H new ATOM 0 HD21 ASN A 29 5.874 -13.496 75.076 1.00 0.00 H new ATOM 0 HD22 ASN A 29 5.537 -15.230 75.082 1.00 0.00 H new ATOM 454 N ARG A 30 3.960 -11.938 78.344 1.00 0.00 N ATOM 455 CA ARG A 30 2.782 -11.223 77.779 1.00 0.00 C ATOM 456 C ARG A 30 2.552 -9.912 78.533 1.00 0.00 C ATOM 457 O ARG A 30 2.345 -9.899 79.730 1.00 0.00 O ATOM 458 CB ARG A 30 1.545 -12.108 77.925 1.00 0.00 C ATOM 459 CG ARG A 30 1.802 -13.463 77.258 1.00 0.00 C ATOM 460 CD ARG A 30 0.465 -14.147 76.957 1.00 0.00 C ATOM 461 NE ARG A 30 -0.526 -13.791 78.009 1.00 0.00 N ATOM 462 CZ ARG A 30 -1.800 -13.985 77.795 1.00 0.00 C ATOM 463 NH1 ARG A 30 -2.199 -14.481 76.656 1.00 0.00 N ATOM 464 NH2 ARG A 30 -2.672 -13.681 78.716 1.00 0.00 N ATOM 0 H ARG A 30 3.807 -12.360 79.260 1.00 0.00 H new ATOM 0 HA ARG A 30 2.966 -11.003 76.727 1.00 0.00 H new ATOM 0 HB2 ARG A 30 1.309 -12.249 78.980 1.00 0.00 H new ATOM 0 HB3 ARG A 30 0.683 -11.624 77.467 1.00 0.00 H new ATOM 0 HG2 ARG A 30 2.367 -13.325 76.336 1.00 0.00 H new ATOM 0 HG3 ARG A 30 2.406 -14.093 77.911 1.00 0.00 H new ATOM 0 HD2 ARG A 30 0.099 -13.837 75.978 1.00 0.00 H new ATOM 0 HD3 ARG A 30 0.598 -15.228 76.920 1.00 0.00 H new ATOM 0 HE ARG A 30 -0.211 -13.396 78.895 1.00 0.00 H new ATOM 0 HH11 ARG A 30 -1.517 -14.716 75.935 1.00 0.00 H new ATOM 0 HH12 ARG A 30 -3.193 -14.633 76.486 1.00 0.00 H new ATOM 0 HH21 ARG A 30 -2.360 -13.291 79.605 1.00 0.00 H new ATOM 0 HH22 ARG A 30 -3.666 -13.833 78.547 1.00 0.00 H new ATOM 478 N THR A 31 2.566 -8.814 77.836 1.00 0.00 N ATOM 479 CA THR A 31 2.331 -7.504 78.504 1.00 0.00 C ATOM 480 C THR A 31 0.996 -7.571 79.254 1.00 0.00 C ATOM 481 O THR A 31 -0.044 -7.276 78.700 1.00 0.00 O ATOM 482 CB THR A 31 2.259 -6.400 77.437 1.00 0.00 C ATOM 483 OG1 THR A 31 2.047 -6.993 76.162 1.00 0.00 O ATOM 484 CG2 THR A 31 3.565 -5.601 77.418 1.00 0.00 C ATOM 0 H THR A 31 2.730 -8.765 76.830 1.00 0.00 H new ATOM 0 HA THR A 31 3.141 -7.285 79.200 1.00 0.00 H new ATOM 0 HB THR A 31 1.435 -5.727 77.673 1.00 0.00 H new ATOM 0 HG1 THR A 31 1.999 -6.292 75.479 1.00 0.00 H new ATOM 0 HG21 THR A 31 3.504 -4.821 76.659 1.00 0.00 H new ATOM 0 HG22 THR A 31 3.726 -5.144 78.395 1.00 0.00 H new ATOM 0 HG23 THR A 31 4.396 -6.268 77.187 1.00 0.00 H new ATOM 492 N LEU A 32 0.999 -7.967 80.502 1.00 0.00 N ATOM 493 CA LEU A 32 -0.300 -8.047 81.230 1.00 0.00 C ATOM 494 C LEU A 32 -0.905 -6.644 81.350 1.00 0.00 C ATOM 495 O LEU A 32 -2.105 -6.475 81.278 1.00 0.00 O ATOM 496 CB LEU A 32 -0.158 -8.729 82.617 1.00 0.00 C ATOM 497 CG LEU A 32 0.895 -8.069 83.536 1.00 0.00 C ATOM 498 CD1 LEU A 32 2.269 -8.034 82.864 1.00 0.00 C ATOM 499 CD2 LEU A 32 0.467 -6.647 83.931 1.00 0.00 C ATOM 0 H LEU A 32 1.826 -8.233 81.037 1.00 0.00 H new ATOM 0 HA LEU A 32 -0.977 -8.678 80.654 1.00 0.00 H new ATOM 0 HB2 LEU A 32 -1.125 -8.713 83.119 1.00 0.00 H new ATOM 0 HB3 LEU A 32 0.108 -9.776 82.470 1.00 0.00 H new ATOM 0 HG LEU A 32 0.967 -8.675 84.439 1.00 0.00 H new ATOM 0 HD11 LEU A 32 2.990 -7.564 83.534 1.00 0.00 H new ATOM 0 HD12 LEU A 32 2.591 -9.051 82.640 1.00 0.00 H new ATOM 0 HD13 LEU A 32 2.207 -7.461 81.939 1.00 0.00 H new ATOM 0 HD21 LEU A 32 1.225 -6.205 84.578 1.00 0.00 H new ATOM 0 HD22 LEU A 32 0.356 -6.038 83.034 1.00 0.00 H new ATOM 0 HD23 LEU A 32 -0.484 -6.688 84.462 1.00 0.00 H new ATOM 511 N GLU A 33 -0.095 -5.632 81.495 1.00 0.00 N ATOM 512 CA GLU A 33 -0.647 -4.250 81.573 1.00 0.00 C ATOM 513 C GLU A 33 -0.860 -3.731 80.149 1.00 0.00 C ATOM 514 O GLU A 33 -1.959 -3.726 79.632 1.00 0.00 O ATOM 515 CB GLU A 33 0.332 -3.335 82.310 1.00 0.00 C ATOM 516 CG GLU A 33 -0.138 -1.885 82.180 1.00 0.00 C ATOM 517 CD GLU A 33 0.591 -1.018 83.205 1.00 0.00 C ATOM 518 OE1 GLU A 33 0.650 -1.418 84.355 1.00 0.00 O ATOM 519 OE2 GLU A 33 1.075 0.035 82.822 1.00 0.00 O ATOM 0 H GLU A 33 0.920 -5.701 81.563 1.00 0.00 H new ATOM 0 HA GLU A 33 -1.592 -4.261 82.116 1.00 0.00 H new ATOM 0 HB2 GLU A 33 0.391 -3.618 83.361 1.00 0.00 H new ATOM 0 HB3 GLU A 33 1.333 -3.444 81.894 1.00 0.00 H new ATOM 0 HG2 GLU A 33 0.057 -1.517 81.173 1.00 0.00 H new ATOM 0 HG3 GLU A 33 -1.215 -1.825 82.338 1.00 0.00 H new ATOM 526 N GLY A 34 0.198 -3.304 79.512 1.00 0.00 N ATOM 527 CA GLY A 34 0.089 -2.789 78.116 1.00 0.00 C ATOM 528 C GLY A 34 1.491 -2.485 77.586 1.00 0.00 C ATOM 529 O GLY A 34 1.707 -2.359 76.397 1.00 0.00 O ATOM 0 H GLY A 34 1.140 -3.290 79.902 1.00 0.00 H new ATOM 0 HA2 GLY A 34 -0.402 -3.526 77.480 1.00 0.00 H new ATOM 0 HA3 GLY A 34 -0.525 -1.889 78.094 1.00 0.00 H new ATOM 533 N GLY A 35 2.445 -2.371 78.467 1.00 0.00 N ATOM 534 CA GLY A 35 3.841 -2.081 78.032 1.00 0.00 C ATOM 535 C GLY A 35 4.824 -2.615 79.081 1.00 0.00 C ATOM 536 O GLY A 35 5.984 -2.256 79.095 1.00 0.00 O ATOM 0 H GLY A 35 2.318 -2.467 79.475 1.00 0.00 H new ATOM 0 HA2 GLY A 35 4.036 -2.545 77.065 1.00 0.00 H new ATOM 0 HA3 GLY A 35 3.978 -1.007 77.903 1.00 0.00 H new ATOM 540 N ARG A 36 4.362 -3.465 79.963 1.00 0.00 N ATOM 541 CA ARG A 36 5.260 -4.022 81.019 1.00 0.00 C ATOM 542 C ARG A 36 5.079 -5.543 81.095 1.00 0.00 C ATOM 543 O ARG A 36 3.991 -6.055 80.929 1.00 0.00 O ATOM 544 CB ARG A 36 4.906 -3.390 82.372 1.00 0.00 C ATOM 545 CG ARG A 36 4.255 -2.019 82.149 1.00 0.00 C ATOM 546 CD ARG A 36 4.117 -1.285 83.489 1.00 0.00 C ATOM 547 NE ARG A 36 3.930 0.175 83.240 1.00 0.00 N ATOM 548 CZ ARG A 36 3.524 0.959 84.204 1.00 0.00 C ATOM 549 NH1 ARG A 36 3.296 0.471 85.393 1.00 0.00 N ATOM 550 NH2 ARG A 36 3.353 2.234 83.982 1.00 0.00 N ATOM 0 H ARG A 36 3.398 -3.798 79.997 1.00 0.00 H new ATOM 0 HA ARG A 36 6.298 -3.796 80.774 1.00 0.00 H new ATOM 0 HB2 ARG A 36 4.226 -4.041 82.921 1.00 0.00 H new ATOM 0 HB3 ARG A 36 5.804 -3.282 82.980 1.00 0.00 H new ATOM 0 HG2 ARG A 36 4.858 -1.427 81.460 1.00 0.00 H new ATOM 0 HG3 ARG A 36 3.275 -2.142 81.689 1.00 0.00 H new ATOM 0 HD2 ARG A 36 3.269 -1.681 84.047 1.00 0.00 H new ATOM 0 HD3 ARG A 36 5.005 -1.450 84.099 1.00 0.00 H new ATOM 0 HE ARG A 36 4.119 0.562 82.315 1.00 0.00 H new ATOM 0 HH11 ARG A 36 3.435 -0.524 85.571 1.00 0.00 H new ATOM 0 HH12 ARG A 36 2.979 1.084 86.144 1.00 0.00 H new ATOM 0 HH21 ARG A 36 3.536 2.619 83.056 1.00 0.00 H new ATOM 0 HH22 ARG A 36 3.036 2.845 84.735 1.00 0.00 H new ATOM 564 N LYS A 37 6.140 -6.266 81.347 1.00 0.00 N ATOM 565 CA LYS A 37 6.039 -7.756 81.431 1.00 0.00 C ATOM 566 C LYS A 37 5.867 -8.172 82.906 1.00 0.00 C ATOM 567 O LYS A 37 6.101 -7.379 83.796 1.00 0.00 O ATOM 568 CB LYS A 37 7.315 -8.386 80.842 1.00 0.00 C ATOM 569 CG LYS A 37 8.398 -7.312 80.684 1.00 0.00 C ATOM 570 CD LYS A 37 8.874 -6.855 82.069 1.00 0.00 C ATOM 571 CE LYS A 37 9.546 -5.486 81.958 1.00 0.00 C ATOM 572 NZ LYS A 37 10.698 -5.571 81.015 1.00 0.00 N ATOM 0 H LYS A 37 7.075 -5.888 81.499 1.00 0.00 H new ATOM 0 HA LYS A 37 5.177 -8.105 80.862 1.00 0.00 H new ATOM 0 HB2 LYS A 37 7.673 -9.183 81.494 1.00 0.00 H new ATOM 0 HB3 LYS A 37 7.095 -8.839 79.875 1.00 0.00 H new ATOM 0 HG2 LYS A 37 9.237 -7.708 80.112 1.00 0.00 H new ATOM 0 HG3 LYS A 37 8.004 -6.463 80.125 1.00 0.00 H new ATOM 0 HD2 LYS A 37 8.029 -6.801 82.755 1.00 0.00 H new ATOM 0 HD3 LYS A 37 9.574 -7.582 82.482 1.00 0.00 H new ATOM 0 HE2 LYS A 37 8.829 -4.745 81.606 1.00 0.00 H new ATOM 0 HE3 LYS A 37 9.889 -5.157 82.939 1.00 0.00 H new ATOM 0 HZ1 LYS A 37 11.503 -5.038 81.402 1.00 0.00 H new ATOM 0 HZ2 LYS A 37 10.970 -6.567 80.888 1.00 0.00 H new ATOM 0 HZ3 LYS A 37 10.425 -5.167 80.096 1.00 0.00 H new ATOM 586 N PRO A 38 5.435 -9.398 83.122 1.00 0.00 N ATOM 587 CA PRO A 38 5.197 -9.926 84.487 1.00 0.00 C ATOM 588 C PRO A 38 6.498 -10.039 85.301 1.00 0.00 C ATOM 589 O PRO A 38 6.618 -10.891 86.160 1.00 0.00 O ATOM 590 CB PRO A 38 4.590 -11.324 84.263 1.00 0.00 C ATOM 591 CG PRO A 38 4.673 -11.634 82.747 1.00 0.00 C ATOM 592 CD PRO A 38 5.133 -10.351 82.034 1.00 0.00 C ATOM 0 HA PRO A 38 4.547 -9.262 85.057 1.00 0.00 H new ATOM 0 HB2 PRO A 38 5.134 -12.074 84.837 1.00 0.00 H new ATOM 0 HB3 PRO A 38 3.555 -11.351 84.603 1.00 0.00 H new ATOM 0 HG2 PRO A 38 5.374 -12.448 82.560 1.00 0.00 H new ATOM 0 HG3 PRO A 38 3.703 -11.956 82.368 1.00 0.00 H new ATOM 0 HD2 PRO A 38 6.012 -10.536 81.416 1.00 0.00 H new ATOM 0 HD3 PRO A 38 4.355 -9.965 81.375 1.00 0.00 H new ATOM 600 N LEU A 39 7.467 -9.193 85.062 1.00 0.00 N ATOM 601 CA LEU A 39 8.740 -9.284 85.852 1.00 0.00 C ATOM 602 C LEU A 39 8.914 -7.996 86.674 1.00 0.00 C ATOM 603 O LEU A 39 9.616 -7.962 87.664 1.00 0.00 O ATOM 604 CB LEU A 39 9.923 -9.453 84.880 1.00 0.00 C ATOM 605 CG LEU A 39 11.162 -10.129 85.540 1.00 0.00 C ATOM 606 CD1 LEU A 39 10.845 -10.725 86.920 1.00 0.00 C ATOM 607 CD2 LEU A 39 11.678 -11.249 84.627 1.00 0.00 C ATOM 0 H LEU A 39 7.437 -8.450 84.364 1.00 0.00 H new ATOM 0 HA LEU A 39 8.704 -10.139 86.527 1.00 0.00 H new ATOM 0 HB2 LEU A 39 9.602 -10.050 84.026 1.00 0.00 H new ATOM 0 HB3 LEU A 39 10.212 -8.475 84.495 1.00 0.00 H new ATOM 0 HG LEU A 39 11.916 -9.354 85.676 1.00 0.00 H new ATOM 0 HD11 LEU A 39 11.743 -11.183 87.334 1.00 0.00 H new ATOM 0 HD12 LEU A 39 10.500 -9.935 87.587 1.00 0.00 H new ATOM 0 HD13 LEU A 39 10.066 -11.481 86.820 1.00 0.00 H new ATOM 0 HD21 LEU A 39 12.545 -11.723 85.087 1.00 0.00 H new ATOM 0 HD22 LEU A 39 10.893 -11.991 84.482 1.00 0.00 H new ATOM 0 HD23 LEU A 39 11.963 -10.830 83.662 1.00 0.00 H new ATOM 619 N HIS A 40 8.270 -6.932 86.266 1.00 0.00 N ATOM 620 CA HIS A 40 8.398 -5.646 87.015 1.00 0.00 C ATOM 621 C HIS A 40 7.583 -5.717 88.307 1.00 0.00 C ATOM 622 O HIS A 40 8.049 -5.342 89.365 1.00 0.00 O ATOM 623 CB HIS A 40 7.873 -4.497 86.150 1.00 0.00 C ATOM 624 CG HIS A 40 7.934 -3.210 86.930 1.00 0.00 C ATOM 625 ND1 HIS A 40 