USER MOD reduce.3.24.130724 H: found=0, std=0, add=948, rem=0, adj=29 USER MOD reduce.3.24.130724 removed 952 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 75 SER OG : rot 70:sc= 0.689 USER MOD Set 1.2: A 133 MET CE :methyl 152:sc= -0.982 (180deg=-3.03) USER MOD Set 2.1: A 106 LYS NZ :NH3+ 179:sc= 0.747 (180deg=0) USER MOD Set 2.2: A 113 GLN : amide:sc= 0.149 K(o=0.83,f=-7.4!) USER MOD Set 2.3: A 149 SER OG : rot 180:sc= -0.065 USER MOD Set 3.1: A 90 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Set 3.2: A 100 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Set 4.1: A 88 SER OG : rot 180:sc= -0.029 USER MOD Set 4.2: A 102 HIS : no HD1:sc= -0.336 X(o=-0.37,f=-0.71) USER MOD Set 5.1: A 84 GLN : amide:sc= -1.2 K(o=-1.4,f=-0.2) USER MOD Set 5.2: A 86 GLN : amide:sc= -0.22 K(o=-1.4,f=-0.65) USER MOD Set 6.1: A 68 HIS : no HD1:sc= 0.0961 K(o=0.51,f=-1.5) USER MOD Set 6.2: A 71 GLN : amide:sc= 0.411 K(o=0.51,f=-2.2) USER MOD Set 7.1: A 62 SER OG : rot 180:sc= -0.0411 USER MOD Set 7.2: A 94 HIS : no HE2:sc= 1.18 K(o=1.1,f=-5.1!) USER MOD Single : A 2 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 4 SER OG : rot 180:sc= -0.158 USER MOD Single : A 9 THR OG1 : rot 180:sc= 0 USER MOD Single : A 23 THR OG1 : rot 180:sc= 0 USER MOD Single : A 24 SER OG : rot 180:sc= -0.0557 USER MOD Single : A 26 LYS NZ :NH3+ -165:sc= -0.0176 (180deg=-0.271) USER MOD Single : A 67 SER OG : rot 180:sc= 0.0201 USER MOD Single : A 72 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 73 THR OG1 : rot 75:sc= 1.25 USER MOD Single : A 76 GLN : amide:sc= -0.995 K(o=-1,f=-5.6!) USER MOD Single : A 77 GLN : amide:sc= -4.46! C(o=-4.5!,f=-6.8!) USER MOD Single : A 79 MET CE :methyl 158:sc= -0.168 (180deg=-0.721) USER MOD Single : A 82 THR OG1 : rot 180:sc= 0 USER MOD Single : A 87 GLN : amide:sc= -0.681 K(o=-0.68,f=-4.9!) USER MOD Single : A 104 SER OG : rot 180:sc= 0 USER MOD Single : A 110 ASN : amide:sc= -1.37 K(o=-1.4,f=-0.22) USER MOD Single : A 111 GLN : amide:sc= 0.668 K(o=0.67,f=-0.65) USER MOD Single : A 115 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 116 MET CE :methyl 170:sc= -2.69! (180deg=-3.14) USER MOD Single : A 118 SER OG : rot 180:sc= 0 USER MOD Single : A 120 HIS : no HD1:sc= -0.132 X(o=-0.13,f=-0.0076) USER MOD Single : A 121 SER OG : rot 180:sc= -0.163 USER MOD Single : A 122 HIS : no HD1:sc= 0 X(o=0,f=-0.0092) USER MOD Single : A 136 THR OG1 : rot 180:sc= 0 USER MOD Single : A 137 GLN : amide:sc= -0.513 K(o=-0.51,f=-4.5!) USER MOD Single : A 141 SER OG : rot -39:sc= 0.456 USER MOD Single : A 144 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 147 GLN : amide:sc= 0 K(o=0,f=-0.64) USER MOD Single : A 148 SER OG : rot 180:sc= 0 USER MOD Single : A 151 SER OG : rot 180:sc= -0.0662 USER MOD Single : A 152 SER OG : rot 180:sc= 0.304 USER MOD Single : A 158 GLN : amide:sc= -0.257 X(o=-0.26,f=-0.13) USER MOD Single : A 159 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 160 GLN : amide:sc= -0.938 K(o=-0.94,f=0) USER MOD Single : A 161 SER OG : rot 180:sc= 0 USER MOD Single : A 162 SER OG : rot -19:sc= 0.789 USER MOD Single : A 163 SER OG : rot 43:sc= 0.0918 USER MOD Single : A 164 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 165 GLN : amide:sc= -0.748 K(o=-0.75,f=0) USER MOD Single : A 166 GLN : amide:sc= 0 X(o=0,f=-0.44) USER MOD Single : A 167 SER OG : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 21 N MET A 2 14.815 -86.085 11.031 1.00 34.12 N ATOM 22 CA MET A 2 14.125 -84.879 11.443 1.00 73.20 C ATOM 23 C MET A 2 14.155 -83.857 10.321 1.00 53.13 C ATOM 24 O MET A 2 14.915 -84.005 9.354 1.00 61.03 O ATOM 25 CB MET A 2 14.752 -84.299 12.710 1.00 74.33 C ATOM 26 CG MET A 2 14.518 -85.140 13.954 1.00 32.41 C ATOM 27 SD MET A 2 12.768 -85.285 14.373 1.00 74.43 S ATOM 28 CE MET A 2 12.862 -86.287 15.856 1.00 73.41 C ATOM 0 HA MET A 2 13.088 -85.131 11.665 1.00 73.20 H new ATOM 0 HB2 MET A 2 15.825 -84.189 12.555 1.00 74.33 H new ATOM 0 HB3 MET A 2 14.350 -83.300 12.878 1.00 74.33 H new ATOM 0 HG2 MET A 2 14.935 -86.135 13.799 1.00 32.41 H new ATOM 0 HG3 MET A 2 15.054 -84.697 14.794 1.00 32.41 H new ATOM 0 HE1 MET A 2 11.857 -86.466 16.239 1.00 73.41 H new ATOM 0 HE2 MET A 2 13.336 -87.240 15.622 1.00 73.41 H new ATOM 0 HE3 MET A 2 13.450 -85.765 16.611 1.00 73.41 H new ATOM 38 N ALA A 3 13.353 -82.819 10.454 1.00 50.43 N ATOM 39 CA ALA A 3 13.249 -81.793 9.432 1.00 35.32 C ATOM 40 C ALA A 3 12.489 -80.592 9.972 1.00 43.31 C ATOM 41 O ALA A 3 12.348 -80.436 11.187 1.00 60.31 O ATOM 42 CB ALA A 3 12.546 -82.357 8.197 1.00 1.55 C ATOM 0 H ALA A 3 12.758 -82.662 11.268 1.00 50.43 H new ATOM 0 HA ALA A 3 14.251 -81.471 9.148 1.00 35.32 H new ATOM 0 HB1 ALA A 3 12.472 -81.581 7.435 1.00 1.55 H new ATOM 0 HB2 ALA A 3 13.118 -83.198 7.805 1.00 1.55 H new ATOM 