7.076 -2.944 87.987 1.00 0.00 N ATOM 626 CD2 HIS A 40 8.745 -2.106 86.821 1.00 0.00 C ATOM 627 CE1 HIS A 40 7.387 -1.725 88.466 1.00 0.00 C ATOM 628 NE2 HIS A 40 8.397 -1.171 87.792 1.00 0.00 N ATOM 0 H HIS A 40 7.662 -6.898 85.448 1.00 0.00 H new ATOM 0 HA HIS A 40 9.447 -5.475 87.257 1.00 0.00 H new ATOM 0 HB2 HIS A 40 8.468 -4.412 85.241 1.00 0.00 H new ATOM 0 HB3 HIS A 40 6.847 -4.699 85.842 1.00 0.00 H new ATOM 0 HD2 HIS A 40 9.533 -1.982 86.093 1.00 0.00 H new ATOM 0 HE1 HIS A 40 6.881 -1.253 89.295 1.00 0.00 H new ATOM 0 HE2 HIS A 40 8.823 -0.258 87.954 1.00 0.00 H new ATOM 636 N TYR A 41 6.377 -6.205 88.235 1.00 0.00 N ATOM 637 CA TYR A 41 5.545 -6.307 89.465 1.00 0.00 C ATOM 638 C TYR A 41 6.192 -7.336 90.383 1.00 0.00 C ATOM 639 O TYR A 41 6.246 -7.175 91.586 1.00 0.00 O ATOM 640 CB TYR A 41 4.138 -6.774 89.091 1.00 0.00 C ATOM 641 CG TYR A 41 3.699 -6.050 87.851 1.00 0.00 C ATOM 642 CD1 TYR A 41 4.115 -6.498 86.593 1.00 0.00 C ATOM 643 CD2 TYR A 41 2.886 -4.922 87.959 1.00 0.00 C ATOM 644 CE1 TYR A 41 3.712 -5.815 85.439 1.00 0.00 C ATOM 645 CE2 TYR A 41 2.481 -4.240 86.811 1.00 0.00 C ATOM 646 CZ TYR A 41 2.894 -4.683 85.548 1.00 0.00 C ATOM 647 OH TYR A 41 2.493 -4.006 84.415 1.00 0.00 O ATOM 0 H TYR A 41 5.932 -6.537 87.379 1.00 0.00 H new ATOM 0 HA TYR A 41 5.478 -5.339 89.962 1.00 0.00 H new ATOM 0 HB2 TYR A 41 4.131 -7.851 88.921 1.00 0.00 H new ATOM 0 HB3 TYR A 41 3.445 -6.576 89.909 1.00 0.00 H new ATOM 0 HD1 TYR A 41 4.747 -7.370 86.512 1.00 0.00 H new ATOM 0 HD2 TYR A 41 2.570 -4.576 88.932 1.00 0.00 H new ATOM 0 HE1 TYR A 41 4.031 -6.160 84.467 1.00 0.00 H new ATOM 0 HE2 TYR A 41 1.848 -3.369 86.896 1.00 0.00 H new ATOM 0 HH TYR A 41 1.969 -3.219 84.672 1.00 0.00 H new ATOM 657 N ALA A 42 6.698 -8.388 89.809 1.00 0.00 N ATOM 658 CA ALA A 42 7.362 -9.438 90.620 1.00 0.00 C ATOM 659 C ALA A 42 8.666 -8.877 91.169 1.00 0.00 C ATOM 660 O ALA A 42 8.922 -8.890 92.355 1.00 0.00 O ATOM 661 CB ALA A 42 7.678 -10.641 89.725 1.00 0.00 C ATOM 0 H ALA A 42 6.679 -8.566 88.805 1.00 0.00 H new ATOM 0 HA ALA A 42 6.709 -9.747 91.437 1.00 0.00 H new ATOM 0 HB1 ALA A 42 8.166 -11.416 90.316 1.00 0.00 H new ATOM 0 HB2 ALA A 42 6.753 -11.034 89.304 1.00 0.00 H new ATOM 0 HB3 ALA A 42 8.340 -10.330 88.917 1.00 0.00 H new ATOM 667 N ALA A 43 9.497 -8.385 90.301 1.00 0.00 N ATOM 668 CA ALA A 43 10.795 -7.831 90.752 1.00 0.00 C ATOM 669 C ALA A 43 10.545 -6.744 91.799 1.00 0.00 C ATOM 670 O ALA A 43 10.996 -6.835 92.924 1.00 0.00 O ATOM 671 CB ALA A 43 11.524 -7.218 89.550 1.00 0.00 C ATOM 0 H ALA A 43 9.332 -8.343 89.295 1.00 0.00 H new ATOM 0 HA ALA A 43 11.403 -8.624 91.187 1.00 0.00 H new ATOM 0 HB1 ALA A 43 12.480 -6.808 89.875 1.00 0.00 H new ATOM 0 HB2 ALA A 43 11.696 -7.988 88.797 1.00 0.00 H new ATOM 0 HB3 ALA A 43 10.915 -6.422 89.122 1.00 0.00 H new ATOM 677 N ASP A 44 9.840 -5.711 91.427 1.00 0.00 N ATOM 678 CA ASP A 44 9.573 -4.590 92.375 1.00 0.00 C ATOM 679 C ASP A 44 8.884 -5.073 93.656 1.00 0.00 C ATOM 680 O ASP A 44 9.129 -4.547 94.722 1.00 0.00 O ATOM 681 CB ASP A 44 8.683 -3.554 91.692 1.00 0.00 C ATOM 682 CG ASP A 44 9.444 -2.912 90.533 1.00 0.00 C ATOM 683 OD1 ASP A 44 10.189 -3.620 89.874 1.00 0.00 O ATOM 684 OD2 ASP A 44 9.270 -1.724 90.324 1.00 0.00 O ATOM 0 H ASP A 44 9.434 -5.594 90.499 1.00 0.00 H new ATOM 0 HA ASP A 44 10.533 -4.154 92.652 1.00 0.00 H new ATOM 0 HB2 ASP A 44 7.772 -4.027 91.325 1.00 0.00 H new ATOM 0 HB3 ASP A 44 8.379 -2.791 92.409 1.00 0.00 H new ATOM 689 N CYS A 45 8.022 -6.048 93.575 1.00 0.00 N ATOM 690 CA CYS A 45 7.323 -6.514 94.810 1.00 0.00 C ATOM 691 C CYS A 45 6.794 -7.926 94.594 1.00 0.00 C ATOM 692 O CYS A 45 5.601 -8.160 94.603 1.00 0.00 O ATOM 693 CB CYS A 45 6.131 -5.599 95.096 1.00 0.00 C ATOM 694 SG CYS A 45 6.691 -3.889 95.295 1.00 0.00 S ATOM 0 H CYS A 45 7.771 -6.540 92.717 1.00 0.00 H new ATOM 0 HA CYS A 45 8.025 -6.496 95.643 1.00 0.00 H new ATOM 0 HB2 CYS A 45 5.411 -5.661 94.280 1.00 0.00 H new ATOM 0 HB3 CYS A 45 5.618 -5.929 95.999 1.00 0.00 H new ATOM 0 HG CYS A 45 7.990 -3.861 95.344 1.00 0.00 H new ATOM 700 N GLY A 46 7.671 -8.866 94.394 1.00 0.00 N ATOM 701 CA GLY A 46 7.223 -10.271 94.170 1.00 0.00 C ATOM 702 C GLY A 46 7.669 -11.149 95.334 1.00 0.00 C ATOM 703 O GLY A 46 7.918 -12.325 95.165 1.00 0.00 O ATOM 0 H GLY A 46 8.681 -8.725 94.375 1.00 0.00 H new ATOM 0 HA2 GLY A 46 6.138 -10.305 94.072 1.00 0.00 H new ATOM 0 HA3 GLY A 46 7.639 -10.650 93.237 1.00 0.00 H new ATOM 707 N GLN A 47 7.803 -10.599 96.508 1.00 0.00 N ATOM 708 CA GLN A 47 8.269 -11.436 97.645 1.00 0.00 C ATOM 709 C GLN A 47 9.553 -12.139 97.196 1.00 0.00 C ATOM 710 O GLN A 47 10.027 -13.073 97.808 1.00 0.00 O ATOM 711 CB GLN A 47 7.187 -12.456 98.011 1.00 0.00 C ATOM 712 CG GLN A 47 6.105 -11.782 98.861 1.00 0.00 C ATOM 713 CD GLN A 47 5.847 -10.362 98.350 1.00 0.00 C ATOM 714 OE1 GLN A 47 5.079 -10.184 97.310 1.00 0.00 O flip ATOM 715 NE2 GLN A 47 6.352 -9.405 98.902 1.00 0.00 N flip ATOM 0 H GLN A 47 7.613 -9.621 96.727 1.00 0.00 H new ATOM 0 HA GLN A 47 8.465 -10.829 98.529 1.00 0.00 H new ATOM 0 HB2 GLN A 47 6.745 -12.872 97.106 1.00 0.00 H new ATOM 0 HB3 GLN A 47 7.629 -13.287 98.560 1.00 0.00 H new ATOM 0 HG2 GLN A 47 5.185 -12.364 98.821 1.00 0.00 H new ATOM 0 HG3 GLN A 47 6.418 -11.751 99.905 1.00 0.00 H new ATOM 0 HE21 GLN A 47 6.952 -9.543 99.715 1.00 0.00 H new ATOM 0 HE22 GLN A 47 6.176 -8.463 98.553 1.00 0.00 H new ATOM 724 N LEU A 48 10.112 -11.651 96.120 1.00 0.00 N ATOM 725 CA LEU A 48 11.381 -12.202 95.562 1.00 0.00 C ATOM 726 C LEU A 48 11.234 -13.664 95.152 1.00 0.00 C ATOM 727 O LEU A 48 12.150 -14.265 94.628 1.00 0.00 O ATOM 728 CB LEU A 48 12.499 -12.055 96.588 1.00 0.00 C ATOM 729 CG LEU A 48 12.942 -10.578 96.717 1.00 0.00 C ATOM 730 CD1 LEU A 48 12.228 -9.665 95.706 1.00 0.00 C ATOM 731 CD2 LEU A 48 12.642 -10.072 98.133 1.00 0.00 C ATOM 0 H LEU A 48 9.728 -10.869 95.589 1.00 0.00 H new ATOM 0 HA LEU A 48 11.627 -11.634 94.665 1.00 0.00 H new ATOM 0 HB2 LEU A 48 12.159 -12.423 97.556 1.00 0.00 H new ATOM 0 HB3 LEU A 48 13.350 -12.669 96.294 1.00 0.00 H new ATOM 0 HG LEU A 48 14.012 -10.543 96.510 1.00 0.00 H new ATOM 0 HD11 LEU A 48 12.572 -8.639 95.836 1.00 0.00 H new ATOM 0 HD12 LEU A 48 12.453 -9.998 94.693 1.00 0.00 H new ATOM 0 HD13 LEU A 48 11.152 -9.710 95.872 1.00 0.00 H new ATOM 0 HD21 LEU A 48 12.955 -9.032 98.221 1.00 0.00 H new ATOM 0 HD22 LEU A 48 11.572 -10.147 98.327 1.00 0.00 H new ATOM 0 HD23 LEU A 48 13.186 -10.677 98.858 1.00 0.00 H new ATOM 743 N GLU A 49 10.098 -14.236 95.364 1.00 0.00 N ATOM 744 CA GLU A 49 9.894 -15.651 94.949 1.00 0.00 C ATOM 745 C GLU A 49 9.252 -15.666 93.564 1.00 0.00 C ATOM 746 O GLU A 49 9.521 -16.518 92.743 1.00 0.00 O ATOM 747 CB GLU A 49 8.965 -16.357 95.939 1.00 0.00 C ATOM 748 CG GLU A 49 7.890 -15.377 96.405 1.00 0.00 C ATOM 749 CD GLU A 49 6.864 -16.111 97.272 1.00 0.00 C ATOM 750 OE1 GLU A 49 6.261 -17.051 96.777 1.00 0.00 O ATOM 751 OE2 GLU A 49 6.696 -15.720 98.415 1.00 0.00 O ATOM 0 H GLU A 49 9.294 -13.791 95.807 1.00 0.00 H new ATOM 0 HA GLU A 49 10.854 -16.167 94.929 1.00 0.00 H new ATOM 0 HB2 GLU A 49 8.503 -17.225 95.468 1.00 0.00 H new ATOM 0 HB3 GLU A 49 9.535 -16.724 96.793 1.00 0.00 H new ATOM 0 HG2 GLU A 49 8.345 -14.565 96.972 1.00 0.00 H new ATOM 0 HG3 GLU A 49 7.397 -14.927 95.544 1.00 0.00 H new ATOM 758 N ILE A 50 8.382 -14.730 93.323 1.00 0.00 N ATOM 759 CA ILE A 50 7.670 -14.666 92.023 1.00 0.00 C ATOM 760 C ILE A 50 8.642 -14.423 90.874 1.00 0.00 C ATOM 761 O ILE A 50 8.649 -15.148 89.903 1.00 0.00 O ATOM 762 CB ILE A 50 6.659 -13.520 92.086 1.00 0.00 C ATOM 763 CG1 ILE A 50 5.726 -13.740 93.305 1.00 0.00 C ATOM 764 CG2 ILE A 50 5.859 -13.455 90.773 1.00 0.00 C ATOM 765 CD1 ILE A 50 4.249 -13.666 92.896 1.00 0.00 C ATOM 0 H ILE A 50 8.131 -13.995 93.984 1.00 0.00 H new ATOM 0 HA ILE A 50 7.168 -15.617 91.843 1.00 0.00 H new ATOM 0 HB ILE A 50 7.176 -12.568 92.208 1.00 0.00 H new ATOM 0 HG12 ILE A 50 5.933 -14.711 93.754 1.00 0.00 H new ATOM 0 HG13 ILE A 50 5.933 -12.987 94.065 1.00 0.00 H new ATOM 0 HG21 ILE A 50 5.141 -12.637 90.825 1.00 0.00 H new ATOM 0 HG22 ILE A 50 6.541 -13.287 89.939 1.00 0.00 H new ATOM 0 HG23 ILE A 50 5.328 -14.395 90.624 1.00 0.00 H new ATOM 0 HD11 ILE A 50 3.620 -13.824 93.772 1.00 0.00 H new ATOM 0 HD12 ILE A 50 4.038 -12.685 92.470 1.00 0.00 H new ATOM 0 HD13 ILE A 50 4.038 -14.436 92.154 1.00 0.00 H new ATOM 777 N LEU A 51 9.436 -13.394 90.952 1.00 0.00 N ATOM 778 CA LEU A 51 10.357 -13.107 89.825 1.00 0.00 C ATOM 779 C LEU A 51 11.047 -14.401 89.369 1.00 0.00 C ATOM 780 O LEU A 51 11.032 -14.734 88.203 1.00 0.00 O ATOM 781 CB LEU A 51 11.416 -12.028 90.160 1.00 0.00 C ATOM 782 CG LEU A 51 11.628 -11.782 91.665 1.00 0.00 C ATOM 783 CD1 LEU A 51 10.338 -11.340 92.371 1.00 0.00 C ATOM 784 CD2 LEU A 51 12.189 -13.042 92.313 1.00 0.00 C ATOM 0 H LEU A 51 9.486 -12.747 91.739 1.00 0.00 H new ATOM 0 HA LEU A 51 9.747 -12.703 89.017 1.00 0.00 H new ATOM 0 HB2 LEU A 51 12.367 -12.321 89.716 1.00 0.00 H new ATOM 0 HB3 LEU A 51 11.121 -11.090 89.690 1.00 0.00 H new ATOM 0 HG LEU A 51 12.341 -10.965 91.773 1.00 0.00 H new ATOM 0 HD11 LEU A 51 10.540 -11.179 93.430 1.00 0.00 H new ATOM 0 HD12 LEU A 51 9.979 -10.413 91.925 1.00 0.00 H new ATOM 0 HD13 LEU A 51 9.579 -12.114 92.260 1.00 0.00 H new ATOM 0 HD21 LEU A 51 12.339 -12.867 93.378 1.00 0.00 H new ATOM 0 HD22 LEU A 51 11.488 -13.865 92.175 1.00 0.00 H new ATOM 0 HD23 LEU A 51 13.142 -13.296 91.849 1.00 0.00 H new ATOM 796 N GLU A 52 11.654 -15.129 90.267 1.00 0.00 N ATOM 797 CA GLU A 52 12.346 -16.392 89.860 1.00 0.00 C ATOM 798 C GLU A 52 11.372 -17.330 89.146 1.00 0.00 C ATOM 799 O GLU A 52 11.739 -18.037 88.233 1.00 0.00 O ATOM 800 CB GLU A 52 12.882 -17.154 91.088 1.00 0.00 C ATOM 801 CG GLU A 52 13.493 -16.212 92.120 1.00 0.00 C ATOM 802 CD GLU A 52 13.959 -17.041 93.320 1.00 0.00 C ATOM 803 OE1 GLU A 52 14.209 -18.222 93.136 1.00 0.00 O ATOM 804 OE2 GLU A 52 14.042 -16.487 94.402 1.00 0.00 O ATOM 0 H GLU A 52 11.702 -14.908 91.261 1.00 0.00 H new ATOM 0 HA GLU A 52 13.167 -16.104 89.203 1.00 0.00 H new ATOM 0 HB2 GLU A 52 12.071 -17.719 91.547 1.00 0.00 H new ATOM 0 HB3 GLU A 52 13.632 -17.877 90.768 1.00 0.00 H new ATOM 0 HG2 GLU A 52 14.332 -15.668 91.686 1.00 0.00 H new ATOM 0 HG3 GLU A 52 12.760 -15.469 92.435 1.00 0.00 H new ATOM 811 N PHE A 53 10.149 -17.385 89.598 1.00 0.00 N ATOM 812 CA PHE A 53 9.161 -18.333 89.005 1.00 0.00 C ATOM 813 C PHE A 53 8.985 -18.143 87.505 1.00 0.00 C ATOM 814 O PHE A 53 9.512 -18.892 86.716 1.00 0.00 O ATOM 815 CB PHE A 53 7.809 -18.134 89.675 1.00 0.00 C ATOM 816 CG PHE A 53 6.797 -19.012 88.989 1.00 0.00 C ATOM 817 CD1 PHE A 53 6.963 -20.400 88.990 1.00 0.00 C ATOM 818 CD2 PHE A 53 5.700 -18.437 88.337 1.00 0.00 C ATOM 819 CE1 PHE A 53 6.033 -21.215 88.340 1.00 0.00 C ATOM 820 CE2 PHE A 53 4.769 -19.253 87.688 1.00 0.00 C ATOM 821 CZ PHE A 53 4.937 -20.642 87.690 1.00 0.00 C ATOM 0 H PHE A 53 9.788 -16.809 90.359 1.00 0.00 H new ATOM 0 HA PHE A 53 9.547 -19.339 89.172 1.00 0.00 H new ATOM 0 HB2 PHE A 53 7.871 -18.385 90.734 1.00 0.00 H new ATOM 0 HB3 PHE A 53 7.506 -17.089 89.613 1.00 0.00 H new ATOM 0 HD1 PHE A 53 7.810 -20.842 89.493 1.00 0.00 H new ATOM 0 HD2 PHE A 53 5.573 -17.364 88.335 1.00 0.00 H new ATOM 0 HE1 PHE A 53 6.161 -22.287 88.340 1.00 0.00 H new ATOM 0 HE2 PHE A 53 3.921 -18.812 87.186 1.00 0.00 H new ATOM 0 HZ PHE A 53 4.218 -21.273 87.188 1.00 0.00 H new ATOM 831 N LEU A 54 8.199 -17.194 87.096 1.00 0.00 N ATOM 832 CA LEU A 54 7.968 -17.032 85.638 1.00 0.00 C ATOM 833 C LEU A 54 9.304 -16.932 84.893 1.00 0.00 C ATOM 834 O LEU A 54 9.346 -16.890 83.680 1.00 0.00 O ATOM 835 CB LEU A 54 7.057 -15.816 85.355 1.00 0.00 C ATOM 836 CG LEU A 54 7.668 -14.459 85.777 1.00 0.00 C ATOM 837 CD1 LEU A 54 8.638 -14.605 86.947 1.00 0.00 C ATOM 838 CD2 LEU A 54 8.385 -13.821 84.583 1.00 0.00 C ATOM 0 H LEU A 54 7.711 -16.530 87.698 1.00 0.00 H new ATOM 0 HA LEU A 54 7.448 -17.915 85.266 1.00 0.00 H new ATOM 0 HB2 LEU A 54 6.831 -15.785 84.289 1.00 0.00 H new ATOM 0 HB3 LEU A 54 6.111 -15.955 85.878 1.00 0.00 H new ATOM 0 HG LEU A 54 6.851 -13.817 86.107 1.00 0.00 H new ATOM 0 HD11 LEU A 54 9.042 -13.627 87.209 1.00 0.00 H new ATOM 0 HD12 LEU A 54 8.112 -15.022 87.806 1.00 0.00 H new ATOM 0 HD13 LEU A 54 9.453 -15.270 86.663 1.00 0.00 H new ATOM 0 HD21 LEU A 54 8.814 -12.865 84.884 1.00 0.00 H new ATOM 0 HD22 LEU A 54 9.180 -14.483 84.240 1.00 0.00 H new ATOM 0 HD23 LEU A 54 7.672 -13.660 83.774 1.00 0.00 H new ATOM 850 N LEU A 55 10.401 -16.937 85.603 1.00 0.00 N ATOM 851 CA LEU A 55 11.729 -16.882 84.927 1.00 0.00 C ATOM 852 C LEU A 55 12.195 -18.320 84.650 1.00 0.00 C ATOM 853 O LEU A 55 12.842 -18.594 83.659 1.00 0.00 O ATOM 854 CB LEU A 55 12.735 -16.166 85.833 1.00 0.00 C ATOM 855 CG LEU A 55 13.829 -15.497 84.990 1.00 0.00 C ATOM 856 CD1 LEU A 55 14.646 -14.557 85.882 1.00 0.00 C ATOM 857 CD2 LEU A 55 14.754 -16.563 84.383 1.00 0.00 C ATOM 0 H LEU A 55 10.434 -16.977 86.622 1.00 0.00 H new ATOM 0 HA LEU A 55 11.654 -16.334 83.988 1.00 0.00 H new ATOM 0 HB2 LEU A 55 12.222 -15.417 86.436 1.00 0.00 H new ATOM 0 HB3 LEU A 55 13.184 -16.879 86.524 1.00 0.00 H new ATOM 0 HG LEU A 55 13.366 -14.931 84.182 1.00 0.00 H new ATOM 0 HD11 LEU A 55 15.425 -14.078 85.289 1.00 0.00 H new ATOM 0 HD12 LEU A 55 13.991 -13.795 86.303 1.00 0.00 H new ATOM 0 HD13 LEU A 55 15.104 -15.128 86.689 1.00 0.00 H new ATOM 0 HD21 LEU A 55 15.527 -16.077 83.787 1.00 0.00 H new ATOM 0 HD22 LEU A 55 15.221 -17.138 85.183 1.00 0.00 H new ATOM 0 HD23 LEU A 55 14.172 -17.231 83.748 1.00 0.00 H new ATOM 869 N LEU A 56 11.847 -19.241 85.513 1.00 0.00 N ATOM 870 CA LEU A 56 12.242 -20.666 85.301 1.00 0.00 C ATOM 871 C LEU A 56 11.780 -21.089 83.916 1.00 0.00 C ATOM 872 O LEU A 56 12.542 -21.579 83.108 1.00 0.00 O ATOM 873 CB LEU A 56 11.549 -21.583 86.322 1.00 0.00 C ATOM 874 CG LEU A 56 11.882 -21.167 87.754 1.00 0.00 C ATOM 875 CD1 LEU A 56 11.081 -22.041 88.723 1.00 0.00 C ATOM 876 CD2 LEU A 56 13.378 -21.355 88.020 1.00 0.00 C ATOM 0 H LEU A 56 11.304 -19.066 86.359 1.00 0.00 H new ATOM 0 HA LEU A 56 13.323 -20.750 85.413 1.00 0.00 H new ATOM 0 HB2 LEU A 56 10.470 -21.548 86.172 1.00 0.00 H new ATOM 0 HB3 LEU A 56 11.861 -22.615 86.158 1.00 0.00 H new ATOM 0 HG LEU A 56 11.625 -20.117 87.896 1.00 0.00 H new ATOM 0 HD11 LEU A 56 11.311 -21.752 89.749 1.00 0.00 H new ATOM 0 HD12 LEU A 56 10.015 -21.906 88.539 1.00 0.00 H new ATOM 0 HD13 LEU A 56 11.346 -23.088 88.573 1.00 0.00 H new ATOM 0 HD21 LEU A 56 13.606 -21.056 89.043 1.00 0.00 H new ATOM 0 HD22 LEU A 56 13.643 -22.403 87.881 1.00 0.00 H new ATOM 0 HD23 LEU A 56 13.951 -20.740 87.326 1.00 0.00 H new ATOM 888 N LYS A 57 10.525 -20.894 83.645 1.00 0.00 N ATOM 889 CA LYS A 57 9.986 -21.273 82.318 1.00 0.00 C ATOM 890 C LYS A 57 10.718 -20.440 81.270 1.00 0.00 C ATOM 891 O LYS A 57 11.903 -20.613 81.053 1.00 0.00 O ATOM 892 CB LYS A 57 8.479 -20.979 82.278 1.00 0.00 C ATOM 893 CG LYS A 57 7.703 -22.147 82.901 1.00 0.00 C ATOM 894 CD LYS A 57 8.075 -22.283 84.379 1.00 0.00 C ATOM 895 CE LYS A 57 7.134 -23.285 85.051 1.00 0.00 C ATOM 896 NZ LYS A 57 5.730 -22.797 84.942 1.00 0.00 N ATOM 0 H LYS A 57 9.847 -20.487 84.289 1.00 0.00 H new ATOM 0 HA LYS A 57 10.133 -22.335 82.123 1.00 0.00 H new ATOM 0 HB2 LYS A 57 8.265 -20.058 82.820 1.00 0.00 H new ATOM 0 HB3 LYS A 57 8.157 -20.825 81.248 1.00 0.00 H new ATOM 0 HG2 LYS A 57 6.631 -21.979 82.800 1.00 0.00 H new ATOM 0 HG3 LYS A 57 7.932 -23.072 82.372 1.00 0.00 H new ATOM 0 HD2 LYS A 57 9.108 -22.617 84.476 1.00 0.00 H new ATOM 0 HD3 LYS A 57 8.005 -21.314 84.873 1.00 0.00 H new ATOM 0 HE2 LYS A 57 7.228 -24.263 84.578 1.00 0.00 H new ATOM 0 HE3 LYS A 57 7.407 -23.410 86.099 1.00 0.00 H new ATOM 0 HZ1 LYS A 57 5.177 -23.147 85.751 1.00 0.00 H new ATOM 0 HZ2 LYS A 57 5.723 -21.757 84.942 1.00 0.00 H new ATOM 0 HZ3 LYS A 57 5.309 -23.146 84.058 1.00 0.00 H new ATOM 910 N GLY A 58 10.051 -19.515 80.642 1.00 0.00 N ATOM 911 CA GLY A 58 10.752 -18.665 79.651 1.00 0.00 C ATOM 912 C GLY A 58 11.773 -17.825 80.413 1.00 0.00 C ATOM 913 O GLY A 58 12.468 -18.327 81.271 1.00 0.00 O ATOM 0 H GLY A 58 9.060 -19.314 80.772 1.00 0.00 H new ATOM 0 HA2 GLY A 58 11.246 -19.280 78.898 1.00 0.00 H new ATOM 0 HA3 GLY A 58 10.044 -18.025 79.125 1.00 0.00 H new ATOM 917 N ALA A 59 11.855 -16.552 80.138 1.00 0.00 N ATOM 918 CA ALA A 59 12.825 -15.700 80.882 1.00 0.00 C ATOM 919 C ALA A 59 12.742 -14.251 80.407 1.00 0.00 C ATOM 920 O ALA A 59 13.533 -13.800 79.600 1.00 0.00 O ATOM 921 CB ALA A 59 14.253 -16.217 80.681 1.00 0.00 C ATOM 0 H ALA A 59 11.296 -16.068 79.435 1.00 0.00 H new ATOM 0 HA ALA A 59 12.570 -15.745 81.941 1.00 0.00 H new ATOM 0 HB1 ALA A 59 14.950 -15.584 81.231 1.00 0.00 H new ATOM 0 HB2 ALA A 59 14.325 -17.240 81.049 1.00 0.00 H new ATOM 0 HB3 ALA A 59 14.502 -16.195 79.620 1.00 0.00 H new ATOM 927 N ASP A 60 11.811 -13.506 80.937 1.00 0.00 N ATOM 928 CA ASP A 60 11.704 -12.074 80.556 1.00 0.00 C ATOM 929 C ASP A 60 12.889 -11.367 81.200 1.00 0.00 C ATOM 930 O ASP A 60 13.054 -10.165 81.122 1.00 0.00 O ATOM 931 CB ASP A 60 10.384 -11.494 81.078 1.00 0.00 C ATOM 932 CG ASP A 60 10.176 -10.089 80.513 1.00 0.00 C ATOM 933 OD1 ASP A 60 10.794 -9.168 81.023 1.00 0.00 O ATOM 934 OD2 ASP A 60 9.397 -9.956 79.582 1.00 0.00 O ATOM 0 H ASP A 60 11.122 -13.829 81.616 1.00 0.00 H new ATOM 0 HA ASP A 60 11.715 -11.945 79.474 1.00 0.00 H new ATOM 0 HB2 ASP A 60 9.554 -12.138 80.789 1.00 0.00 H new ATOM 0 HB3 ASP A 60 10.397 -11.460 82.167 1.00 0.00 H new ATOM 939 N ILE A 61 13.718 -12.147 81.836 1.00 0.00 N ATOM 940 CA ILE A 61 14.929 -11.617 82.512 1.00 0.00 C ATOM 941 C ILE A 61 15.707 -10.723 81.541 1.00 0.00 C ATOM 942 O ILE A 61 16.552 -9.947 81.935 1.00 0.00 O ATOM 943 CB ILE A 61 15.794 -12.821 82.920 1.00 0.00 C ATOM 944 CG1 ILE A 61 16.947 -12.386 83.836 1.00 0.00 C ATOM 945 CG2 ILE A 61 16.367 -13.480 81.662 1.00 0.00 C ATOM 946 CD1 ILE A 61 18.030 -13.472 83.842 1.00 0.00 C ATOM 0 H ILE A 61 13.600 -13.157 81.916 1.00 0.00 H new ATOM 0 HA ILE A 61 14.658 -11.026 83.387 1.00 0.00 H new ATOM 0 HB ILE A 61 15.169 -13.528 83.465 1.00 0.00 H new ATOM 0 HG12 ILE A 61 17.366 -11.441 83.489 1.00 0.00 H new ATOM 0 HG13 ILE A 61 16.579 -12.218 84.848 1.00 0.00 H new ATOM 0 HG21 ILE A 61 16.981 -14.334 81.946 1.00 0.00 H new ATOM 0 HG22 ILE A 61 15.550 -13.817 81.023 1.00 0.00 H new ATOM 0 HG23 ILE A 61 16.978 -12.759 81.119 1.00 0.00 H new ATOM 0 HD11 ILE A 61 18.850 -13.165 84.492 1.00 0.00 H new ATOM 0 HD12 ILE A 61 17.606 -14.407 84.209 1.00 0.00 H new ATOM 0 HD13 ILE A 61 18.405 -13.617 82.829 1.00 0.00 H new ATOM 958 N ASN A 62 15.434 -10.843 80.266 1.00 0.00 N ATOM 959 CA ASN A 62 16.172 -10.020 79.258 1.00 0.00 C ATOM 960 C ASN A 62 15.268 -9.667 78.063 1.00 0.00 C ATOM 961 O ASN A 62 15.422 -8.635 77.439 1.00 0.00 O ATOM 962 CB ASN A 62 17.367 -10.824 78.754 1.00 0.00 C ATOM 963 CG ASN A 62 16.871 -12.121 78.109 1.00 0.00 C ATOM 964 OD1 ASN A 62 15.914 -12.798 78.685 1.00 0.00 O flip ATOM 965 ND2 ASN A 62 17.359 -12.521 77.070 1.00 0.00 N flip ATOM 0 H ASN A 62 14.733 -11.475 79.879 1.00 0.00 H new ATOM 0 HA ASN A 62 16.497 -9.093 79.731 