0 HB3 ALA A 3 11.546 -82.695 8.470 1.00 1.55 H new ATOM 48 N SER A 4 12.009 -79.746 9.079 1.00 71.00 N ATOM 49 CA SER A 4 11.274 -78.551 9.464 1.00 64.40 C ATOM 50 C SER A 4 10.361 -78.104 8.328 1.00 72.33 C ATOM 51 O SER A 4 9.934 -76.948 8.271 1.00 55.43 O ATOM 52 CB SER A 4 12.252 -77.425 9.820 1.00 42.04 C ATOM 53 OG SER A 4 13.117 -77.814 10.881 1.00 21.03 O ATOM 0 H SER A 4 12.116 -79.865 8.072 1.00 71.00 H new ATOM 0 HA SER A 4 10.663 -78.782 10.337 1.00 64.40 H new ATOM 0 HB2 SER A 4 12.843 -77.162 8.943 1.00 42.04 H new ATOM 0 HB3 SER A 4 11.695 -76.533 10.109 1.00 42.04 H new ATOM 0 HG SER A 4 13.732 -77.079 11.088 1.00 21.03 H new ATOM 59 N ASP A 5 10.042 -79.035 7.445 1.00 64.50 N ATOM 60 CA ASP A 5 9.179 -78.747 6.310 1.00 41.33 C ATOM 61 C ASP A 5 7.730 -78.699 6.762 1.00 1.05 C ATOM 62 O ASP A 5 6.976 -77.806 6.365 1.00 42.35 O ATOM 63 CB ASP A 5 9.369 -79.804 5.216 1.00 43.21 C ATOM 64 CG ASP A 5 8.381 -79.665 4.079 1.00 33.52 C ATOM 65 OD1 ASP A 5 8.595 -78.805 3.196 1.00 13.41 O ATOM 66 OD2 ASP A 5 7.392 -80.431 4.052 1.00 24.40 O ATOM 0 H ASP A 5 10.369 -80.000 7.492 1.00 64.50 H new ATOM 0 HA ASP A 5 9.448 -77.775 5.896 1.00 41.33 H new ATOM 0 HB2 ASP A 5 10.382 -79.731 4.820 1.00 43.21 H new ATOM 0 HB3 ASP A 5 9.270 -80.796 5.656 1.00 43.21 H new ATOM 71 N ASP A 6 7.368 -79.655 7.619 1.00 24.21 N ATOM 72 CA ASP A 6 6.027 -79.748 8.213 1.00 43.12 C ATOM 73 C ASP A 6 4.931 -79.897 7.162 1.00 1.12 C ATOM 74 O ASP A 6 4.507 -78.922 6.536 1.00 60.42 O ATOM 75 CB ASP A 6 5.741 -78.546 9.115 1.00 32.34 C ATOM 76 CG ASP A 6 4.364 -78.600 9.746 1.00 64.24 C ATOM 77 OD1 ASP A 6 4.194 -79.338 10.739 1.00 53.52 O ATOM 78 OD2 ASP A 6 3.456 -77.888 9.264 1.00 53.15 O ATOM 0 H ASP A 6 8.000 -80.394 7.925 1.00 24.21 H new ATOM 0 HA ASP A 6 6.018 -80.654 8.820 1.00 43.12 H new ATOM 0 HB2 ASP A 6 6.494 -78.500 9.901 1.00 32.34 H new ATOM 0 HB3 ASP A 6 5.833 -77.630 8.532 1.00 32.34 H new ATOM 83 N ARG A 7 4.478 -81.116 6.972 1.00 1.40 N ATOM 84 CA ARG A 7 3.425 -81.394 6.028 1.00 54.40 C ATOM 85 C ARG A 7 2.108 -81.545 6.777 1.00 35.00 C ATOM 86 O ARG A 7 1.855 -82.576 7.407 1.00 72.23 O ATOM 87 CB ARG A 7 3.742 -82.667 5.223 1.00 21.02 C ATOM 88 CG ARG A 7 3.072 -82.743 3.844 1.00 2.42 C ATOM 89 CD ARG A 7 1.552 -82.841 3.932 1.00 14.23 C ATOM 90 NE ARG A 7 1.117 -84.035 4.653 1.00 61.34 N ATOM 91 CZ ARG A 7 -0.111 -84.216 5.142 1.00 71.11 C ATOM 92 NH1 ARG A 7 -1.054 -83.296 4.946 1.00 60.33 N ATOM 93 NH2 ARG A 7 -0.397 -85.323 5.814 1.00 64.51 N ATOM 0 H ARG A 7 4.828 -81.937 7.466 1.00 1.40 H new ATOM 0 HA ARG A 7 3.344 -80.566 5.324 1.00 54.40 H new ATOM 0 HB2 ARG A 7 4.822 -82.736 5.091 1.00 21.02 H new ATOM 0 HB3 ARG A 7 3.436 -83.535 5.808 1.00 21.02 H new ATOM 0 HG2 ARG A 7 3.342 -81.860 3.264 1.00 2.42 H new ATOM 0 HG3 ARG A 7 3.457 -83.608 3.305 1.00 2.42 H new ATOM 0 HD2 ARG A 7 1.161 -81.954 4.431 1.00 14.23 H new ATOM 0 HD3 ARG A 7 1.131 -82.852 2.926 1.00 14.23 H new ATOM 0 HE ARG A 7 1.799 -84.781 4.792 1.00 61.34 H new ATOM 0 HH11 ARG A 7 -0.839 -82.449 4.420 1.00 60.33 H new ATOM 0 HH12 ARG A 7 -1.992 -83.439 5.322 1.00 60.33 H new ATOM 0 HH21 ARG A 7 0.321 -86.033 5.956 1.00 64.51 H new ATOM 0 HH22 ARG A 7 -1.335 -85.464 6.189 1.00 64.51 H new ATOM 107 N ALA A 8 1.286 -80.519 6.708 1.00 64.34 N ATOM 108 CA ALA A 8 0.000 -80.510 7.378 1.00 31.54 C ATOM 109 C ALA A 8 -0.894 -79.448 6.769 1.00 31.21 C ATOM 110 O ALA A 8 -0.497 -78.286 6.634 1.00 12.20 O ATOM 111 CB ALA A 8 0.177 -80.257 8.871 1.00 42.13 C ATOM 0 H ALA A 8 1.489 -79.667 6.186 1.00 64.34 H new ATOM 0 HA ALA A 8 -0.468 -81.485 7.247 1.00 31.54 H new ATOM 0 HB1 ALA A 8 -0.798 -80.254 9.358 1.00 42.13 H new ATOM 0 HB2 ALA A 8 0.795 -81.044 9.303 1.00 42.13 H new ATOM 0 HB3 ALA A 8 0.661 -79.292 9.022 1.00 42.13 H new ATOM 117 N THR A 9 -2.083 -79.846 6.386 1.00 61.30 N ATOM 118 CA THR A 9 -3.028 -78.949 5.769 1.00 73.22 C ATOM 119 C THR A 9 -3.927 -78.304 6.821 1.00 3.24 C ATOM 120 O THR A 9 -4.625 -78.997 7.562 1.00 74.11 O ATOM 121 CB THR A 9 -3.896 -79.699 4.745 1.00 74.34 C ATOM 122 OG1 THR A 9 -3.058 -80.520 3.920 1.00 21.02 O ATOM 123 CG2 THR A 9 -4.656 -78.722 3.866 1.00 2.44 C ATOM 0 H THR A 9 -2.422 -80.802 6.494 1.00 61.30 H new ATOM 0 HA THR A 9 -2.463 -78.169 5.257 1.00 73.22 H new ATOM 0 HB THR A 9 -4.613 -80.317 5.285 1.00 74.34 H new ATOM 0 HG1 THR A 9 -3.610 -81.000 3.268 1.00 21.02 H new ATOM 0 HG21 THR A 9 -5.263 -79.274 3.149 1.00 2.44 H new ATOM 0 HG22 THR A 9 -5.302 -78.101 4.487 1.00 2.44 H new ATOM 0 HG23 THR A 9 -3.949 -78.088 3.330 1.00 2.44 H new ATOM 131 N GLY A 10 -3.897 -76.989 6.884 1.00 72.34 N ATOM 132 CA GLY A 10 -4.714 -76.272 7.834 1.00 34.41 C ATOM 133 C GLY A 10 -4.810 -74.806 7.489 1.00 2.42 C ATOM 134 O GLY A 10 -4.151 -73.976 8.115 1.00 41.21 O ATOM 0 H GLY A 10 -3.316 -76.398 6.289 1.00 72.34 H new ATOM 0 HA2 GLY A 10 -5.713 -76.707 7.857 1.00 34.41 H new ATOM 0 HA3 GLY A 10 -4.294 -76.384 8.834 1.00 34.41 H new ATOM 138 N PRO A 11 -5.614 -74.452 6.481 1.00 54.33 N ATOM 139 CA PRO A 11 -5.763 -73.075 6.042 1.00 54.15 C ATOM 140 C PRO A 11 -6.781 -72.301 6.870 1.00 40.23 C ATOM 141 O PRO A 11 -7.832 -72.829 7.251 1.00 62.34 O ATOM 142 CB PRO A 11 -6.253 -73.230 4.607 1.00 42.14 C ATOM 143 CG PRO A 11 -7.055 -74.490 4.619 1.00 41.51 C ATOM 144 CD PRO A 11 -6.450 -75.377 5.684 1.00 22.22 C ATOM 0 HA PRO A 11 -4.836 -72.510 6.142 1.00 54.15 H new ATOM 0 HB2 PRO A 11 -6.858 -72.377 4.300 1.00 42.14 H new ATOM 0 HB3 PRO A 11 -5.419 -73.297 3.908 1.00 42.14 H new ATOM 0 HG2 PRO A 11 -8.102 -74.281 4.838 1.00 41.51 H new ATOM 0 HG3 PRO A 11 -7.024 -74.978 3.645 1.00 41.51 H new ATOM 0 HD2 PRO A 11 -7.219 -75.849 6.296 1.00 22.22 H new ATOM 0 HD3 PRO A 11 -5.854 -76.178 5.246 1.00 22.22 H new ATOM 209 N LEU A 16 -16.081 -63.894 4.995 1.00 31.15 N ATOM 210 CA LEU A 16 -16.115 -62.784 4.066 1.00 1.33 C ATOM 211 C LEU A 16 -17.367 -61.943 4.267 1.00 14.31 C ATOM 212 O LEU A 16 -18.483 -62.472 4.344 1.00 11.44 O ATOM 213 CB LEU A 16 -16.053 -63.290 2.621 1.00 61.14 C ATOM 214 CG LEU A 16 -16.065 -62.208 1.535 1.00 63.11 C ATOM 215 CD1 LEU A 16 -14.817 -61.343 1.619 1.00 10.50 C ATOM 216 CD2 LEU A 16 -16.188 -62.837 0.160 1.00 30.15 C ATOM 0 HA LEU A 16 -15.243 -62.159 4.260 1.00 1.33 H new ATOM 0 HB2 LEU A 16 -15.148 -63.887 2.503 1.00 61.14 H new ATOM 0 HB3 LEU A 16 -16.899 -63.957 2.453 1.00 61.14 H new ATOM 0 HG LEU A 16 -16.932 -61.568 1.701 1.00 63.11 H new ATOM 0 HD11 LEU A 16 -14.848 -60.583 0.839 1.00 10.50 H new ATOM 0 HD12 LEU A 16 -14.774 -60.860 2.595 1.00 10.50 H new ATOM 0 HD13 LEU A 16 -13.933 -61.966 1.484 1.00 10.50 H new ATOM 0 HD21 LEU A 16 -16.195 -62.054 -0.599 1.00 30.15 H new ATOM 0 HD22 LEU A 16 -15.342 -63.502 -0.013 1.00 30.15 H new ATOM 0 HD23 LEU A 16 -17.115 -63.407 0.102 1.00 30.15 H new ATOM 228 N VAL A 17 -17.180 -60.648 4.352 1.00 11.03 N ATOM 229 CA VAL A 17 -18.273 -59.720 4.512 1.00 1.50 C ATOM 230 C VAL A 17 -17.959 -58.420 3.775 1.00 34.41 C ATOM 231 O VAL A 17 -16.879 -57.841 3.937 1.00 54.12 O ATOM 232 CB VAL A 17 -18.579 -59.437 6.016 1.00 51.42 C ATOM 233 CG1 VAL A 17 -17.351 -58.912 6.749 1.00 24.13 C ATOM 234 CG2 VAL A 17 -19.747 -58.473 6.161 1.00 11.02 C ATOM 0 H VAL A 17 -16.261 -60.206 4.312 1.00 11.03 H new ATOM 0 HA VAL A 17 -19.166 -60.173 4.081 1.00 1.50 H new ATOM 0 HB VAL A 17 -18.858 -60.385 6.477 1.00 51.42 H new ATOM 0 HG11 VAL A 17 -17.602 -58.726 7.793 1.00 24.13 H new ATOM 0 HG12 VAL A 17 -16.551 -59.650 6.694 1.00 24.13 H new ATOM 0 HG13 VAL A 17 -17.020 -57.983 6.285 1.00 24.13 H new ATOM 0 HG21 VAL A 17 -19.940 -58.292 7.218 1.00 11.02 H new ATOM 0 HG22 VAL A 17 -19.504 -57.531 5.670 1.00 11.02 H new ATOM 0 HG23 VAL A 17 -20.635 -58.905 5.699 1.00 11.02 H new ATOM 244 N VAL A 18 -18.886 -57.975 2.952 1.00 71.22 N ATOM 245 CA VAL A 18 -18.687 -56.774 2.167 1.00 31.04 C ATOM 246 C VAL A 18 -20.009 -56.038 1.945 1.00 14.12 C ATOM 247 O VAL A 18 -20.993 -56.616 1.466 1.00 45.00 O ATOM 248 CB VAL A 18 -17.999 -57.095 0.801 1.00 65.24 C ATOM 249 CG1 VAL A 18 -18.747 -58.183 0.043 1.00 63.25 C ATOM 250 CG2 VAL A 18 -17.859 -55.840 -0.052 1.00 72.45 C ATOM 0 H VAL A 18 -19.788 -58.429 2.809 1.00 71.22 H new ATOM 0 HA VAL A 18 -18.023 -56.120 2.732 1.00 31.04 H new ATOM 0 HB VAL A 18 -16.999 -57.469 1.020 1.00 65.24 H new ATOM 0 HG11 VAL A 18 -18.241 -58.381 -0.902 1.00 63.25 H new ATOM 0 HG12 VAL A 18 -18.769 -59.094 0.641 1.00 63.25 H new ATOM 0 HG13 VAL A 18 -19.767 -57.854 -0.153 1.00 63.25 H new ATOM 0 HG21 VAL A 18 -17.377 -56.094 -0.996 1.00 72.45 H new ATOM 0 HG22 VAL A 18 -18.846 -55.422 -0.249 1.00 72.45 H new ATOM 0 HG23 VAL A 18 -17.253 -55.105 0.478 1.00 72.45 H new ATOM 260 N ALA A 19 -20.029 -54.771 2.327 1.00 2.55 N ATOM 261 CA ALA A 19 -21.210 -53.936 2.182 1.00 4.33 C ATOM 262 C ALA A 19 -21.455 -53.573 0.720 1.00 71.11 C ATOM 263 O ALA A 19 -20.667 -53.931 -0.160 1.00 72.42 O ATOM 264 CB ALA A 19 -21.072 -52.679 3.032 1.00 54.22 C ATOM 0 H ALA A 19 -19.230 -54.294 2.745 1.00 2.55 H new ATOM 0 HA ALA A 19 -22.073 -54.503 2.531 1.00 4.33 H new ATOM 0 HB1 ALA A 19 -21.962 -52.061 2.915 1.00 54.22 H new ATOM 0 HB2 ALA A 19 -20.959 -52.959 4.079 1.00 54.22 H new ATOM 0 HB3 ALA A 19 -20.196 -52.117 2.710 1.00 54.22 H new ATOM 270 N ALA A 20 -22.526 -52.842 0.474 1.00 52.53 N ATOM 271 CA ALA A 20 -22.895 -52.437 -0.868 1.00 54.11 C ATOM 272 C ALA A 20 -23.880 -51.285 -0.817 1.00 42.11 C ATOM 273 O ALA A 20 -25.043 -51.464 -0.438 1.00 13.30 O ATOM 274 CB ALA A 20 -23.503 -53.609 -1.629 1.00 72.52 C ATOM 0 H ALA A 20 -23.164 -52.513 1.199 1.00 52.53 H new ATOM 0 HA ALA A 20 -21.995 -52.110 -1.389 1.00 54.11 