1.00 0.00 H new ATOM 0 HB2 ASN A 62 17.934 -10.239 78.030 1.00 0.00 H new ATOM 0 HB3 ASN A 62 18.042 -11.050 79.580 1.00 0.00 H new ATOM 0 HD21 ASN A 62 18.106 -11.992 76.621 1.00 0.00 H new ATOM 0 HD22 ASN A 62 17.021 -13.386 76.648 1.00 0.00 H new ATOM 972 N ALA A 63 14.335 -10.533 77.754 1.00 0.00 N ATOM 973 CA ALA A 63 13.378 -10.330 76.610 1.00 0.00 C ATOM 974 C ALA A 63 13.197 -8.851 76.199 1.00 0.00 C ATOM 975 O ALA A 63 13.305 -8.538 75.030 1.00 0.00 O ATOM 976 CB ALA A 63 12.018 -10.911 77.001 1.00 0.00 C ATOM 0 H ALA A 63 14.189 -11.405 78.263 1.00 0.00 H new ATOM 0 HA ALA A 63 13.805 -10.840 75.746 1.00 0.00 H new ATOM 0 HB1 ALA A 63 11.313 -10.771 76.181 1.00 0.00 H new ATOM 0 HB2 ALA A 63 12.124 -11.975 77.211 1.00 0.00 H new ATOM 0 HB3 ALA A 63 11.646 -10.401 77.890 1.00 0.00 H new ATOM 982 N PRO A 64 12.911 -7.983 77.148 1.00 0.00 N ATOM 983 CA PRO A 64 12.692 -6.548 76.901 1.00 0.00 C ATOM 984 C PRO A 64 13.228 -6.045 75.551 1.00 0.00 C ATOM 985 O PRO A 64 14.328 -6.349 75.130 1.00 0.00 O ATOM 986 CB PRO A 64 13.384 -5.919 78.112 1.00 0.00 C ATOM 987 CG PRO A 64 13.307 -6.994 79.241 1.00 0.00 C ATOM 988 CD PRO A 64 12.815 -8.300 78.580 1.00 0.00 C ATOM 0 HA PRO A 64 11.638 -6.286 76.811 1.00 0.00 H new ATOM 0 HB2 PRO A 64 14.419 -5.663 77.884 1.00 0.00 H new ATOM 0 HB3 PRO A 64 12.887 -4.997 78.413 1.00 0.00 H new ATOM 0 HG2 PRO A 64 14.283 -7.139 79.704 1.00 0.00 H new ATOM 0 HG3 PRO A 64 12.624 -6.678 80.029 1.00 0.00 H new ATOM 0 HD2 PRO A 64 13.438 -9.152 78.850 1.00 0.00 H new ATOM 0 HD3 PRO A 64 11.795 -8.545 78.875 1.00 0.00 H new ATOM 996 N ASP A 65 12.406 -5.264 74.879 1.00 0.00 N ATOM 997 CA ASP A 65 12.760 -4.690 73.546 1.00 0.00 C ATOM 998 C ASP A 65 12.332 -3.217 73.523 1.00 0.00 C ATOM 999 O ASP A 65 13.130 -2.328 73.298 1.00 0.00 O ATOM 1000 CB ASP A 65 11.994 -5.446 72.455 1.00 0.00 C ATOM 1001 CG ASP A 65 12.669 -6.788 72.176 1.00 0.00 C ATOM 1002 OD1 ASP A 65 13.739 -6.783 71.588 1.00 0.00 O ATOM 1003 OD2 ASP A 65 12.100 -7.802 72.547 1.00 0.00 O ATOM 0 H ASP A 65 11.480 -4.997 75.214 1.00 0.00 H new ATOM 0 HA ASP A 65 13.832 -4.777 73.371 1.00 0.00 H new ATOM 0 HB2 ASP A 65 10.963 -5.607 72.768 1.00 0.00 H new ATOM 0 HB3 ASP A 65 11.961 -4.850 71.543 1.00 0.00 H new ATOM 1008 N LYS A 66 11.071 -2.960 73.762 1.00 0.00 N ATOM 1009 CA LYS A 66 10.566 -1.565 73.764 1.00 0.00 C ATOM 1010 C LYS A 66 10.789 -0.955 75.145 1.00 0.00 C ATOM 1011 O LYS A 66 10.827 0.249 75.310 1.00 0.00 O ATOM 1012 CB LYS A 66 9.077 -1.586 73.446 1.00 0.00 C ATOM 1013 CG LYS A 66 8.629 -0.184 73.049 1.00 0.00 C ATOM 1014 CD LYS A 66 8.820 0.026 71.543 1.00 0.00 C ATOM 1015 CE LYS A 66 8.237 1.382 71.136 1.00 0.00 C ATOM 1016 NZ LYS A 66 8.865 1.828 69.861 1.00 0.00 N ATOM 0 H LYS A 66 10.366 -3.670 73.958 1.00 0.00 H new ATOM 0 HA LYS A 66 11.093 -0.970 73.018 1.00 0.00 H new ATOM 0 HB2 LYS A 66 8.876 -2.288 72.637 1.00 0.00 H new ATOM 0 HB3 LYS A 66 8.513 -1.929 74.313 1.00 0.00 H new ATOM 0 HG2 LYS A 66 7.581 -0.041 73.314 1.00 0.00 H new ATOM 0 HG3 LYS A 66 9.202 0.559 73.603 1.00 0.00 H new ATOM 0 HD2 LYS A 66 9.880 -0.016 71.291 1.00 0.00 H new ATOM 0 HD3 LYS A 66 8.329 -0.774 70.989 1.00 0.00 H new ATOM 0 HE2 LYS A 66 7.157 1.304 71.014 1.00 0.00 H new ATOM 0 HE3 LYS A 66 8.417 2.118 71.920 1.00 0.00 H new ATOM 0 HZ1 LYS A 66 8.470 2.749 69.583 1.00 0.00 H new ATOM 0 HZ2 LYS A 66 9.893 1.918 69.993 1.00 0.00 H new ATOM 0 HZ3 LYS A 66 8.671 1.129 69.116 1.00 0.00 H new ATOM 1030 N HIS A 67 10.955 -1.785 76.135 1.00 0.00 N ATOM 1031 CA HIS A 67 11.196 -1.279 77.508 1.00 0.00 C ATOM 1032 C HIS A 67 12.659 -0.869 77.612 1.00 0.00 C ATOM 1033 O HIS A 67 13.123 -0.417 78.638 1.00 0.00 O ATOM 1034 CB HIS A 67 10.905 -2.398 78.504 1.00 0.00 C ATOM 1035 CG HIS A 67 9.709 -3.184 78.043 1.00 0.00 C ATOM 1036 ND1 HIS A 67 9.588 -4.544 78.275 1.00 0.00 N ATOM 1037 CD2 HIS A 67 8.575 -2.815 77.363 1.00 0.00 C ATOM 1038 CE1 HIS A 67 8.419 -4.943 77.744 1.00 0.00 C ATOM 1039 NE2 HIS A 67 7.761 -3.929 77.175 1.00 0.00 N ATOM 0 H HIS A 67 10.933 -2.801 76.048 1.00 0.00 H new ATOM 0 HA HIS A 67 10.553 -0.426 77.725 1.00 0.00 H new ATOM 0 HB2 HIS A 67 11.771 -3.053 78.594 1.00 0.00 H new ATOM 0 HB3 HIS A 67 10.719 -1.979 79.493 1.00 0.00 H new ATOM 0 HD2 HIS A 67 8.349 -1.814 77.026 1.00 0.00 H new ATOM 0 HE1 HIS A 67 8.056 -5.960 77.774 1.00 0.00 H new ATOM 0 HE2 HIS A 67 6.857 -3.963 76.704 1.00 0.00 H new ATOM 1047 N HIS A 68 13.382 -1.027 76.537 1.00 0.00 N ATOM 1048 CA HIS A 68 14.827 -0.660 76.514 1.00 0.00 C ATOM 1049 C HIS A 68 15.486 -0.921 77.865 1.00 0.00 C ATOM 1050 O HIS A 68 16.376 -0.201 78.268 1.00 0.00 O ATOM 1051 CB HIS A 68 14.970 0.824 76.178 1.00 0.00 C ATOM 1052 CG HIS A 68 14.329 1.655 77.260 1.00 0.00 C ATOM 1053 ND1 HIS A 68 14.909 1.822 78.510 1.00 0.00 N ATOM 1054 CD2 HIS A 68 13.165 2.382 77.288 1.00 0.00 C ATOM 1055 CE1 HIS A 68 14.099 2.621 79.228 1.00 0.00 C ATOM 1056 NE2 HIS A 68 13.021 2.991 78.530 1.00 0.00 N ATOM 0 H HIS A 68 13.026 -1.402 75.658 1.00 0.00 H new ATOM 0 HA HIS A 68 15.319 -1.274 75.759 1.00 0.00 H new ATOM 0 HB2 HIS A 68 16.024 1.085 76.082 1.00 0.00 H new ATOM 0 HB3 HIS A 68 14.501 1.036 75.217 1.00 0.00 H new ATOM 0 HD1 HIS A 68 15.789 1.414 78.826 1.00 0.00 H new ATOM 0 HD2 HIS A 68 12.466 2.468 76.469 1.00 0.00 H new ATOM 0 HE1 HIS A 68 14.296 2.926 80.245 1.00 0.00 H new ATOM 1064 N ILE A 69 15.079 -1.932 78.579 1.00 0.00 N ATOM 1065 CA ILE A 69 15.733 -2.174 79.889 1.00 0.00 C ATOM 1066 C ILE A 69 15.565 -3.614 80.344 1.00 0.00 C ATOM 1067 O ILE A 69 14.700 -4.350 79.913 1.00 0.00 O ATOM 1068 CB ILE A 69 15.141 -1.240 80.948 1.00 0.00 C ATOM 1069 CG1 ILE A 69 16.272 -0.464 81.647 1.00 0.00 C ATOM 1070 CG2 ILE A 69 14.338 -2.053 81.980 1.00 0.00 C ATOM 1071 CD1 ILE A 69 17.216 -1.417 82.388 1.00 0.00 C ATOM 0 H ILE A 69 14.340 -2.586 78.319 1.00 0.00 H new ATOM 0 HA ILE A 69 16.798 -1.976 79.766 1.00 0.00 H new ATOM 0 HB ILE A 69 14.470 -0.531 80.464 1.00 0.00 H new ATOM 0 HG12 ILE A 69 16.834 0.110 80.910 1.00 0.00 H new ATOM 0 HG13 ILE A 69 15.846 0.251 82.350 1.00 0.00 H new ATOM 0 HG21 ILE A 69 13.921 -1.380 82.729 1.00 0.00 H new ATOM 0 HG22 ILE A 69 13.529 -2.582 81.477 1.00 0.00 H new ATOM 0 HG23 ILE A 69 14.995 -2.774 82.466 1.00 0.00 H new ATOM 0 HD11 ILE A 69 18.006 -0.843 82.873 1.00 0.00 H new ATOM 0 HD12 ILE A 69 16.656 -1.971 83.141 1.00 0.00 H new ATOM 0 HD13 ILE A 69 17.659 -2.115 81.678 1.00 0.00 H new ATOM 1083 N THR A 70 16.412 -3.979 81.247 1.00 0.00 N ATOM 1084 CA THR A 70 16.414 -5.328 81.841 1.00 0.00 C ATOM 1085 C THR A 70 15.779 -5.188 83.257 1.00 0.00 C ATOM 1086 O THR A 70 16.047 -4.219 83.927 1.00 0.00 O ATOM 1087 CB THR A 70 17.892 -5.747 81.895 1.00 0.00 C ATOM 1088 OG1 THR A 70 18.455 -5.328 83.116 1.00 0.00 O ATOM 1089 CG2 THR A 70 18.647 -5.029 80.794 1.00 0.00 C ATOM 0 H THR A 70 17.139 -3.365 81.615 1.00 0.00 H new ATOM 0 HA THR A 70 15.848 -6.078 81.287 1.00 0.00 H new ATOM 0 HB THR A 70 17.958 -6.829 81.786 1.00 0.00 H new ATOM 0 HG1 THR A 70 19.429 -5.269 83.024 1.00 0.00 H new ATOM 0 HG21 THR A 70 19.697 -5.320 80.824 1.00 0.00 H new ATOM 0 HG22 THR A 70 18.223 -5.299 79.827 1.00 0.00 H new ATOM 0 HG23 THR A 70 18.564 -3.952 80.939 1.00 0.00 H new ATOM 1097 N PRO A 71 14.908 -6.092 83.663 1.00 0.00 N ATOM 1098 CA PRO A 71 14.212 -5.968 84.974 1.00 0.00 C ATOM 1099 C PRO A 71 15.170 -6.001 86.186 1.00 0.00 C ATOM 1100 O PRO A 71 14.816 -5.542 87.258 1.00 0.00 O ATOM 1101 CB PRO A 71 13.229 -7.151 85.006 1.00 0.00 C ATOM 1102 CG PRO A 71 13.253 -7.790 83.597 1.00 0.00 C ATOM 1103 CD PRO A 71 14.521 -7.281 82.888 1.00 0.00 C ATOM 0 HA PRO A 71 13.716 -5.001 85.057 1.00 0.00 H new ATOM 0 HB2 PRO A 71 13.522 -7.877 85.765 1.00 0.00 H new ATOM 0 HB3 PRO A 71 12.225 -6.812 85.260 1.00 0.00 H new ATOM 0 HG2 PRO A 71 13.262 -8.878 83.668 1.00 0.00 H new ATOM 0 HG3 PRO A 71 12.361 -7.515 83.034 1.00 0.00 H new ATOM 0 HD2 PRO A 71 15.309 -8.034 82.891 1.00 0.00 H new ATOM 0 HD3 PRO A 71 14.323 -7.031 81.846 1.00 0.00 H new ATOM 1111 N LEU A 72 16.363 -6.529 86.064 1.00 0.00 N ATOM 1112 CA LEU A 72 17.257 -6.549 87.259 1.00 0.00 C ATOM 1113 C LEU A 72 17.384 -5.126 87.800 1.00 0.00 C ATOM 1114 O LEU A 72 17.406 -4.908 88.992 1.00 0.00 O ATOM 1115 CB LEU A 72 18.660 -7.104 86.929 1.00 0.00 C ATOM 1116 CG LEU A 72 18.651 -8.040 85.708 1.00 0.00 C ATOM 1117 CD1 LEU A 72 17.535 -9.077 85.827 1.00 0.00 C ATOM 1118 CD2 LEU A 72 18.472 -7.232 84.426 1.00 0.00 C ATOM 0 H LEU A 72 16.748 -6.937 85.212 1.00 0.00 H new ATOM 0 HA LEU A 72 16.814 -7.210 88.004 1.00 0.00 H new ATOM 0 HB2 LEU A 72 19.341 -6.274 86.741 1.00 0.00 H new ATOM 0 HB3 LEU A 72 19.046 -7.644 87.794 1.00 0.00 H new ATOM 0 HG LEU A 72 19.607 -8.562 85.672 1.00 0.00 H new ATOM 0 HD11 LEU A 72 17.548 -9.728 84.953 1.00 0.00 H new ATOM 0 HD12 LEU A 72 17.688 -9.674 86.726 1.00 0.00 H new ATOM 0 HD13 LEU A 72 16.572 -8.570 85.888 1.00 0.00 H new ATOM 0 HD21 LEU A 72 18.467 -7.906 83.569 1.00 0.00 H new ATOM 0 HD22 LEU A 72 17.527 -6.690 84.467 1.00 0.00 H new ATOM 0 HD23 LEU A 72 19.293 -6.523 84.325 1.00 0.00 H new ATOM 1130 N LEU A 73 17.458 -4.149 86.935 1.00 0.00 N ATOM 1131 CA LEU A 73 17.564 -2.746 87.422 1.00 0.00 C ATOM 1132 C LEU A 73 16.218 -2.343 88.031 1.00 0.00 C ATOM 1133 O LEU A 73 16.131 -1.452 88.850 1.00 0.00 O ATOM 1134 CB LEU A 73 17.934 -1.799 86.265 1.00 0.00 C ATOM 1135 CG LEU A 73 19.276 -2.235 85.632 1.00 0.00 C ATOM 1136 CD1 LEU A 73 19.036 -3.221 84.485 1.00 0.00 C ATOM 1137 CD2 LEU A 73 20.019 -1.006 85.087 1.00 0.00 C ATOM 0 H LEU A 73 17.450 -4.262 85.921 1.00 0.00 H new ATOM 