H new ATOM 0 HB1 ALA A 20 -23.775 -53.288 -2.635 1.00 72.52 H new ATOM 0 HB2 ALA A 20 -22.776 -54.419 -1.690 1.00 72.52 H new ATOM 0 HB3 ALA A 20 -24.394 -53.959 -1.107 1.00 72.52 H new ATOM 280 N ALA A 21 -23.411 -50.105 -1.191 1.00 41.24 N ATOM 281 CA ALA A 21 -24.228 -48.905 -1.172 1.00 62.31 C ATOM 282 C ALA A 21 -23.529 -47.778 -1.914 1.00 43.22 C ATOM 283 O ALA A 21 -22.431 -47.962 -2.440 1.00 21.14 O ATOM 284 CB ALA A 21 -24.518 -48.485 0.265 1.00 12.11 C ATOM 0 H ALA A 21 -22.456 -49.954 -1.515 1.00 41.24 H new ATOM 0 HA ALA A 21 -25.172 -49.121 -1.672 1.00 62.31 H new ATOM 0 HB1 ALA A 21 -25.131 -47.584 0.264 1.00 12.11 H new ATOM 0 HB2 ALA A 21 -25.051 -49.286 0.778 1.00 12.11 H new ATOM 0 HB3 ALA A 21 -23.580 -48.284 0.782 1.00 12.11 H new ATOM 290 N ALA A 22 -24.163 -46.618 -1.943 1.00 43.22 N ATOM 291 CA ALA A 22 -23.616 -45.446 -2.608 1.00 40.45 C ATOM 292 C ALA A 22 -24.329 -44.207 -2.124 1.00 61.33 C ATOM 293 O ALA A 22 -25.558 -44.189 -2.027 1.00 31.51 O ATOM 294 CB ALA A 22 -23.748 -45.576 -4.122 1.00 44.43 C ATOM 0 H ALA A 22 -25.071 -46.461 -1.506 1.00 43.22 H new ATOM 0 HA ALA A 22 -22.556 -45.367 -2.365 1.00 40.45 H new ATOM 0 HB1 ALA A 22 -23.333 -44.689 -4.601 1.00 44.43 H new ATOM 0 HB2 ALA A 22 -23.205 -46.459 -4.460 1.00 44.43 H new ATOM 0 HB3 ALA A 22 -24.800 -45.673 -4.388 1.00 44.43 H new ATOM 300 N THR A 23 -23.566 -43.183 -1.816 1.00 23.32 N ATOM 301 CA THR A 23 -24.119 -41.956 -1.304 1.00 30.11 C ATOM 302 C THR A 23 -24.649 -41.080 -2.435 1.00 2.12 C ATOM 303 O THR A 23 -23.878 -40.437 -3.156 1.00 25.23 O ATOM 304 CB THR A 23 -23.066 -41.173 -0.501 1.00 2.35 C ATOM 305 OG1 THR A 23 -22.382 -42.065 0.393 1.00 74.30 O ATOM 306 CG2 THR A 23 -23.722 -40.070 0.305 1.00 43.45 C ATOM 0 H THR A 23 -22.551 -43.179 -1.914 1.00 23.32 H new ATOM 0 HA THR A 23 -24.946 -42.221 -0.645 1.00 30.11 H new ATOM 0 HB THR A 23 -22.357 -40.728 -1.200 1.00 2.35 H new ATOM 0 HG1 THR A 23 -21.710 -41.566 0.903 1.00 74.30 H new ATOM 0 HG21 THR A 23 -22.961 -39.528 0.866 1.00 43.45 H new ATOM 0 HG22 THR A 23 -24.235 -39.383 -0.368 1.00 43.45 H new ATOM 0 HG23 THR A 23 -24.443 -40.505 0.998 1.00 43.45 H new ATOM 314 N SER A 24 -25.956 -41.086 -2.607 1.00 40.31 N ATOM 315 CA SER A 24 -26.590 -40.272 -3.620 1.00 14.22 C ATOM 316 C SER A 24 -26.614 -38.809 -3.178 1.00 33.22 C ATOM 317 O SER A 24 -26.344 -38.499 -2.010 1.00 31.12 O ATOM 318 CB SER A 24 -28.011 -40.773 -3.894 1.00 74.13 C ATOM 319 OG SER A 24 -28.600 -40.095 -4.995 1.00 72.12 O ATOM 0 H SER A 24 -26.601 -41.650 -2.054 1.00 40.31 H new ATOM 0 HA SER A 24 -26.015 -40.348 -4.543 1.00 14.22 H new ATOM 0 HB2 SER A 24 -27.988 -41.844 -4.095 1.00 74.13 H new ATOM 0 HB3 SER A 24 -28.626 -40.629 -3.006 1.00 74.13 H new ATOM 0 HG SER A 24 -29.505 -40.439 -5.145 1.00 72.12 H new ATOM 325 N ALA A 25 -26.945 -37.921 -4.098 1.00 34.13 N ATOM 326 CA ALA A 25 -27.005 -36.502 -3.808 1.00 21.53 C ATOM 327 C ALA A 25 -27.701 -35.756 -4.931 1.00 2.14 C ATOM 328 O ALA A 25 -27.131 -35.564 -6.005 1.00 61.43 O ATOM 329 CB ALA A 25 -25.602 -35.940 -3.605 1.00 2.54 C ATOM 0 H ALA A 25 -27.178 -38.162 -5.061 1.00 34.13 H new ATOM 0 HA ALA A 25 -27.577 -36.367 -2.890 1.00 21.53 H new ATOM 0 HB1 ALA A 25 -25.665 -34.874 -3.388 1.00 2.54 H new ATOM 0 HB2 ALA A 25 -25.122 -36.452 -2.771 1.00 2.54 H new ATOM 0 HB3 ALA A 25 -25.015 -36.092 -4.511 1.00 2.54 H new ATOM 335 N LYS A 26 -28.939 -35.354 -4.698 1.00 23.13 N ATOM 336 CA LYS A 26 -29.676 -34.588 -5.688 1.00 53.44 C ATOM 337 C LYS A 26 -29.248 -33.133 -5.652 1.00 51.40 C ATOM 338 O LYS A 26 -29.953 -32.273 -5.124 1.00 4.53 O ATOM 339 CB LYS A 26 -31.191 -34.708 -5.493 1.00 10.21 C ATOM 340 CG LYS A 26 -31.756 -36.066 -5.868 1.00 22.25 C ATOM 341 CD LYS A 26 -33.273 -36.084 -5.759 1.00 35.53 C ATOM 342 CE LYS A 26 -33.847 -37.425 -6.196 1.00 12.02 C ATOM 343 NZ LYS A 26 -33.545 -37.728 -7.619 1.00 32.41 N ATOM 0 H LYS A 26 -29.452 -35.544 -3.837 1.00 23.13 H new ATOM 0 HA LYS A 26 -29.441 -35.004 -6.668 1.00 53.44 H new ATOM 0 HB2 LYS A 26 -31.430 -34.502 -4.450 1.00 10.21 H new ATOM 0 HB3 LYS A 26 -31.686 -33.942 -6.091 1.00 10.21 H new ATOM 0 HG2 LYS A 26 -31.460 -36.317 -6.887 1.00 22.25 H new ATOM 0 HG3 LYS A 26 -31.334 -36.830 -5.216 1.00 22.25 H new ATOM 0 HD2 LYS A 26 -33.568 -35.879 -4.730 1.00 35.53 H new ATOM 0 HD3 LYS A 26 -33.693 -35.289 -6.375 1.00 35.53 H new ATOM 0 HE2 LYS A 26 -33.441 -38.215 -5.564 1.00 12.02 H new ATOM 0 HE3 LYS A 26 -34.927 -37.421 -6.048 1.00 12.02 H new ATOM 0 HZ1 LYS A 26 -34.154 -38.506 -7.945 1.00 32.41 H new ATOM 0 HZ2 LYS A 26 -33.722 -36.883 -8.199 1.00 32.41 H new ATOM 0 HZ3 LYS A 26 -32.547 -38.008 -7.710 1.00 32.41 H new ATOM 357 N VAL A 27 -28.063 -32.883 -6.159 1.00 40.21 N ATOM 358 CA VAL A 27 -27.508 -31.553 -6.233 1.00 61.33 C ATOM 359 C VAL A 27 -26.460 -31.488 -7.345 1.00 54.12 C ATOM 360 O VAL A 27 -25.280 -31.795 -7.140 1.00 15.52 O ATOM 361 CB VAL A 27 -26.918 -31.083 -4.859 1.00 40.05 C ATOM 362 CG1 VAL A 27 -25.936 -32.102 -4.287 1.00 32.41 C ATOM 363 CG2 VAL A 27 -26.266 -29.709 -4.985 1.00 51.31 C ATOM 0 H VAL A 27 -27.451 -33.607 -6.536 1.00 40.21 H new ATOM 0 HA VAL A 27 -28.316 -30.862 -6.473 1.00 61.33 H new ATOM 0 HB VAL A 27 -27.750 -31.003 -4.159 1.00 40.05 H new ATOM 0 HG11 VAL A 27 -25.549 -31.740 -3.335 1.00 32.41 H new ATOM 0 HG12 VAL A 27 -26.447 -33.053 -4.133 1.00 32.41 H new ATOM 0 HG13 VAL A 27 -25.110 -32.242 -4.984 1.00 32.41 H new ATOM 0 HG21 VAL A 27 -25.865 -29.407 -4.018 1.00 51.31 H new ATOM 0 HG22 VAL A 27 -25.458 -29.755 -5.715 1.00 51.31 H new ATOM 0 HG23 VAL A 27 -27.009 -28.982 -5.313 1.00 51.31 H new ATOM 799 N VAL A 60 12.396 9.734 -2.067 1.00 34.32 N ATOM 800 CA VAL A 60 11.003 9.863 -1.684 1.00 62.11 C ATOM 801 C VAL A 60 10.171 10.377 -2.854 1.00 30.22 C ATOM 802 O VAL A 60 10.685 10.559 -3.960 1.00 61.02 O ATOM 803 CB VAL A 60 10.833 10.804 -0.467 1.00 74.02 C ATOM 804 CG1 VAL A 60 11.505 10.212 0.759 1.00 3.42 C ATOM 805 CG2 VAL A 60 11.393 12.190 -0.767 1.00 62.33 C ATOM 0 HA VAL A 60 10.650 8.872 -1.400 1.00 62.11 H new ATOM 0 HB VAL A 60 9.767 10.907 -0.264 1.00 74.02 H new ATOM 0 HG11 VAL A 60 11.376 10.886 1.606 1.00 3.42 H new ATOM 0 HG12 VAL A 60 11.054 9.247 0.991 1.00 3.42 H new ATOM 0 HG13 VAL A 60 12.568 10.077 0.561 1.00 3.42 H new ATOM 0 HG21 VAL A 60 11.261 12.832 0.104 1.00 62.33 H new ATOM 0 HG22 VAL A 60 12.454 12.111 -1.002 1.00 62.33 H new ATOM 0 HG23 VAL A 60 10.864 12.620 -1.618 1.00 62.33 H new ATOM 815 N LEU A 61 8.900 10.623 -2.612 1.00 13.10 N ATOM 816 CA LEU A 61 8.010 11.076 -3.661 1.00 4.43 C ATOM 817 C LEU A 61 8.047 12.590 -3.774 1.00 25.34 C ATOM 818 O LEU A 61 7.371 13.300 -3.026 1.00 51.14 O ATOM 819 CB LEU A 61 6.579 10.600 -3.389 1.00 74.23 C ATOM 820 CG LEU A 61 5.518 11.015 -4.413 1.00 23.12 C ATOM 821 CD1 LEU A 61 5.805 10.399 -5.773 1.00 14.01 C ATOM 822 CD2 LEU A 61 4.133 10.620 -3.928 1.00 12.15 C ATOM 0 H LEU A 61 8.460 10.517 -1.698 1.00 13.10 H new ATOM 0 HA LEU A 61 8.347 10.649 -4.606 1.00 4.43 H new ATOM 0 HB2 LEU A 61 6.587 9.512 -3.327 1.00 74.23 H new ATOM 0 HB3 LEU A 61 6.275 10.973 -2.411 1.00 74.23 H new ATOM 0 HG LEU A 61 5.553 12.099 -4.521 1.00 23.12 H new ATOM 0 HD11 LEU A 61 5.037 10.709 -6.482 1.00 14.01 H new ATOM 0 HD12 LEU A 61 6.781 10.733 -6.125 1.00 14.01 H new ATOM 0 HD13 LEU A 61 5.803 9.312 -5.688 1.00 14.01 H new ATOM 0 HD21 LEU A 61 3.389 10.921 -4.666 1.00 12.15 H new ATOM 0 HD22 LEU A 61 4.090 9.540 -3.790 1.00 12.15 H new ATOM 0 HD23 LEU A 61 3.925 11.115 -2.980 1.00 12.15 H new ATOM 834 N SER A 62 8.856 13.078 -4.691 1.00 41.23 N ATOM 835 CA SER A 62 8.977 14.501 -4.920 1.00 62.22 C ATOM 836 C SER A 62 8.909 14.799 -6.403 1.00 42.51 C ATOM 837 O SER A 62 9.927 15.012 -7.063 1.00 13.42 O ATOM 838 CB SER A 62 10.270 15.039 -4.311 1.00 23.34 C ATOM 839 OG SER A 62 10.360 14.699 -2.935 1.00 41.33 O ATOM 0 H SER A 62 9.444 12.503 -5.294 1.00 41.23 H new ATOM 0 HA SER A 62 8.144 15.005 -4.430 1.00 62.22 H new ATOM 0 HB2 SER A 62 11.127 14.632 -4.848 1.00 23.34 H new ATOM 0 HB3 SER A 62 10.308 16.122 -4.426 1.00 23.34 H new ATOM 0 HG SER A 62 11.196 15.052 -2.565 1.00 41.33 H new ATOM 845 N ALA A 63 7.709 14.762 -6.923 1.00 55.13 N ATOM 846 CA ALA A 63 7.467 15.010 -8.317 1.00 43.15 C ATOM 847 C ALA A 63 6.258 15.916 -8.461 1.00 60.43 C ATOM 848 O ALA A 63 5.451 16.006 -7.531 1.00 51.52 O ATOM 849 CB ALA A 63 7.233 13.687 -9.033 1.00 62.51 C ATOM 0 H ALA A 63 6.867 14.557 -6.385 1.00 55.13 H new ATOM 0 HA ALA A 63 8.331 15.501 -8.765 1.00 43.15 H new ATOM 0 HB1 ALA A 63 7.049 13.873 -10.091 1.00 62.51 H new ATOM 0 HB2 ALA A 63 8.113 13.054 -8.924 1.00 62.51 H new ATOM 0 HB3 ALA A 63 6.369 13.185 -8.597 1.00 62.51 H new ATOM 855 N PRO A 64 6.124 16.625 -9.604 1.00 13.23 N ATOM 856 CA PRO A 64 4.965 17.484 -9.866 1.00 31.02 C ATOM 857 C PRO A 64 3.659 16.716 -9.667 1.00 53.23 C ATOM 858 O PRO A 64 3.368 15.772 -10.399 1.00 13.35 O ATOM 859 CB PRO A 64 5.134 17.894 -11.344 1.00 25.43 C ATOM 860 CG PRO A 64 6.213 17.009 -11.882 1.00 72.21 C ATOM 861 CD PRO A 64 7.081 16.658 -10.714 1.00 1.24 C ATOM 0 HA PRO A 64 4.918 18.339 -9.192 1.00 31.02 H new ATOM 0 HB2 PRO A 64 4.204 17.761 -11.897 1.00 25.43 H new ATOM 0 HB3 PRO A 64 5.409 18.945 -11.431 1.00 25.43 H new ATOM 0 HG2 PRO A 64 5.791 16.113 -12.338 1.00 72.21 H new ATOM 0 HG3 PRO A 64 6.787 17.520 -12.655 1.00 72.21 H new ATOM 0 HD2 PRO A 64 7.576 15.697 -10.851 1.00 1.24 H new ATOM 0 HD3 PRO A 64 7.863 17.400 -10.553 1.00 1.24 H new ATOM 869 N LEU A 65 2.883 17.129 -8.681 1.00 70.54 N ATOM 870 CA LEU A 65 1.658 16.432 -8.332 1.00 72.43 C ATOM 871 C LEU A 65 0.606 16.552 -9.428 1.00 22.35 C ATOM 872 O LEU A 65 0.386 17.625 -9.990 1.00 62.34 O ATOM 873 CB LEU A 65 1.128 16.918 -6.966 1.00 24.50 C ATOM 874 CG LEU A 65 1.105 18.442 -6.729 1.00 22.12 C ATOM 875 CD1 LEU A 65 -0.114 19.087 -7.364 1.00 64.42 C ATOM 876 CD2 LEU A 65 1.158 18.750 -5.245 1.00 44.20 C ATOM 0 H LEU A 65 3.081 17.948 -8.105 1.00 70.54 H new ATOM 0 HA LEU A 65 1.889 15.371 -8.241 1.00 72.43 H new ATOM 0 HB2 LEU A 65 0.113 16.540 -6.842 1.00 24.50 H new ATOM 0 HB3 LEU A 65 1.736 16.462 -6.184 1.00 24.50 H new ATOM 0 HG LEU A 65 1.989 18.865 -7.206 1.00 22.12 H new ATOM 0 HD11 LEU A 65 -0.097 20.161 -7.177 1.00 64.42 H new ATOM 0 HD12 LEU A 65 -0.103 18.906 -8.439 1.00 64.42 H new ATOM 0 HD13 LEU A 65 -1.019 18.658 -6.933 1.00 64.42 H new ATOM 0 HD21 LEU A 65 1.141 19.830 -5.097 1.00 44.20 H new ATOM 0 HD22 LEU A 65 0.297 18.302 -4.749 1.00 44.20 H new ATOM 0 HD23 LEU A 65 2.075 18.340 -4.821 1.00 44.20 H new ATOM 888 N GLY A 66 -0.011 15.429 -9.751 1.00 43.54 N ATOM 889 CA GLY A 66 -1.000 15.394 -10.805 1.00 51.33 C ATOM 890 C GLY A 66 -0.398 14.911 -12.106 1.00 61.05 C ATOM 891 O GLY A 66 -1.057 14.232 -12.895 1.00 23.33 O ATOM 0 H GLY A 66 0.158 14.531 -9.297 1.00 43.54 H new ATOM 0 HA2 GLY A 66 -1.821 14.738 -10.515 1.00 51.33 H new ATOM 0 HA3 GLY A 66 -1.422 16.389 -10.944 1.00 51.33 H new ATOM 895 N SER A 67 0.858 15.275 -12.327 1.00 64.12 N ATOM 896 CA SER A 67 1.595 14.876 -13.512 1.00 62.11 C ATOM 897 C SER A 67 1.729 13.354 -13.589 1.00 12.14 C ATOM 898 O SER A 67 1.665 12.654 -12.566 1.00 72.21 O ATOM 899 CB SER A 67 2.986 15.529 -13.508 1.00 60.23 C ATOM 900 OG SER A 67 3.761 15.112 -14.621 1.00 64.50 O ATOM 0 H SER A 67 1.394 15.858 -11.684 1.00 64.12 H new ATOM 0 HA SER A 67 1.042 15.213 -14.389 1.00 62.11 H new ATOM 0 HB2 SER A 67 2.880 16.614 -13.524 1.00 60.23 H new ATOM 0 HB3 SER A 67 3.506 15.273 -12.585 1.00 60.23 H new ATOM 0 HG SER A 67 4.639 15.547 -14.590 1.00 64.50 H new ATOM 906 N HIS A 68 1.930 12.846 -14.800 1.00 45.35 N ATOM 907 CA HIS A 68 2.114 11.420 -15.007 1.00 75.13 C ATOM 908 C HIS A 68 3.423 10.977 -14.357 1.00 74.45 C ATOM 909 O HIS A 68 3.564 9.828 -13.942 1.00 34.24 O ATOM 910 CB HIS A 68 2.120 11.097 -16.507 1.00 23.22 C ATOM 911 CG HIS A 68 2.100 9.628 -16.826 1.00 53.20 C ATOM 912 ND1 HIS A 68 2.779 9.082 -17.891 1.00 44.35 N ATOM 913 CD2 HIS A 68 1.459 8.599 -16.227 1.00 54.22 C ATOM 914 CE1 HIS A 68 2.558 7.785 -17.935 1.00 50.33 C ATOM 915 NE2 HIS A 68 1.761 7.465 -16.936 1.00 45.41 N ATOM 0 H HIS A 68 1.969 13.404 -15.653 1.00 45.35 H new ATOM 0 HA HIS A 68 1.288 10.879 -14.546 1.00 75.13 H new ATOM 0 HB2 HIS A 68 1.254 11.569 -16.971 1.00 23.22 H new ATOM 0 HB3 HIS A 68 3.006 11.542 -16.959 1.00 23.22 H new ATOM 0 HD2 HIS A 68 0.827 8.659 -15.353 1.00 54.22 H new ATOM 0 HE1 HIS A 68 2.961 7.100 -18.666 1.00 50.33 H new ATOM 0 HE2 HIS A 68 1.423 6.526 -16.724 1.00 45.41 H new ATOM 924 N GLU A 69 4.370 11.912 -14.267 1.00 55.34 N ATOM 925 CA GLU A 69 5.656 11.663 -13.623 1.00 62.21 C ATOM 926 C GLU A 69 5.442 11.269 -12.164 1.00 10.42 C ATOM 927 O GLU A 69 6.066 10.334 -11.655 1.00 63.14 O ATOM 928 CB GLU A 69 6.533 12.915 -13.699 1.00 3.31 C ATOM 929 CG GLU A 69 7.932 12.729 -13.131 1.00 34.14 C ATOM 930 CD GLU A 69 8.741 14.005 -13.147 1.00 33.13 C ATOM 931 OE1 GLU A 69 8.840 14.637 -14.217 1.00 24.54 O ATOM 932 OE2 GLU A 69 9.302 14.378 -12.092 1.00 5.30 O ATOM 0 H GLU A 69 4.266 12.857 -14.637 1.00 55.34 H new ATOM 0 HA GLU A 69 6.157 10.846 -14.143 1.00 62.21 H new ATOM 0 HB2 GLU A 69 6.614 13.226 -14.740 1.00 3.31 H new ATOM 0 HB3 GLU A 69 6.039 13.725 -13.162 1.00 3.31 H new ATOM 0 HG2 GLU A 69 7.858 12.363 -12.107 1.00 34.14 H new ATOM 0 HG3 GLU A 69 8.455 11.965 -13.706 1.00 34.14 H new ATOM 939 N TRP A 70 4.532 11.971 -11.508 1.00 71.33 N ATOM 940 CA TRP A 70 4.204 11.720 -10.116 1.00 23.44 C ATOM 941 C TRP A 70 3.485 10.387 -9.983 1.00 51.53 C ATOM 942 O TRP A 70 3.769 9.608 -9.074 1.00 35.12 O ATOM 943 CB TRP A 70 3.310 12.865 -9.622 1.00 2.54 C ATOM 944 CG TRP A 70 2.898 12.796 -8.187 1.00 5.44 C ATOM 945 CD1 TRP A 70 3.641 13.148 -7.100 1.00 62.10 C ATOM 946 CD2 TRP A 70 1.623 12.378 -7.684 1.00 63.22 C ATOM 947 NE1 TRP A 70 2.910 12.969 -5.953 1.00 3.45 N ATOM 948 CE2 TRP A 70 1.670 12.495 -6.285 1.00 54.13 C ATOM 949 CE3 TRP A 70 0.449 11.911 -8.284 1.00 25.15 C ATOM 950 CZ2 TRP A 70 0.589 12.167 -5.474 1.00 12.21 C ATOM 951 CZ3 TRP A 70 -0.623 11.586 -7.477 1.00 22.01 C ATOM 952 CH2 TRP A 70 -0.545 11.716 -6.086 1.00 73.00 C ATOM 0 H TRP A 70 3.999 12.733 -11.928 1.00 71.33 H new ATOM 0 HA TRP A 70 5.112 11.674 -9.515 1.00 23.44 H new ATOM 0 HB2 TRP A 70 3.835 13.806 -9.785 1.00 2.54 H new ATOM 0 HB3 TRP A 70 2.411 12.890 -10.238 1.00 2.54 H new ATOM 0 HD1 TRP A 70 4.656 13.514 -7.136 1.00 62.10 H new ATOM 0 HE1 TRP A 70 3.238 