0 HA LEU A 73 18.349 -2.675 88.175 1.00 0.00 H new ATOM 0 HB2 LEU A 73 17.147 -1.808 85.511 1.00 0.00 H new ATOM 0 HB3 LEU A 73 18.011 -0.776 86.632 1.00 0.00 H new ATOM 0 HG LEU A 73 19.875 -2.721 86.402 1.00 0.00 H new ATOM 0 HD11 LEU A 73 19.992 -3.516 84.053 1.00 0.00 H new ATOM 0 HD12 LEU A 73 18.522 -4.104 84.866 1.00 0.00 H new ATOM 0 HD13 LEU A 73 18.423 -2.746 83.719 1.00 0.00 H new ATOM 0 HD21 LEU A 73 20.964 -1.319 84.642 1.00 0.00 H new ATOM 0 HD22 LEU A 73 19.406 -0.517 84.330 1.00 0.00 H new ATOM 0 HD23 LEU A 73 20.215 -0.309 85.901 1.00 0.00 H new ATOM 1149 N SER A 74 15.164 -3.004 87.640 1.00 0.00 N ATOM 1150 CA SER A 74 13.828 -2.671 88.206 1.00 0.00 C ATOM 1151 C SER A 74 13.863 -2.831 89.730 1.00 0.00 C ATOM 1152 O SER A 74 13.424 -1.971 90.472 1.00 0.00 O ATOM 1153 CB SER A 74 12.775 -3.605 87.610 1.00 0.00 C ATOM 1154 OG SER A 74 11.476 -3.136 87.950 1.00 0.00 O ATOM 0 H SER A 74 15.170 -3.759 86.954 1.00 0.00 H new ATOM 0 HA SER A 74 13.574 -1.640 87.960 1.00 0.00 H new ATOM 0 HB2 SER A 74 12.885 -3.649 86.526 1.00 0.00 H new ATOM 0 HB3 SER A 74 12.917 -4.618 87.987 1.00 0.00 H new ATOM 0 HG SER A 74 11.214 -3.501 88.821 1.00 0.00 H new ATOM 1160 N ALA A 75 14.391 -3.924 90.200 1.00 0.00 N ATOM 1161 CA ALA A 75 14.464 -4.142 91.676 1.00 0.00 C ATOM 1162 C ALA A 75 15.475 -3.167 92.267 1.00 0.00 C ATOM 1163 O ALA A 75 15.316 -2.680 93.367 1.00 0.00 O ATOM 1164 CB ALA A 75 14.909 -5.577 91.967 1.00 0.00 C ATOM 0 H ALA A 75 14.776 -4.677 89.630 1.00 0.00 H new ATOM 0 HA ALA A 75 13.483 -3.977 92.121 1.00 0.00 H new ATOM 0 HB1 ALA A 75 14.961 -5.730 93.045 1.00 0.00 H new ATOM 0 HB2 ALA A 75 14.192 -6.275 91.535 1.00 0.00 H new ATOM 0 HB3 ALA A 75 15.892 -5.749 91.529 1.00 0.00 H new ATOM 1170 N VAL A 76 16.516 -2.880 91.539 1.00 0.00 N ATOM 1171 CA VAL A 76 17.547 -1.938 92.044 1.00 0.00 C ATOM 1172 C VAL A 76 16.868 -0.718 92.689 1.00 0.00 C ATOM 1173 O VAL A 76 16.934 -0.524 93.889 1.00 0.00 O ATOM 1174 CB VAL A 76 18.434 -1.506 90.873 1.00 0.00 C ATOM 1175 CG1 VAL A 76 19.230 -0.259 91.256 1.00 0.00 C ATOM 1176 CG2 VAL A 76 19.390 -2.653 90.515 1.00 0.00 C ATOM 0 H VAL A 76 16.697 -3.261 90.610 1.00 0.00 H new ATOM 0 HA VAL A 76 18.162 -2.425 92.801 1.00 0.00 H new ATOM 0 HB VAL A 76 17.811 -1.271 90.010 1.00 0.00 H new ATOM 0 HG11 VAL A 76 19.859 0.043 90.418 1.00 0.00 H new ATOM 0 HG12 VAL A 76 18.542 0.550 91.503 1.00 0.00 H new ATOM 0 HG13 VAL A 76 19.857 -0.479 92.120 1.00 0.00 H new ATOM 0 HG21 VAL A 76 20.024 -2.351 89.682 1.00 0.00 H new ATOM 0 HG22 VAL A 76 20.013 -2.890 91.378 1.00 0.00 H new ATOM 0 HG23 VAL A 76 18.813 -3.533 90.231 1.00 0.00 H new ATOM 1186 N TYR A 77 16.208 0.098 91.911 1.00 0.00 N ATOM 1187 CA TYR A 77 15.524 1.294 92.485 1.00 0.00 C ATOM 1188 C TYR A 77 14.329 0.834 93.327 1.00 0.00 C ATOM 1189 O TYR A 77 13.264 1.416 93.277 1.00 0.00 O ATOM 1190 CB TYR A 77 15.024 2.202 91.349 1.00 0.00 C ATOM 1191 CG TYR A 77 15.879 2.029 90.114 1.00 0.00 C ATOM 1192 CD1 TYR A 77 17.024 2.816 89.939 1.00 0.00 C ATOM 1193 CD2 TYR A 77 15.518 1.095 89.135 1.00 0.00 C ATOM 1194 CE1 TYR A 77 17.809 2.665 88.787 1.00 0.00 C ATOM 1195 CE2 TYR A 77 16.302 0.946 87.983 1.00 0.00 C ATOM 1196 CZ TYR A 77 17.446 1.731 87.809 1.00 0.00 C ATOM 1197 OH TYR A 77 18.217 1.585 86.672 1.00 0.00 O ATOM 0 H TYR A 77 16.113 -0.012 90.901 1.00 0.00 H new ATOM 0 HA TYR A 77 16.226 1.849 93.108 1.00 0.00 H new ATOM 0 HB2 TYR A 77 13.986 1.964 91.116 1.00 0.00 H new ATOM 0 HB3 TYR A 77 15.047 3.243 91.671 1.00 0.00 H new ATOM 0 HD1 TYR A 77 17.302 3.539 90.691 1.00 0.00 H new ATOM 0 HD2 TYR A 77 14.634 0.489 89.268 1.00 0.00 H new ATOM 0 HE1 TYR A 77 18.694 3.269 88.654 1.00 0.00 H new ATOM 0 HE2 TYR A 77 16.023 0.225 87.229 1.00 0.00 H new ATOM 0 HH TYR A 77 17.641 1.621 85.880 1.00 0.00 H new ATOM 1207 N GLU A 78 14.496 -0.213 94.093 1.00 0.00 N ATOM 1208 CA GLU A 78 13.367 -0.718 94.929 1.00 0.00 C ATOM 1209 C GLU A 78 13.826 -0.918 96.371 1.00 0.00 C ATOM 1210 O GLU A 78 13.058 -0.774 97.300 1.00 0.00 O ATOM 1211 CB GLU A 78 12.887 -2.064 94.377 1.00 0.00 C ATOM 1212 CG GLU A 78 11.455 -2.320 94.853 1.00 0.00 C ATOM 1213 CD GLU A 78 10.482 -1.601 93.921 1.00 0.00 C ATOM 1214 OE1 GLU A 78 10.687 -1.666 92.719 1.00 0.00 O ATOM 1215 OE2 GLU A 78 9.552 -0.993 94.421 1.00 0.00 O ATOM 0 H GLU A 78 15.365 -0.740 94.176 1.00 0.00 H new ATOM 0 HA GLU A 78 12.558 0.012 94.903 1.00 0.00 H new ATOM 0 HB2 GLU A 78 12.926 -2.059 93.288 1.00 0.00 H new ATOM 0 HB3 GLU A 78 13.544 -2.865 94.715 1.00 0.00 H new ATOM 0 HG2 GLU A 78 11.247 -3.390 94.861 1.00 0.00 H new ATOM 0 HG3 GLU A 78 11.329 -1.963 95.875 1.00 0.00 H new ATOM 1222 N GLY A 79 15.057 -1.279 96.570 1.00 0.00 N ATOM 1223 CA GLY A 79 15.540 -1.522 97.954 1.00 0.00 C ATOM 1224 C GLY A 79 15.351 -3.005 98.249 1.00 0.00 C ATOM 1225 O GLY A 79 15.746 -3.505 99.281 1.00 0.00 O ATOM 0 H GLY A 79 15.751 -1.417 95.835 1.00 0.00 H new ATOM 0 HA2 GLY A 79 16.589 -1.243 98.049 1.00 0.00 H new ATOM 0 HA3 GLY A 79 14.983 -0.915 98.667 1.00 0.00 H new ATOM 1229 N HIS A 80 14.764 -3.712 97.321 1.00 0.00 N ATOM 1230 CA HIS A 80 14.561 -5.169 97.506 1.00 0.00 C ATOM 1231 C HIS A 80 15.900 -5.829 97.213 1.00 0.00 C ATOM 1232 O HIS A 80 16.497 -6.465 98.059 1.00 0.00 O ATOM 1233 CB HIS A 80 13.507 -5.662 96.504 1.00 0.00 C ATOM 1234 CG HIS A 80 12.142 -5.634 97.135 1.00 0.00 C ATOM 1235 ND1 HIS A 80 11.386 -6.782 97.326 1.00 0.00 N ATOM 1236 CD2 HIS A 80 11.371 -4.595 97.584 1.00 0.00 C ATOM 1237 CE1 HIS A 80 10.212 -6.404 97.862 1.00 0.00 C ATOM 1238 NE2 HIS A 80 10.151 -5.082 98.041 1.00 0.00 N ATOM 0 H HIS A 80 14.416 -3.336 96.439 1.00 0.00 H new ATOM 0 HA HIS A 80 14.218 -5.406 98.513 1.00 0.00 H new ATOM 0 HB2 HIS A 80 13.518 -5.033 95.614 1.00 0.00 H new ATOM 0 HB3 HIS A 80 13.746 -6.675 96.181 1.00 0.00 H new ATOM 0 HD2 HIS A 80 11.665 -3.556 97.583 1.00 0.00 H new ATOM 0 HE1 HIS A 80 9.415 -7.087 98.117 1.00 0.00 H new ATOM 0 HE2 HIS A 80 9.376 -4.545 98.430 1.00 0.00 H new ATOM 1246 N VAL A 81 16.376 -5.647 96.014 1.00 0.00 N ATOM 1247 CA VAL A 81 17.684 -6.212 95.606 1.00 0.00 C ATOM 1248 C VAL A 81 17.925 -7.582 96.235 1.00 0.00 C ATOM 1249 O VAL A 81 19.010 -8.130 96.172 1.00 0.00 O ATOM 1250 CB VAL A 81 18.792 -5.203 95.932 1.00 0.00 C ATOM 1251 CG1 VAL A 81 18.888 -4.176 94.781 1.00 0.00 C ATOM 1252 CG2 VAL A 81 18.457 -4.460 97.233 1.00 0.00 C ATOM 0 H VAL A 81 15.899 -5.117 95.285 1.00 0.00 H new ATOM 0 HA VAL A 81 17.687 -6.382 94.529 1.00 0.00 H new ATOM 0 HB VAL A 81 19.738 -5.731 96.050 1.00 0.00 H new ATOM 0 HG11 VAL A 81 19.673 -3.453 95.003 1.00 0.00 H new ATOM 0 HG12 VAL A 81 19.123 -4.693 93.851 1.00 0.00 H new ATOM 0 HG13 VAL A 81 17.936 -3.656 94.677 1.00 0.00 H new ATOM 0 HG21 VAL A 81 19.249 -3.745 97.458 1.00 0.00 H new ATOM 0 HG22 VAL A 81 17.512 -3.930 97.116 1.00 0.00 H new ATOM 0 HG23 VAL A 81 18.373 -5.177 98.050 1.00 0.00 H new ATOM 1262 N SER A 82 16.903 -8.182 96.761 1.00 0.00 N ATOM 1263 CA SER A 82 17.060 -9.557 97.282 1.00 0.00 C ATOM 1264 C SER A 82 16.952 -10.444 96.049 1.00 0.00 C ATOM 1265 O SER A 82 17.389 -11.578 96.015 1.00 0.00 O ATOM 1266 CB SER A 82 15.940 -9.877 98.271 1.00 0.00 C ATOM 1267 OG SER A 82 16.414 -9.677 99.595 1.00 0.00 O ATOM 0 H SER A 82 15.969 -7.781 96.852 1.00 0.00 H new ATOM 0 HA SER A 82 18.001 -9.700 97.814 1.00 0.00 H new ATOM 0 HB2 SER A 82 15.077 -9.239 98.081 1.00 0.00 H new ATOM 0 HB3 SER A 82 15.609 -10.907 98.142 1.00 0.00 H new ATOM 0 HG SER A 82 15.698 -9.880 100.233 1.00 0.00 H new ATOM 1273 N CYS A 83 16.364 -9.882 95.025 1.00 0.00 N ATOM 1274 CA CYS A 83 16.183 -10.590 93.735 1.00 0.00 C ATOM 1275 C CYS A 83 17.462 -10.434 92.915 1.00 0.00 C ATOM 1276 O CYS A 83 18.080 -11.404 92.531 1.00 0.00 O ATOM 1277 CB CYS A 83 15.006 -9.955 92.985 1.00 0.00 C ATOM 1278 SG CYS A 83 14.754 -8.270 93.599 1.00 0.00 S ATOM 0 H CYS A 83 15.993 -8.932 95.036 1.00 0.00 H new ATOM 0 HA CYS A 83 15.979 -11.648 93.901 1.00 0.00 H new ATOM 0 HB2 CYS A 83 15.207 -9.939 91.914 1.00 0.00 H new ATOM 0 HB3 CYS A 83 14.103 -10.548 93.131 1.00 0.00 H new ATOM 0 HG CYS A 83 13.639 -7.798 93.126 1.00 0.00 H new ATOM 1284 N VAL A 84 17.871 -9.213 92.658 1.00 0.00 N ATOM 1285 CA VAL A 84 19.124 -8.998 91.877 1.00 0.00 C ATOM 1286 C VAL A 84 20.123 -10.075 92.285 1.00 0.00 C ATOM 1287 O VAL A 84 20.846 -10.619 91.478 1.00 0.00 O ATOM 1288 CB VAL A 84 19.719 -7.625 92.207 1.00 0.00 C ATOM 1289 CG1 VAL A 84 18.709 -6.523 91.897 1.00 0.00 C ATOM 1290 CG2 VAL A 84 20.075 -7.581 93.686 1.00 0.00 C ATOM 0 H VAL A 84 17.392 -8.363 92.955 1.00 0.00 H new ATOM 0 HA VAL A 84 18.908 -9.046 90.810 1.00 0.00 H new ATOM 0 HB VAL A 84 20.611 -7.466 91.602 1.00 0.00 H new ATOM 0 HG11 VAL A 84 19.144 -5.553 92.136 1.00 0.00 H new ATOM 0 HG12 VAL A 84 18.450 -6.554 90.839 1.00 0.00 H new ATOM 0 HG13 VAL A 84 17.810 -6.675 92.495 1.00 0.00 H new ATOM 0 HG21 VAL A 84 20.499 -6.607 93.929 1.00 0.00 H new ATOM 0 HG22 VAL A 84 19.177 -7.745 94.281 1.00 0.00 H new ATOM 0 HG23 VAL A 84 20.804 -8.360 93.908 1.00 0.00 H new ATOM 1300 N LYS A 85 20.154 -10.380 93.549 1.00 0.00 N ATOM 1301 CA LYS A 85 21.086 -11.415 94.058 1.00 0.00 C ATOM 1302 C LYS A 85 20.820 -12.767 93.371 1.00 0.00 C ATOM 1303 O LYS A 85 21.568 -13.205 92.511 1.00 0.00 O ATOM 1304 CB LYS A 85 20.865 -11.546 95.568 1.00 0.00 C ATOM 1305 CG LYS A 85 21.424 -10.306 96.294 1.00 0.00 C ATOM 1306 CD LYS A 85 22.436 -10.737 97.360 1.00 0.00 C ATOM 1307 CE LYS A 85 23.747 -11.147 96.682 1.00 0.00 C ATOM 1308 NZ LYS A 85 24.779 -11.411 97.721 1.00 0.00 N ATOM 0 H LYS A 85 19.564 -9.949 94.260 1.00 0.00 H