13.159 -5.006 1.00 3.45 H new ATOM 0 HE3 TRP A 70 0.382 11.807 -9.357 1.00 25.15 H new ATOM 0 HZ2 TRP A 70 0.644 12.265 -4.400 1.00 12.21 H new ATOM 0 HZ3 TRP A 70 -1.536 11.226 -7.927 1.00 22.01 H new ATOM 0 HH2 TRP A 70 -1.401 11.454 -5.483 1.00 73.00 H new ATOM 963 N GLN A 71 2.581 10.121 -10.912 1.00 51.21 N ATOM 964 CA GLN A 71 1.857 8.860 -10.934 1.00 5.13 C ATOM 965 C GLN A 71 2.821 7.677 -11.072 1.00 34.13 C ATOM 966 O GLN A 71 2.755 6.712 -10.304 1.00 45.42 O ATOM 967 CB GLN A 71 0.844 8.839 -12.069 1.00 20.34 C ATOM 968 CG GLN A 71 -0.319 9.786 -11.871 1.00 62.10 C ATOM 969 CD GLN A 71 -1.410 9.567 -12.893 1.00 31.33 C ATOM 970 OE1 GLN A 71 -1.141 9.206 -14.042 1.00 32.45 O ATOM 971 NE2 GLN A 71 -2.645 9.746 -12.480 1.00 75.23 N ATOM 0 H GLN A 71 2.330 10.764 -11.663 1.00 51.21 H new ATOM 0 HA GLN A 71 1.325 8.766 -9.987 1.00 5.13 H new ATOM 0 HB2 GLN A 71 1.351 9.092 -13.000 1.00 20.34 H new ATOM 0 HB3 GLN A 71 0.459 7.825 -12.181 1.00 20.34 H new ATOM 0 HG2 GLN A 71 -0.729 9.652 -10.870 1.00 62.10 H new ATOM 0 HG3 GLN A 71 0.036 10.814 -11.935 1.00 62.10 H new ATOM 0 HE21 GLN A 71 -2.824 10.045 -11.521 1.00 75.23 H new ATOM 0 HE22 GLN A 71 -3.424 9.586 -13.118 1.00 75.23 H new ATOM 980 N GLN A 72 3.715 7.760 -12.057 1.00 41.14 N ATOM 981 CA GLN A 72 4.696 6.705 -12.296 1.00 43.14 C ATOM 982 C GLN A 72 5.644 6.530 -11.116 1.00 2.41 C ATOM 983 O GLN A 72 6.010 5.406 -10.773 1.00 54.11 O ATOM 984 CB GLN A 72 5.487 6.968 -13.574 1.00 22.02 C ATOM 985 CG GLN A 72 4.652 6.870 -14.837 1.00 64.12 C ATOM 986 CD GLN A 72 5.476 7.054 -16.092 1.00 44.15 C ATOM 987 OE1 GLN A 72 5.643 8.169 -16.581 1.00 52.12 O ATOM 988 NE2 GLN A 72 5.988 5.961 -16.627 1.00 62.44 N ATOM 0 H GLN A 72 3.779 8.548 -12.702 1.00 41.14 H new ATOM 0 HA GLN A 72 4.138 5.776 -12.416 1.00 43.14 H new ATOM 0 HB2 GLN A 72 5.931 7.962 -13.518 1.00 22.02 H new ATOM 0 HB3 GLN A 72 6.309 6.255 -13.636 1.00 22.02 H new ATOM 0 HG2 GLN A 72 4.160 5.898 -14.869 1.00 64.12 H new ATOM 0 HG3 GLN A 72 3.866 7.625 -14.808 1.00 64.12 H new ATOM 0 HE21 GLN A 72 5.825 5.054 -16.189 1.00 62.44 H new ATOM 0 HE22 GLN A 72 6.546 6.023 -17.478 1.00 62.44 H new ATOM 997 N THR A 73 6.034 7.632 -10.485 1.00 62.11 N ATOM 998 CA THR A 73 6.924 7.559 -9.340 1.00 43.53 C ATOM 999 C THR A 73 6.223 6.864 -8.176 1.00 73.03 C ATOM 1000 O THR A 73 6.815 6.020 -7.494 1.00 21.22 O ATOM 1001 CB THR A 73 7.408 8.961 -8.914 1.00 52.33 C ATOM 1002 OG1 THR A 73 8.031 9.610 -10.036 1.00 75.02 O ATOM 1003 CG2 THR A 73 8.411 8.867 -7.769 1.00 73.41 C ATOM 0 H THR A 73 5.750 8.576 -10.746 1.00 62.11 H new ATOM 0 HA THR A 73 7.800 6.978 -9.629 1.00 43.53 H new ATOM 0 HB THR A 73 6.546 9.536 -8.575 1.00 52.33 H new ATOM 0 HG1 THR A 73 7.341 9.912 -10.663 1.00 75.02 H new ATOM 0 HG21 THR A 73 8.737 9.868 -7.487 1.00 73.41 H new ATOM 0 HG22 THR A 73 7.941 8.384 -6.912 1.00 73.41 H new ATOM 0 HG23 THR A 73 9.273 8.281 -8.088 1.00 73.41 H new ATOM 1011 N PHE A 74 4.957 7.214 -7.959 1.00 55.23 N ATOM 1012 CA PHE A 74 4.156 6.564 -6.940 1.00 22.35 C ATOM 1013 C PHE A 74 4.080 5.060 -7.207 1.00 14.11 C ATOM 1014 O PHE A 74 4.158 4.256 -6.289 1.00 50.11 O ATOM 1015 CB PHE A 74 2.749 7.169 -6.883 1.00 1.03 C ATOM 1016 CG PHE A 74 1.890 6.584 -5.796 1.00 71.41 C ATOM 1017 CD1 PHE A 74 2.079 6.953 -4.474 1.00 23.15 C ATOM 1018 CD2 PHE A 74 0.902 5.657 -6.093 1.00 11.12 C ATOM 1019 CE1 PHE A 74 1.301 6.413 -3.470 1.00 1.12 C ATOM 1020 CE2 PHE A 74 0.120 5.113 -5.093 1.00 0.20 C ATOM 1021 CZ PHE A 74 0.321 5.492 -3.778 1.00 60.15 C ATOM 0 H PHE A 74 4.470 7.944 -8.478 1.00 55.23 H new ATOM 0 HA PHE A 74 4.634 6.725 -5.974 1.00 22.35 H new ATOM 0 HB2 PHE A 74 2.830 8.245 -6.732 1.00 1.03 H new ATOM 0 HB3 PHE A 74 2.258 7.019 -7.844 1.00 1.03 H new ATOM 0 HD1 PHE A 74 2.845 7.673 -4.226 1.00 23.15 H new ATOM 0 HD2 PHE A 74 0.742 5.357 -7.118 1.00 11.12 H new ATOM 0 HE1 PHE A 74 1.459 6.711 -2.444 1.00 1.12 H new ATOM 0 HE2 PHE A 74 -0.647 4.393 -5.337 1.00 0.20 H new ATOM 0 HZ PHE A 74 -0.288 5.068 -2.994 1.00 60.15 H new ATOM 1031 N SER A 75 3.933 4.690 -8.471 1.00 33.45 N ATOM 1032 CA SER A 75 3.891 3.285 -8.853 1.00 64.32 C ATOM 1033 C SER A 75 5.164 2.554 -8.406 1.00 53.02 C ATOM 1034 O SER A 75 5.098 1.447 -7.864 1.00 30.54 O ATOM 1035 CB SER A 75 3.713 3.165 -10.365 1.00 43.11 C ATOM 1036 OG SER A 75 2.553 3.859 -10.793 1.00 75.54 O ATOM 0 H SER A 75 3.841 5.343 -9.250 1.00 33.45 H new ATOM 0 HA SER A 75 3.043 2.817 -8.354 1.00 64.32 H new ATOM 0 HB2 SER A 75 4.590 3.567 -10.872 1.00 43.11 H new ATOM 0 HB3 SER A 75 3.637 2.114 -10.644 1.00 43.11 H new ATOM 0 HG SER A 75 2.696 4.824 -10.699 1.00 75.54 H new ATOM 1042 N GLN A 76 6.315 3.186 -8.635 1.00 71.13 N ATOM 1043 CA GLN A 76 7.610 2.620 -8.251 1.00 43.32 C ATOM 1044 C GLN A 76 7.646 2.276 -6.759 1.00 65.35 C ATOM 1045 O