new ATOM 0 HA LYS A 85 22.115 -11.126 93.844 1.00 0.00 H new ATOM 0 HB2 LYS A 85 19.801 -11.652 95.780 1.00 0.00 H new ATOM 0 HB3 LYS A 85 21.355 -12.446 95.939 1.00 0.00 H new ATOM 0 HG2 LYS A 85 21.901 -9.638 95.577 1.00 0.00 H new ATOM 0 HG3 LYS A 85 20.610 -9.748 96.757 1.00 0.00 H new ATOM 0 HD2 LYS A 85 22.615 -9.920 98.058 1.00 0.00 H new ATOM 0 HD3 LYS A 85 22.038 -11.570 97.940 1.00 0.00 H new ATOM 0 HE2 LYS A 85 23.591 -12.038 96.074 1.00 0.00 H new ATOM 0 HE3 LYS A 85 24.085 -10.357 96.011 1.00 0.00 H new ATOM 0 HZ1 LYS A 85 25.670 -11.690 97.262 1.00 0.00 H new ATOM 0 HZ2 LYS A 85 24.934 -10.550 98.283 1.00 0.00 H new ATOM 0 HZ3 LYS A 85 24.456 -12.178 98.344 1.00 0.00 H new ATOM 1322 N LEU A 86 19.768 -13.434 93.755 1.00 0.00 N ATOM 1323 CA LEU A 86 19.446 -14.757 93.153 1.00 0.00 C ATOM 1324 C LEU A 86 19.155 -14.596 91.650 1.00 0.00 C ATOM 1325 O LEU A 86 18.895 -15.547 90.946 1.00 0.00 O ATOM 1326 CB LEU A 86 18.266 -15.365 93.956 1.00 0.00 C ATOM 1327 CG LEU A 86 16.970 -15.515 93.136 1.00 0.00 C ATOM 1328 CD1 LEU A 86 16.620 -14.211 92.395 1.00 0.00 C ATOM 1329 CD2 LEU A 86 17.098 -16.684 92.144 1.00 0.00 C ATOM 0 H LEU A 86 19.111 -13.116 94.467 1.00 0.00 H new ATOM 0 HA LEU A 86 20.287 -15.447 93.215 1.00 0.00 H new ATOM 0 HB2 LEU A 86 18.562 -16.344 94.334 1.00 0.00 H new ATOM 0 HB3 LEU A 86 18.066 -14.736 94.823 1.00 0.00 H new ATOM 0 HG LEU A 86 16.157 -15.730 93.829 1.00 0.00 H new ATOM 0 HD11 LEU A 86 15.701 -14.351 91.826 1.00 0.00 H new ATOM 0 HD12 LEU A 86 16.480 -13.408 93.118 1.00 0.00 H new ATOM 0 HD13 LEU A 86 17.431 -13.950 91.715 1.00 0.00 H new ATOM 0 HD21 LEU A 86 16.175 -16.778 91.572 1.00 0.00 H new ATOM 0 HD22 LEU A 86 17.929 -16.495 91.464 1.00 0.00 H new ATOM 0 HD23 LEU A 86 17.281 -17.608 92.692 1.00 0.00 H new ATOM 1341 N LEU A 87 19.207 -13.395 91.145 1.00 0.00 N ATOM 1342 CA LEU A 87 18.923 -13.195 89.695 1.00 0.00 C ATOM 1343 C LEU A 87 20.125 -13.607 88.843 1.00 0.00 C ATOM 1344 O LEU A 87 20.091 -14.620 88.172 1.00 0.00 O ATOM 1345 CB LEU A 87 18.602 -11.717 89.439 1.00 0.00 C ATOM 1346 CG LEU A 87 17.163 -11.573 88.936 1.00 0.00 C ATOM 1347 CD1 LEU A 87 16.760 -10.093 88.937 1.00 0.00 C ATOM 1348 CD2 LEU A 87 17.049 -12.141 87.516 1.00 0.00 C ATOM 0 H LEU A 87 19.432 -12.549 91.668 1.00 0.00 H new ATOM 0 HA LEU A 87 18.071 -13.817 89.419 1.00 0.00 H new ATOM 0 HB2 LEU A 87 18.734 -11.143 90.356 1.00 0.00 H new ATOM 0 HB3 LEU A 87 19.295 -11.308 88.704 1.00 0.00 H new ATOM 0 HG LEU A 87 16.496 -12.127 89.596 1.00 0.00 H new ATOM 0 HD11 LEU A 87 15.735 -9.995 88.578 1.00 0.00 H new ATOM 0 HD12 LEU A 87 16.829 -9.698 89.950 1.00 0.00 H new ATOM 0 HD13 LEU A 87 17.429 -9.533 88.283 1.00 0.00 H new ATOM 0 HD21 LEU A 87 16.023 -12.036 87.163 1.00 0.00 H new ATOM 0 HD22 LEU A 87 17.719 -11.596 86.851 1.00 0.00 H new ATOM 0 HD23 LEU A 87 17.324 -13.196 87.523 1.00 0.00 H new ATOM 1360 N LEU A 88 21.180 -12.832 88.826 1.00 0.00 N ATOM 1361 CA LEU A 88 22.328 -13.220 87.964 1.00 0.00 C ATOM 1362 C LEU A 88 22.713 -14.662 88.264 1.00 0.00 C ATOM 1363 O LEU A 88 23.414 -15.300 87.504 1.00 0.00 O ATOM 1364 CB LEU A 88 23.535 -12.269 88.123 1.00 0.00 C ATOM 1365 CG LEU A 88 24.294 -12.484 89.445 1.00 0.00 C ATOM 1366 CD1 LEU A 88 23.315 -12.506 90.616 1.00 0.00 C ATOM 1367 CD2 LEU A 88 25.094 -13.799 89.400 1.00 0.00 C ATOM 0 H LEU A 88 21.293 -11.969 89.358 1.00 0.00 H new ATOM 0 HA LEU A 88 22.018 -13.136 86.923 1.00 0.00 H new ATOM 0 HB2 LEU A 88 24.220 -12.416 87.288 1.00 0.00 H new ATOM 0 HB3 LEU A 88 23.188 -11.237 88.072 1.00 0.00 H new ATOM 0 HG LEU A 88 24.991 -11.658 89.582 1.00 0.00 H new ATOM 0 HD11 LEU A 88 23.863 -12.659 91.546 1.00 0.00 H new ATOM 0 HD12 LEU A 88 22.781 -11.557 90.661 1.00 0.00 H new ATOM 0 HD13 LEU A 88 22.601 -13.318 90.478 1.00 0.00 H new ATOM 0 HD21 LEU A 88 25.624 -13.935 90.343 1.00 0.00 H new ATOM 0 HD22 LEU A 88 24.412 -14.635 89.244 1.00 0.00 H new ATOM 0 HD23 LEU A 88 25.813 -13.760 88.582 1.00 0.00 H new ATOM 1379 N SER A 89 22.233 -15.193 89.352 1.00 0.00 N ATOM 1380 CA SER A 89 22.548 -16.608 89.675 1.00 0.00 C ATOM 1381 C SER A 89 22.079 -17.464 88.500 1.00 0.00 C ATOM 1382 O SER A 89 22.423 -18.622 88.374 1.00 0.00 O ATOM 1383 CB SER A 89 21.809 -17.027 90.948 1.00 0.00 C ATOM 1384 OG SER A 89 22.376 -18.232 91.445 1.00 0.00 O ATOM 0 H SER A 89 21.640 -14.711 90.027 1.00 0.00 H new ATOM 0 HA SER A 89 23.618 -16.735 89.840 1.00 0.00 H new ATOM 0 HB2 SER A 89 21.881 -16.241 91.699 1.00 0.00 H new ATOM 0 HB3 SER A 89 20.749 -17.170 90.737 1.00 0.00 H new ATOM 0 HG SER A 89 21.906 -18.502 92.261 1.00 0.00 H new ATOM 1390 N LYS A 90 21.298 -16.875 87.629 1.00 0.00 N ATOM 1391 CA LYS A 90 20.790 -17.608 86.431 1.00 0.00 C ATOM 1392 C LYS A 90 21.414 -16.991 85.182 1.00 0.00 C ATOM 1393 O LYS A 90 21.513 -17.611 84.144 1.00 0.00 O ATOM 1394 CB LYS A 90 19.268 -17.454 86.347 1.00 0.00 C ATOM 1395 CG LYS A 90 18.622 -17.966 87.638 1.00 0.00 C ATOM 1396 CD LYS A 90 17.130 -18.235 87.409 1.00 0.00 C ATOM 1397 CE LYS A 90 16.362 -16.912 87.399 1.00 0.00 C ATOM 1398 NZ LYS A 90 16.688 -16.135 88.629 1.00 0.00 N ATOM 0 H LYS A 90 20.988 -15.906 87.699 1.00 0.00 H new ATOM 0 HA LYS A 90 21.049 -18.664 86.506 1.00 0.00 H new ATOM 0 HB2 LYS A 90 19.007 -16.407 86.190 1.00 0.00 H new ATOM 0 HB3 LYS A 90 18.884 -18.010 85.492 1.00 0.00 H new ATOM 0 HG2 LYS A 90 19.118 -18.880 87.965 1.00 0.00 H new ATOM 0 HG3 LYS A 90 18.749 -17.232 88.434 1.00 0.00 H new ATOM 0 HD2 LYS A 90 16.986 -18.757 86.463 1.00 0.00 H new ATOM 0 HD3 LYS A 90 16.743 -18.885 88.194 1.00 0.00 H new ATOM 0 HE2 LYS A 90 16.624 -16.335 86.512 1.00 0.00 H new ATOM 0 HE3 LYS A 90 15.290 -17.103 87.351 1.00 0.00 H new ATOM 0 HZ1 LYS A 90 15.946 -15.426 88.799 1.00 0.00 H new ATOM 0 HZ2 LYS A 90 16.743 -16.780 89.443 1.00 0.00 H new ATOM 0 HZ3 LYS A 90 17.603 -15.656 88.505 1.00 0.00 H new ATOM 1412 N GLY A 91 21.831 -15.763 85.289 1.00 0.00 N ATOM 1413 CA GLY A 91 22.455 -15.063 84.134 1.00 0.00 C ATOM 1414 C GLY A 91 22.195 -13.561 84.262 1.00 0.00 C ATOM 1415 O GLY A 91 22.962 -12.839 84.863 1.00 0.00 O ATOM 0 H GLY A 91 21.765 -15.206 86.141 1.00 0.00 H new ATOM 0 HA2 GLY A 91 23.527 -15.259 84.110 1.00 0.00 H new ATOM 0 HA3 GLY A 91 22.041 -15.438 83.198 1.00 0.00 H new ATOM 1419 N ALA A 92 21.102 -13.099 83.717 1.00 0.00 N ATOM 1420 CA ALA A 92 20.745 -11.649 83.808 1.00 0.00 C ATOM 1421 C ALA A 92 21.977 -10.746 83.653 1.00 0.00 C ATOM 1422 O ALA A 92 21.888 -9.552 83.867 1.00 0.00 O ATOM 1423 CB ALA A 92 20.110 -11.384 85.179 1.00 0.00 C ATOM 0 H ALA A 92 20.430 -13.671 83.205 1.00 0.00 H new ATOM 0 HA ALA A 92 20.052 -11.419 82.999 1.00 0.00 H new ATOM 0 HB1 ALA A 92 19.845 -10.330 85.259 1.00 0.00 H new ATOM 0 HB2 ALA A 92 19.213 -11.993 85.288 1.00 0.00 H new ATOM 0 HB3 ALA A 92 20.821 -11.640 85.965 1.00 0.00 H new ATOM 1429 N ASP A 93 23.118 -11.277 83.289 1.00 0.00 N ATOM 1430 CA ASP A 93 24.322 -10.403 83.142 1.00 0.00 C ATOM 1431 C ASP A 93 24.261 -9.280 84.188 1.00 0.00 C ATOM 1432 O ASP A 93 24.448 -9.498 85.368 1.00 0.00 O ATOM 1433 CB ASP A 93 24.320 -9.794 81.740 1.00 0.00 C ATOM 1434 CG ASP A 93 22.949 -9.176 81.462 1.00 0.00 C ATOM 1435 OD1 ASP A 93 22.031 -9.925 81.167 1.00 0.00 O ATOM 1436 OD2 ASP A 93 22.838 -7.964 81.553 1.00 0.00 O ATOM 0 H ASP A 93 23.267 -12.266 83.089 1.00 0.00 H new ATOM 0 HA ASP A 93 25.230 -10.988 83.290 1.00 0.00 H new ATOM 0 HB2 ASP A 93 25.098 -9.034 81.659 1.00 0.00 H new ATOM 0 HB3 ASP A 93 24.544 -10.560 80.998 1.00 0.00 H new ATOM 1441 N LYS A 94 23.970 -8.087 83.752 1.00 0.00 N ATOM 1442 CA LYS A 94 23.853 -6.935 84.679 1.00 0.00 C ATOM 1443 C LYS A 94 23.011 -5.868 83.976 1.00 0.00 C ATOM 1444 O LYS A 94 22.000 -5.420 84.479 1.00 0.00 O ATOM 1445 CB LYS A 94 25.244 -6.397 85.013 1.00 0.00 C ATOM 1446 CG LYS A 94 26.208 -6.645 83.840 1.00 0.00 C ATOM 1447 CD LYS A 94 27.265 -5.538 83.801 1.00 0.00 C ATOM 1448 CE LYS A 94 26.597 -4.196 83.473 1.00 0.00 C ATOM 1449 NZ LYS A 94 27.466 -3.422 82.545 1.00 0.00 N ATOM 0 H LYS A 94 23.806 -7.861 82.771 1.00 0.00 H new ATOM 0 HA LYS A 94 23.379 -7.230 85.615 1.00 0.00 H new ATOM 0 HB2 LYS A 94 25.187 -5.330 85.226 1.00 0.00 H new ATOM 0 HB3 LYS A 94 25.623 -6.882 85.913 1.00 0.00 H new ATOM 0 HG2 LYS A 94 26.689 -7.617 83.950 1.00 0.00 H new ATOM 0 HG3 LYS A 94 25.656 -6.668 82.901 1.00 0.00 H new ATOM 0 HD2 LYS A 94 27.776 -5.476 84.762 1.00 0.00 H new ATOM 0 HD3 LYS A 94 28.022 -5.771 83.052 1.00 0.00 H new ATOM 0 HE2 LYS A 94 25.621 -4.365 83.018 1.00 0.00 H new ATOM 0 HE3 LYS A 94 26.428 -3.629 84.388 1.00 0.00 H new ATOM 0 HZ1 LYS A 94 27.013 -2.513 82.323 1.00 0.00 H new ATOM 0 HZ2 LYS A 94 28.387 -3.249 82.995 1.00 0.00 H new ATOM 0 HZ3 LYS A 94 27.605 -3.963 81.668 1.00 0.00 H new ATOM 1463 N THR A 95 23.401 -5.501 82.787 1.00 0.00 N ATOM 1464 CA THR A 95 22.616 -4.514 81.998 1.00 0.00 C ATOM 1465 C THR A 95 22.718 -4.924 80.537 1.00 0.00 C ATOM 1466 O THR A 95 23.324 -4.251 79.727 1.00 0.00 O ATOM 1467 CB THR A 95 23.162 -3.095 82.172 1.00 0.00 C ATOM 1468 OG1 THR A 95 24.480 -3.014 81.650 1.00 0.00 O ATOM 1469 CG2 THR A 95 23.163 -2.722 83.652 1.00 0.00 C ATOM 0 H THR A 95 24.241 -5.848 82.324 1.00 0.00 H new ATOM 0 HA THR A 95 21.582 -4.508 82.342 1.00 0.00 H new ATOM 0 HB THR A 95 22.525 -2.398 81.628 1.00 0.00 H new ATOM 0 HG1 THR A 95 24.470 -3.247 80.698 1.00 0.00 H new ATOM 0 HG21 THR A 95 23.552 -1.711 83.772 1.00 0.00 H new ATOM 0 HG22 THR A 95 22.145 -2.767 84.039 1.00 0.00 H new ATOM 0 HG23 THR A 95 23.792 -3.421 84.203 1.00 0.00 H new ATOM 1477 N VAL A 96 22.143 -6.039 80.199 1.00 0.00 N ATOM 1478 CA VAL A 96 22.224 -6.515 78.802 1.00 0.00 C ATOM 1479 C VAL A 96 21.368 -5.594 77.924 1.00 0.00 C ATOM 1480 O VAL A 96 21.159 -5.848 76.754 1.00 0.00 O ATOM 1481 CB VAL A 96 21.730 -7.982 78.755 1.00 0.00 C ATOM 1482 CG1 VAL A 96 20.683 -8.190 77.651 1.00 0.00 C ATOM 1483 CG2 VAL A 96 22.920 -8.915 78.495 1.00 0.00 C ATOM 0 H VAL A 96 21.619 -6.641 80.834 1.00 0.00 H new ATOM 0 HA VAL A 96 23.247 -6.488 78.426 1.00 0.00 H new ATOM 0 HB VAL A 96 21.268 -8.210 79.715 1.00 0.00 H new ATOM 0 HG11 VAL A 96 20.359 -9.231 77.648 1.00 0.00 H new ATOM 0 HG12 VAL A 96 19.825 -7.544 77.837 1.00 0.00 H new ATOM 0 HG13 VAL A 96 21.120 -7.943 76.684 1.00 0.00 H new ATOM 0 HG21 VAL A 96 22.572 -9.948 78.462 1.00 0.00 H new ATOM 0 HG22 VAL A 96 23.383 -8.657 77.542 1.00 0.00 H new ATOM 0 HG23 VAL A 96 23.651 -8.804 79.296 1.00 0.00 H new ATOM 1493 N LYS A 97 20.883 -4.507 78.474 1.00 0.00 N ATOM 1494 CA LYS A 97 20.059 -3.583 77.641 1.00 0.00 C ATOM 1495 C LYS A 97 19.875 -2.207 78.313 1.00 0.00 C ATOM 1496 O LYS A 97 19.190 -1.358 77.781 1.00 0.00 O ATOM 1497 CB LYS A 97 18.689 -4.229 77.375 1.00 0.00 C ATOM 1498 CG LYS A 97 18.502 -4.447 75.873 1.00 0.00 C ATOM 1499 CD LYS A 97 18.172 -3.111 75.208 1.00 0.00 C ATOM 1500 CE LYS A 97 18.333 -3.238 73.693 1.00 0.00 C ATOM 1501 NZ LYS A 97 17.883 -4.590 73.258 1.00 0.00 N ATOM 0 H LYS A 97 21.019 -4.225 79.445 1.00 0.00 H new ATOM 0 HA LYS A 97 20.584 -3.414 76.701 1.00 0.00 H new ATOM 0 HB2 LYS A 97 18.617 -5.181 77.902 1.00 0.00 H new ATOM 0 HB3 LYS A 97 17.894 -3.590 77.761 1.00 0.00 H new ATOM 0 HG2 LYS A 97 19.409 -4.869 75.439 1.00 0.00 H new ATOM 0 HG3 LYS A 97 17.700 -5.163 75.695 1.00 0.00 H new ATOM 0 HD2 LYS A 97 17.152 -2.814 75.452 1.00 0.00 H new ATOM 0 HD3 LYS A 97 18.831 -2.331 75.590 1.00 0.00 H new ATOM 0 HE2 LYS A 97 17.749 -2.469 73.189 1.00 0.00 H new ATOM 0 HE3 LYS A 97 19.375 -3.082 73.413 1.00 0.00 H new ATOM 0 HZ1 LYS A 97 17.668 -4.574 72.241 1.00 0.00 H new ATOM 0 HZ2 LYS A 97 18.637 -5.283 73.442 1.00 0.00 H new ATOM 0 HZ3 LYS A 97 17.029 -4.859 73.788 1.00 0.00 H new ATOM 1515 N GLY A 98 20.477 -1.950 79.451 1.00 0.00 N ATOM 1516 CA GLY A 98 20.302 -0.604 80.078 1.00 0.00 C ATOM 1517 C GLY A 98 21.112 0.404 79.265 1.00 0.00 C ATOM 1518 O GLY A 98 21.872 0.014 78.400 1.00 0.00 O ATOM 0 H GLY A 98 21.071 -2.602 79.964 1.00 0.00 H new ATOM 0 HA2 GLY A 98 19.249 -0.324 80.092 1.00 0.00 H new ATOM 0 HA3 GLY A 98 20.641 -0.619 81.114 1.00 0.00 H new ATOM 1522 N PRO A 99 20.958 1.667 79.563 1.00 0.00 N ATOM 1523 CA PRO A 99 21.712 2.707 78.857 1.00 0.00 C ATOM 1524 C PRO A 99 23.182 2.303 78.785 1.00 0.00 C ATOM 1525 O PRO A 99 23.661 1.836 77.771 1.00 0.00 O ATOM 1526 CB PRO A 99 21.503 3.978 79.696 1.00 0.00 C ATOM 1527 CG PRO A 99 20.422 3.653 80.765 1.00 0.00 C ATOM 1528 CD PRO A 99 20.051 2.161 80.613 1.00 0.00 C ATOM 0 HA PRO A 99 21.384 2.862 77.829 1.00 0.00 H new ATOM 0 HB2 PRO A 99 22.435 4.282 80.172 1.00 0.00 H new ATOM 0 HB3 PRO A 99 21.182 4.807 79.065 1.00 0.00 H new ATOM 0 HG2 PRO A 99 20.801 3.853 81.767 1.00 0.00 H new ATOM 0 HG3 PRO A 99 19.543 4.283 80.625 1.00 0.00 H new ATOM 0 HD2 PRO A 99 20.192 1.619 81.548 1.00 0.00 H new ATOM 0 HD3 PRO A 99 19.006 2.038 80.327 1.00 0.00 H new ATOM 1536 N ASP A 100 23.899 2.472 79.852 1.00 0.00 N ATOM 1537 CA ASP A 100 25.335 2.092 79.846 1.00 0.00 C ATOM 1538 C ASP A 100 25.792 1.827 81.280 1.00 0.00 C ATOM 1539 O ASP A 100 25.308 0.931 81.949 1.00 0.00 O ATOM 1540 CB ASP A 100 26.155 3.238 79.247 1.00 0.00 C ATOM 1541 CG ASP A 100 27.617 2.810 79.105 1.00 0.00 C ATOM 1542 OD1 ASP A 100 27.848 1.641 78.846 1.00 0.00 O ATOM 1543 OD2 ASP A 100 28.480 3.660 79.253 1.00 0.00 O ATOM 0 H ASP A 100 23.554 2.857 80.731 1.00 0.00 H new ATOM 0 HA ASP A 100 25.478 1.192 79.249 1.00 0.00 H new ATOM 0 HB2 ASP A 100 25.752 3.516 78.273 1.00 0.00 H new ATOM 0 HB3 ASP A 100 26.085 4.119 79.884 1.00 0.00 H new ATOM 1548 N GLY A 101 26.719 2.598 81.757 1.00 0.00 N ATOM 1549 CA GLY A 101 27.212 2.391 83.141 1.00 0.00 C ATOM 1550 C GLY A 101 26.075 2.629 84.133 1.00 0.00 C ATOM 1551 O GLY A 101 26.259 2.541 85.341 1.00 0.00 O ATOM 0 H GLY A 101 27.159 3.365 81.248 1.00 0.00 H new ATOM 0 HA2 GLY A 101 27.598 1.378 83.252 1.00 0.00 H new ATOM 0 HA3 GLY A 101 28.038 3.072 83.349 1.00 0.00 H new ATOM 1555 N LEU A 102 24.883 2.902 83.655 1.00 0.00 N ATOM 1556 CA LEU A 102 23.776 3.119 84.614 1.00 0.00 C ATOM 1557 C LEU A 102 23.819 1.992 85.606 1.00 0.00 C ATOM 1558 O LEU A 102 24.115 2.190 86.767 1.00 0.00 O ATOM 1559 CB LEU A 102 22.415 3.137 83.922 1.00 0.00 C ATOM 1560 CG LEU A 102 21.324 3.595 84.913 1.00 0.00 C ATOM 1561 CD1 LEU A 102 19.968 3.649 84.211 1.00 0.00 C ATOM 1562 CD2 LEU A 102 21.229 2.619 86.088 1.00 0.00 C ATOM 0 H LEU A 102 24.641 2.981 82.667 1.00 0.00 H new ATOM 0 HA LEU A 102 23.902 4.088 85.096 1.00 0.00 H new ATOM 0 HB2 LEU A 102 22.443 3.808 83.064 1.00 0.00 H new ATOM 0 HB3 LEU A 102 22.178 2.143 83.542 1.00 0.00 H new ATOM 0 HG LEU A 102 21.591 4.586 85.281 1.00 0.00 H new ATOM 0 HD11 LEU A 102 19.205 3.973 84.918 1.00 0.00 H new ATOM 0 HD12 LEU A 102 20.016 4.354 83.381 1.00 0.00 H new ATOM 0 HD13 LEU A 102 19.715 2.659 83.832 1.00 0.00 H new ATOM 0 HD21 LEU A 102 20.455 2.955 86.779 1.00 0.00 H new ATOM 0 HD22 LEU A 102 20.977 1.626 85.716 1.00 0.00 H new ATOM 0 HD23 LEU A 102 22.187 2.580 86.607 1.00 0.00 H new ATOM 1574 N THR A 103 23.534 0.804 85.157 1.00 0.00 N ATOM 1575 CA THR A 103 23.557 -0.352 86.084 1.00 0.00 C ATOM 1576 C THR A 103 23.353 0.147 87.522 1.00 0.00 C ATOM 1577 O THR A 103 22.335 0.732 87.871 1.00 0.00 O ATOM 1578 CB THR A 103 24.935 -1.013 85.988 1.00 0.00 C ATOM 1579 OG1 THR A 103 25.220 -1.332 84.635 1.00 0.00 O ATOM 1580 CG2 THR A 103 24.978 -2.286 86.839 1.00 0.00 C ATOM 0 H THR A 103 23.287 0.586 84.192 1.00 0.00 H new ATOM 0 HA THR A 103 22.769 -1.058 85.824 1.00 0.00 H new ATOM 0 HB THR A 103 25.684 -0.316 86.362 1.00 0.00 H new ATOM 0 HG1 THR A 103 26.187 -1.448 84.523 1.00 0.00 H new ATOM 0 HG21 THR A 103 25.964 -2.744 86.760 1.00 0.00 H new ATOM 0 HG22 THR A 103 24.777 -2.034 87.880 1.00 0.00 H new ATOM 0 HG23 THR A 103 24.223 -2.987 86.483 1.00 0.00 H new ATOM 1588 N ALA A 104 24.333 -0.065 88.351 1.00 0.00 N ATOM 1589 CA ALA A 104 24.241 0.394 89.765 1.00 0.00 C ATOM 1590 C ALA A 104 24.940 1.753 89.929 1.00 0.00 C ATOM 1591 O ALA A 104 24.656 2.494 90.846 1.00 0.00 O ATOM 1592 CB ALA A 104 24.913 -0.629 90.674 1.00 0.00 C ATOM 0 H ALA A 104 25.202 -0.541 88.109 1.00 0.00 H new ATOM 0 HA ALA A 104 23.190 0.498 90.035 1.00 0.00 H new ATOM 0 HB1 ALA A 104 24.847 -0.295 91.709 1.00 0.00 H new ATOM 0 HB2 ALA A 104 24.413 -1.592 90.571 1.00 0.00 H new ATOM 0 HB3 ALA A 104 25.961 -0.733 90.393 1.00 0.00 H new ATOM 1598 N LEU A 105 25.882 2.063 89.072 1.00 0.00 N ATOM 1599 CA LEU A 105 26.635 3.341 89.200 1.00 0.00 C ATOM 1600 C LEU A 105 25.697 4.556 89.210 1.00 0.00 C ATOM 1601 O LEU A 105 25.676 5.325 90.152 1.00 0.00 O ATOM 1602 CB LEU A 105 27.587 3.481 88.011 1.00 0.00 C ATOM 1603 CG LEU A 105 28.296 2.156 87.726 1.00 0.00 C ATOM 1604 CD1 LEU A 105 29.289 2.353 86.581 1.00 0.00 C ATOM 1605 CD2 LEU A 105 29.042 1.676 88.973 1.00 0.00 C ATOM 0 H LEU A 105 26.161 1.478 88.284 1.00 0.00 H new ATOM 0 HA LEU A 105 27.180 3.314 90.144 1.00 0.00 H new ATOM 0 HB2 LEU A 105 27.031 3.798 87.129 1.00 0.00 H new ATOM 0 HB3 LEU A 105 28.324 4.256 88.219 1.00 0.00 H new ATOM 0 HG LEU A 105 27.555 1.406 87.449 1.00 0.00 H new ATOM 0 HD11 LEU A 105 29.797 1.411 86.374 1.00 0.00 H new ATOM 0 HD12 LEU A 105 28.755 2.681 85.689 1.00 0.00 H new ATOM 0 HD13 LEU A 105 30.024 3.107 86.862 1.00 0.00 H new ATOM 0 HD21 LEU A 105 29.542 0.732 88.757 1.00 0.00 H new ATOM 0 HD22 LEU A 105 29.783 2.421 89.263 1.00 0.00 H new ATOM 0 HD23 LEU A 105 28.333 1.532 89.788 1.00 0.00 H new ATOM 1617 N GLU A 106 24.964 4.771 88.157 1.00 0.00 N ATOM 1618 CA GLU A 106 24.087 5.962 88.094 1.00 0.00 C ATOM 1619 C GLU A 106 22.760 5.681 88.803 1.00 0.00 C ATOM 1620 O GLU A 106 21.957 6.568 89.009 1.00 0.00 O ATOM 1621 CB GLU A 106 23.816 6.287 86.621 1.00 0.00 C ATOM 1622 CG GLU A 106 25.109 6.149 85.804 1.00 0.00 C ATOM 1623 CD GLU A 106 26.001 7.369 86.037 1.00 0.00 C ATOM 1624 OE1 GLU A 106 26.363 7.605 87.179 1.00 0.00 O ATOM 1625 OE2 GLU A 106 26.307 8.048 85.071 1.00 0.00 O ATOM 0 H GLU A 106 24.937 4.168 87.335 1.00 0.00 H new ATOM 0 HA GLU A 106 24.576 6.802 88.587 1.00 0.00 H new ATOM 0 HB2 GLU A 106 23.054 5.615 86.226 1.00 0.00 H new ATOM 0 HB3 GLU A 106 23.425 7.301 86.530 1.00 0.00 H new ATOM 0 HG2 GLU A 106 25.637 5.240 86.093 1.00 0.00 H new ATOM 0 HG3 GLU A 106 24.872 6.057 84.744 1.00 0.00 H new ATOM 1632 N ALA A 107 22.508 4.453 89.158 1.00 0.00 N ATOM 1633 CA ALA A 107 21.209 4.136 89.825 1.00 0.00 C ATOM 1634 C ALA A 107 21.191 4.518 91.310 1.00 0.00 C ATOM 1635 O ALA A 107 20.167 4.924 91.820 1.00 0.00 O ATOM 1636 CB ALA A 107 20.927 2.637 89.732 1.00 0.00 C ATOM 0 H ALA A 107 23.135 3.661 89.019 1.00 0.00 H new ATOM 0 HA ALA A 107 20.451 4.722 89.305 1.00 0.00 H new ATOM 0 HB1 ALA A 107 19.978 2.414 90.221 1.00 0.00 H new ATOM 0 HB2 ALA A 107 20.874 2.341 88.684 1.00 0.00 H new ATOM 0 HB3 ALA A 107 21.727 2.085 90.225 1.00 0.00 H new ATOM 1642 N THR A 108 22.259 4.333 92.044 1.00 0.00 N ATOM 1643 CA THR A 108 22.164 4.634 93.495 1.00 0.00 C ATOM 1644 C THR A 108 23.521 4.890 94.144 1.00 0.00 C ATOM 1645 O THR A 108 24.491 5.262 93.517 1.00 0.00 O ATOM 1646 CB THR A 108 21.579 3.392 94.149 1.00 0.00 C ATOM 1647 OG1 THR A 108 21.438 3.605 95.547 1.00 0.00 O ATOM 1648 CG2 THR A 108 22.536 2.221 93.889 1.00 0.00 C ATOM 0 H THR A 108 23.163 3.997 91.711 1.00 0.00 H new ATOM 0 HA THR A 108 21.563 5.534 93.624 1.00 0.00 H new ATOM 0 HB THR A 108 20.596 3.172 93.733 1.00 0.00 H new ATOM 0 HG1 THR A 108 21.063 4.496 95.706 1.00 0.00 H new ATOM 0 HG21 THR A 108 22.138 1.317 94.349 1.00 0.00 H new ATOM 0 HG22 THR A 108 22.639 2.067 92.815 1.00 0.00 H new ATOM 0 HG23 THR A 108 23.512 2.447 94.318 1.00 0.00 H new ATOM 1656 N ASP A 109 23.556 4.639 95.428 1.00 0.00 N ATOM 1657 CA ASP A 109 24.791 4.788 96.231 1.00 0.00 C ATOM 1658 C ASP A 109 24.765 3.735 97.350 1.00 0.00 C ATOM 1659 O ASP A 109 25.714 3.583 98.091 1.00 0.00 O ATOM 1660 CB ASP A 109 24.864 6.190 96.841 1.00 0.00 C ATOM 1661 CG ASP A 109 25.997 6.234 97.868 1.00 0.00 C ATOM 1662 OD1 ASP A 109 27.146 6.239 97.455 1.00 0.00 O ATOM 1663 OD2 ASP A 109 25.697 6.258 99.049 1.00 0.00 O ATOM 0 H ASP A 109 22.746 4.326 95.964 1.00 0.00 H new ATOM 0 HA ASP A 109 25.665 4.646 95.595 1.00 0.00 H new ATOM 0 HB2 ASP A 109 25.036 6.931 96.060 1.00 0.00 H new ATOM 0 HB3 ASP A 109 23.916 6.442 97.316 1.00 0.00 H new ATOM 1668 N ASN A 110 23.685 2.990 97.463 1.00 0.00 N ATOM 1669 CA ASN A 110 23.621 1.935 98.518 1.00 0.00 C ATOM 1670 C ASN A 110 24.476 0.757 98.042 1.00 0.00 C ATOM 1671 O ASN A 110 24.571 0.487 96.863 1.00 0.00 O ATOM 1672 CB ASN A 110 22.166 1.500 98.763 1.00 0.00 C ATOM 1673 CG ASN A 110 21.441 1.321 97.436 1.00 0.00 C ATOM 1674 OD1 ASN A 110 22.137 1.265 96.346 1.00 0.00 O flip ATOM 1675 ND2 ASN A 110 20.229 1.230 97.394 1.00 0.00 N flip ATOM 0 H ASN A 110 22.856 3.069 96.874 1.00 0.00 H new ATOM 0 HA ASN A 110 24.002 2.317 99.465 1.00 0.00 H new ATOM 0 HB2 ASN A 110 22.147 0.566 99.325 1.00 0.00 H new ATOM 0 HB3 ASN A 110 21.652 2.247 99.369 1.00 0.00 H new ATOM 0 HD21 ASN A 110 19.684 1.275 98.255 1.00 0.00 H new ATOM 0 HD22 ASN A 110 19.757 1.109 96.498 1.00 0.00 H new ATOM 1682 N GLN A 111 25.153 0.102 98.936 1.00 0.00 N ATOM 1683 CA GLN A 111 26.069 -1.003 98.526 1.00 0.00 C ATOM 1684 C GLN A 111 25.344 -2.345 98.284 1.00 0.00 C ATOM 1685 O GLN A 111 25.979 -3.357 98.074 1.00 0.00 O ATOM 1686 CB GLN A 111 27.138 -1.135 99.610 1.00 0.00 C ATOM 1687 CG GLN A 111 27.927 -2.434 99.458 1.00 0.00 C ATOM 1688 CD GLN A 111 29.243 -2.290 100.219 1.00 0.00 C ATOM 1689 OE1 GLN A 111 29.262 -1.768 101.316 1.00 0.00 O ATOM 1690 NE2 GLN A 111 30.349 -2.722 99.683 1.00 0.00 N ATOM 0 H GLN A 111 25.115 0.282 99.939 1.00 0.00 H new ATOM 0 HA GLN A 111 26.515 -0.753 97.564 1.00 0.00 H new ATOM 0 HB2 GLN A 111 27.819 -0.285 99.557 1.00 0.00 H new ATOM 0 HB3 GLN A 111 26.668 -1.106 100.593 1.00 0.00 H new ATOM 0 HG2 GLN A 111 27.353 -3.274 99.849 1.00 0.00 H new ATOM 0 HG3 GLN A 111 28.118 -2.641 98.405 1.00 0.00 H new ATOM 0 HE21 GLN A 111 30.332 -3.160 98.762 1.00 0.00 H new ATOM 0 HE22 GLN A 111 31.232 -2.622 100.184 1.00 0.00 H new ATOM 1699 N ALA A 112 24.041 -2.379 98.262 1.00 0.00 N ATOM 1700 CA ALA A 112 23.356 -3.680 97.987 1.00 0.00 C ATOM 1701 C ALA A 112 23.235 -3.832 96.473 1.00 0.00 C ATOM 1702 O ALA A 112 23.474 -4.879 95.887 1.00 0.00 O ATOM 1703 CB ALA A 112 21.961 -3.681 98.620 1.00 0.00 C ATOM 0 H ALA A 112 23.427 -1.580 98.419 1.00 0.00 H new ATOM 0 HA ALA A 112 23.927 -4.506 98.411 1.00 0.00 H new ATOM 0 HB1 ALA A 112 21.469 -4.632 98.415 1.00 0.00 H new ATOM 0 HB2 ALA A 112 22.050 -3.544 99.698 1.00 0.00 H new ATOM 0 HB3 ALA A 112 21.370 -2.868 98.198 1.00 0.00 H new ATOM 1709 N ILE A 113 22.907 -2.758 95.846 1.00 0.00 N ATOM 1710 CA ILE A 113 22.788 -2.744 94.370 1.00 0.00 C ATOM 1711 C ILE A 113 24.190 -2.856 93.820 1.00 0.00 C ATOM 1712 O ILE A 113 24.498 -3.680 92.976 1.00 0.00 O ATOM 1713 CB ILE A 113 22.221 -1.396 93.920 1.00 0.00 C ATOM 1714 CG1 ILE A 113 20.772 -1.226 94.383 1.00 0.00 C ATOM 1715 CG2 ILE A 113 22.270 -1.291 92.390 1.00 0.00 C ATOM 1716 CD1 ILE A 113 20.657 -1.428 95.890 1.00 0.00 C ATOM 0 H ILE A 113 22.710 -1.865 96.299 1.00 0.00 H new ATOM 0 HA ILE A 113 22.141 -3.552 94.027 1.00 0.00 H new ATOM 0 HB ILE A 113 22.830 -0.611 94.368 1.00 0.00 H new ATOM 0 HG12 ILE A 113 20.415 -0.231 94.117 1.00 0.00 H new ATOM 0 HG13 ILE A 113 20.134 -1.943 93.866 1.00 0.00 H new ATOM 0 HG21 ILE A 113 21.865 -0.328 92.078 1.00 0.00 H new ATOM 0 HG22 ILE A 113 23.303 -1.376 92.052 1.00 0.00 H new ATOM 0 HG23 ILE A 113 21.677 -2.094 91.951 1.00 0.00 H new ATOM 0 HD11 ILE A 113 19.618 -1.302 96.196 1.00 0.00 H new ATOM 0 HD12 ILE A 113 20.993 -2.432 96.149 1.00 0.00 H new ATOM 0 HD13 ILE A 113 21.278 -0.694 96.404 1.00 0.00 H new ATOM 1728 N LYS A 114 25.048 -2.014 94.303 1.00 0.00 N ATOM 1729 CA LYS A 114 26.439 -2.035 93.830 1.00 0.00 C ATOM 1730 C LYS A 114 26.948 -3.469 93.953 1.00 0.00 C ATOM 1731 O LYS A 114 27.959 -3.837 93.396 1.00 0.00 O ATOM 1732 CB LYS A 114 27.281 -1.080 94.676 1.00 0.00 C ATOM 1733 CG LYS A 114 26.598 0.301 94.741 1.00 0.00 C ATOM 1734 CD LYS A 114 26.938 1.114 93.487 1.00 0.00 C ATOM 1735 CE LYS A 114 26.717 2.598 93.769 1.00 0.00 C ATOM 1736 NZ LYS A 114 27.678 3.046 94.816 1.00 0.00 N ATOM 0 H LYS A 114 24.839 -1.309 95.010 1.00 0.00 H new ATOM 0 HA LYS A 114 26.507 -1.709 92.792 1.00 0.00 H new ATOM 0 HB2 LYS A 114 27.404 -1.483 95.681 1.00 0.00 H new ATOM 0 HB3 LYS A 114 28.278 -0.983 94.247 1.00 0.00 H new ATOM 0 HG2 LYS A 114 25.518 0.178 94.823 1.00 0.00 H new ATOM 0 HG3 LYS A 114 26.926 0.837 95.632 1.00 0.00 H new ATOM 0 HD2 LYS A 114 27.974 0.938 93.196 1.00 0.00 H new ATOM 0 HD3 LYS A 114 26.314 0.794 92.653 1.00 0.00 H new ATOM 0 HE2 LYS A 114 26.857 3.179 92.857 1.00 0.00 H new ATOM 0 HE3 LYS A 114 25.693 2.769 94.101 1.00 0.00 H new ATOM 0 HZ1 LYS A 114 27.907 4.050 94.670 1.00 0.00 H new ATOM 0 HZ2 LYS A 114 27.251 2.921 95.756 1.00 0.00 H new ATOM 0 HZ3 LYS A 114 28.548 2.480 94.753 1.00 0.00 H new ATOM 1750 N ALA A 115 26.220 -4.298 94.661 1.00 0.00 N ATOM 1751 CA ALA A 115 26.631 -5.713 94.787 1.00 0.00 C ATOM 1752 C ALA A 115 26.574 -6.327 93.402 1.00 0.00 C ATOM 1753 O ALA A 115 27.435 -7.087 93.019 1.00 0.00 O ATOM 1754 CB ALA A 115 25.678 -6.466 95.723 1.00 0.00 C ATOM 0 H ALA A 115 25.362 -4.048 95.153 1.00 0.00 H new ATOM 0 HA ALA A 115 27.636 -5.778 95.204 1.00 0.00 H new ATOM 0 HB1 ALA A 115 25.995 -7.506 95.805 1.00 0.00 H new ATOM 0 HB2 ALA A 115 25.695 -6.003 96.709 1.00 0.00 H new ATOM 0 HB3 ALA A 115 24.666 -6.425 95.321 1.00 0.00 H new ATOM 1760 N LEU A 116 25.579 -5.977 92.627 1.00 0.00 N ATOM 1761 CA LEU A 116 25.515 -6.539 91.252 1.00 0.00 C ATOM 1762 C LEU A 116 26.669 -5.935 90.449 1.00 0.00 C ATOM 1763 O LEU A 116 26.960 -6.351 89.342 1.00 0.00 O ATOM 1764 CB LEU A 116 24.174 -6.194 90.588 1.00 0.00 C ATOM 1765 CG LEU A 116 23.282 -7.442 90.478 1.00 0.00 C ATOM 1766 CD1 LEU A 116 22.084 -7.115 89.584 1.00 0.00 C ATOM 1767 CD2 LEU A 116 24.052 -8.623 89.856 1.00 0.00 C ATOM 0 H LEU A 116 24.825 -5.340 92.883 1.00 0.00 H new ATOM 0 HA LEU A 116 25.598 -7.625 91.287 1.00 0.00 H new ATOM 0 HB2 LEU A 116 23.663 -5.426 91.168 1.00 0.00 H new ATOM 0 HB3 LEU A 116 24.351 -5.779 89.596 1.00 0.00 H new ATOM 0 HG LEU A 116 22.958 -7.725 91.479 1.00 0.00 H new ATOM 0 HD11 LEU A 116 21.444 -7.993 89.498 1.00 0.00 H new ATOM 0 HD12 LEU A 116 21.517 -6.293 90.022 1.00 0.00 H new ATOM 0 HD13 LEU A 116 22.437 -6.825 88.594 1.00 0.00 H new ATOM 0 HD21 LEU A 116 23.396 -9.491 89.791 1.00 0.00 H new ATOM 0 HD22 LEU A 116 24.392 -8.350 88.857 1.00 0.00 H new ATOM 0 HD23 LEU A 116 24.913 -8.865 90.479 1.00 0.00 H new ATOM 1779 N LEU A 117 27.365 -4.990 91.025 1.00 0.00 N ATOM 1780 CA LEU A 117 28.531 -4.403 90.310 1.00 0.00 C ATOM 1781 C LEU A 117 29.665 -5.401 90.497 1.00 0.00 C ATOM 1782 O LEU A 117 30.639 -5.409 89.770 1.00 0.00 O ATOM 1783 CB LEU A 117 28.911 -3.040 90.932 1.00 0.00 C ATOM 1784 CG LEU A 117 29.178 -1.979 89.846 1.00 0.00 C ATOM 1785 CD1 LEU A 117 30.372 -2.386 88.980 1.00 0.00 C ATOM 1786 CD2 LEU A 117 27.941 -1.796 88.958 1.00 0.00 C ATOM 0 H LEU A 117 27.177 -4.604 91.950 1.00 0.00 H new ATOM 0 HA LEU A 117 28.314 -4.227 89.257 1.00 0.00 H new ATOM 0 HB2 LEU A 117 28.107 -2.700 91.585 1.00 0.00 H new ATOM 0 HB3 LEU A 117 29.799 -3.157 91.554 1.00 0.00 H new ATOM 0 HG LEU A 117 29.403 -1.036 90.344 1.00 0.00 H new ATOM 0 HD11 LEU A 117 30.546 -1.625 88.219 1.00 0.00 H new ATOM 0 HD12 LEU A 117 31.259 -2.482 89.606 1.00 0.00 H new ATOM 0 HD13 LEU A 117 30.163 -3.341 88.498 1.00 0.00 H new ATOM 0 HD21 LEU A 117 28.147 -1.043 88.197 1.00 0.00 H new ATOM 0 HD22 LEU A 117 27.696 -2.742 88.476 1.00 0.00 H new ATOM 0 HD23 LEU A 117 27.099 -1.472 89.570 1.00 0.00 H new ATOM 1798 N GLN A 118 29.504 -6.269 91.465 1.00 0.00 N ATOM 1799 CA GLN A 118 30.524 -7.321 91.735 1.00 0.00 C ATOM 1800 C GLN A 118 31.901 -6.881 91.223 1.00 0.00 C ATOM 1801 O GLN A 118 32.475 -7.613 90.433 1.00 0.00 O ATOM 1802 CB GLN A 118 30.107 -8.618 91.046 1.00 0.00 C ATOM 1803 CG GLN A 118 28.607 -8.858 91.245 1.00 0.00 C ATOM 1804 CD GLN A 118 28.170 -10.085 90.438 1.00 0.00 C ATOM 1805 OE1 GLN A 118 28.496 -10.208 89.273 1.00 0.00 O ATOM 1806 NE2 GLN A 118 27.437 -11.002 91.009 1.00 0.00 N ATOM 1807 OXT GLN A 118 32.357 -5.827 91.631 1.00 0.00 O ATOM 0 H GLN A 118 28.696 -6.291 92.087 1.00 0.00 H new ATOM 0 HA GLN A 118 30.591 -7.481 92.811 1.00 0.00 H new ATOM 0 HB2 GLN A 118 30.337 -8.564 89.982 1.00 0.00 H new ATOM 0 HB3 GLN A 118 30.675 -9.455 91.453 1.00 0.00 H new ATOM 0 HG2 GLN A 118 28.390 -9.010 92.302 1.00 0.00 H new ATOM 0 HG3 GLN A 118 28.043 -7.981 90.927 1.00 0.00 H new ATOM 0 HE21 GLN A 118 27.163 -10.900 91.986 1.00 0.00 H new ATOM 0 HE22 GLN A 118 27.139 -11.820 90.478 1.00 0.00 H new TER 1816 GLN A 118