GLN A 76 7.973 1.149 -6.380 1.00 35.34 O ATOM 1046 CB GLN A 76 8.743 3.601 -8.578 1.00 63.34 C ATOM 1047 CG GLN A 76 8.829 4.003 -10.046 1.00 23.13 C ATOM 1048 CD GLN A 76 9.243 2.862 -10.964 1.00 70.23 C ATOM 1049 OE1 GLN A 76 8.967 1.691 -10.700 1.00 53.31 O ATOM 1050 NE2 GLN A 76 9.909 3.201 -12.049 1.00 60.01 N ATOM 0 H GLN A 76 6.377 4.098 -9.088 1.00 71.13 H new ATOM 0 HA GLN A 76 7.750 1.702 -8.822 1.00 43.32 H new ATOM 0 HB2 GLN A 76 8.613 4.500 -7.976 1.00 63.34 H new ATOM 0 HB3 GLN A 76 9.691 3.153 -8.281 1.00 63.34 H new ATOM 0 HG2 GLN A 76 7.860 4.384 -10.368 1.00 23.13 H new ATOM 0 HG3 GLN A 76 9.543 4.820 -10.150 1.00 23.13 H new ATOM 0 HE21 GLN A 76 10.119 4.182 -12.233 1.00 60.01 H new ATOM 0 HE22 GLN A 76 10.215 2.482 -12.705 1.00 60.01 H new ATOM 1059 N GLN A 77 7.301 3.249 -5.921 1.00 54.52 N ATOM 1060 CA GLN A 77 7.315 3.051 -4.471 1.00 42.30 C ATOM 1061 C GLN A 77 6.295 2.000 -4.015 1.00 73.10 C ATOM 1062 O GLN A 77 6.430 1.428 -2.940 1.00 70.41 O ATOM 1063 CB GLN A 77 7.131 4.370 -3.714 1.00 23.14 C ATOM 1064 CG GLN A 77 5.907 5.159 -4.118 1.00 33.31 C ATOM 1065 CD GLN A 77 5.745 6.437 -3.329 1.00 61.13 C ATOM 1066 OE1 GLN A 77 5.237 7.429 -3.834 1.00 64.41 O ATOM 1067 NE2 GLN A 77 6.159 6.417 -2.080 1.00 23.14 N ATOM 0 H GLN A 77 7.009 4.180 -6.217 1.00 54.52 H new ATOM 0 HA GLN A 77 8.303 2.664 -4.223 1.00 42.30 H new ATOM 0 HB2 GLN A 77 7.074 4.157 -2.647 1.00 23.14 H new ATOM 0 HB3 GLN A 77 8.014 4.989 -3.869 1.00 23.14 H new ATOM 0 HG2 GLN A 77 5.969 5.399 -5.179 1.00 33.31 H new ATOM 0 HG3 GLN A 77 5.020 4.539 -3.983 1.00 33.31 H new ATOM 0 HE21 GLN A 77 6.578 5.570 -1.695 1.00 23.14 H new ATOM 0 HE22 GLN A 77 6.061 7.248 -1.497 1.00 23.14 H new ATOM 1076 N VAL A 78 5.281 1.744 -4.838 1.00 5.01 N ATOM 1077 CA VAL A 78 4.285 0.732 -4.509 1.00 11.24 C ATOM 1078 C VAL A 78 4.806 -0.651 -4.880 1.00 42.32 C ATOM 1079 O VAL A 78 4.505 -1.643 -4.217 1.00 43.11 O ATOM 1080 CB VAL A 78 2.924 0.992 -5.210 1.00 51.10 C ATOM 1081 CG1 VAL A 78 1.934 -0.131 -4.916 1.00 41.13 C ATOM 1082 CG2 VAL A 78 2.346 2.321 -4.763 1.00 51.44 C ATOM 0 H VAL A 78 5.129 2.219 -5.728 1.00 5.01 H new ATOM 0 HA VAL A 78 4.111 0.786 -3.434 1.00 11.24 H new ATOM 0 HB VAL A 78 3.100 1.023 -6.285 1.00 51.10 H new ATOM 0 HG11 VAL A 78 0.989 0.076 -5.419 1.00 41.13 H new ATOM 0 HG12 VAL A 78 2.338 -1.076 -5.278 1.00 41.13 H new ATOM 0 HG13 VAL A 78 1.766 -0.196 -3.841 1.00 41.13 H new ATOM 0 HG21 VAL A 78 1.392 2.489 -5.263 1.00 51.44 H new ATOM 0 HG22 VAL A 78 2.193 2.307 -3.684 1.00 51.44 H new ATOM 0 HG23 VAL A 78 3.037 3.123 -5.021 1.00 51.44 H new ATOM 1092 N MET A 79 5.616 -0.713 -5.929 1.00 32.22 N ATOM 1093 CA MET A 79 6.227 -1.972 -6.331 1.00 72.51 C ATOM 1094 C MET A 79 7.249 -2.405 -5.286 1.00 0.31 C ATOM 1095 O MET A 79 7.579 -3.580 -5.169 1.00 50.44 O ATOM 1096 CB MET A 79 6.877 -1.860 -7.713 1.00 21.22 C ATOM 1097 CG MET A 79 5.885 -1.605 -8.839 1.00 44.11 C ATOM 1098 SD MET A 79 6.649 -1.635 -10.476 1.00 74.44 S ATOM 1099 CE MET A 79 7.201 -3.342 -10.566 1.00 65.33 C ATOM 0 H MET A 79 5.863 0.087 -6.512 1.00 32.22 H new ATOM 0 HA MET A 79 5.445 -2.729 -6.399 1.00 72.51 H new ATOM 0 HB2 MET A 79 7.609 -1.052 -7.696 1.00 21.22 H new ATOM 0 HB3 MET A 79 7.423 -2.780 -7.923 1.00 21.22 H new ATOM 0 HG2 MET A 79 5.097 -2.357 -8.798 1.00 44.11 H new ATOM 0 HG3 MET A 79 5.410 -0.636 -8.684 1.00 44.11 H new ATOM 0 HE1 MET A 79 7.329 -3.628 -11.610 1.00 65.33 H new ATOM 0 HE2 MET A 79 8.151 -3.445 -10.042 1.00 65.33 H new ATOM 0 HE3 MET A 79 6.458 -3.990 -10.100 1.00 65.33 H new ATOM 1109 N LEU A 80 7.737 -1.433 -4.529 1.00 40.11 N ATOM 1110 CA LEU A 80 8.654 -1.696 -3.429 1.00 73.25 C ATOM 1111 C LEU A 80 7.992 -2.656 -2.432 1.00 12.03 C ATOM 1112 O LEU A 80 8.634 -3.575 -1.909 1.00 44.22 O ATOM 1113 CB LEU A 80 9.036 -0.384 -2.735 1.00 20.50 C ATOM 1114 CG LEU A 80 10.065 -0.494 -1.607 1.00 12.21 C ATOM 1115 CD1 LEU A 80 11.403 -0.977 -2.143 1.00 3.03 C ATOM 1116 CD2 LEU A 80 10.224 0.843 -0.898 1.00 2.45 C ATOM 0 H LEU A 80 7.511 -0.447 -4.658 1.00 40.11 H new ATOM 0 HA LEU A 80 9.563 -2.156 -3.818 1.00 73.25 H new ATOM 0 HB2 LEU A 80 9.424 0.302 -3.488 1.00 20.50 H new ATOM 0 HB3 LEU A 80 8.130 0.067 -2.330 1.00 20.50 H new ATOM 0 HG LEU A 80 9.703 -1.226 -0.885 1.00 12.21 H new ATOM 0 HD11 LEU A 80 12.119 -1.048 -1.324 1.00 3.03 H new ATOM 0 HD12 LEU A 80 11.278 -1.958 -2.602 1.00 3.03 H new ATOM 0 HD13 LEU A 80 11.772 -0.272 -2.888 1.00 3.03 H new ATOM 0 HD21 LEU A 80 10.959 0.746 -0.099 1.00 2.45 H new ATOM 0 HD22 LEU A 80 10.560 1.595 -1.611 1.00 2.45 H new ATOM 0 HD23 LEU A 80 9.266 1.147 -0.475 1.00 2.45 H new ATOM 1128 N PHE A 81 6.700 -2.428 -2.183 1.00 74.13 N ATOM 1129 CA PHE A 81 5.898 -3.282 -1.307 1.00 72.34 C ATOM 1130 C PHE A 81 5.990 -4.752 -1.699 1.00 24.04 C ATOM 1131 O PHE A 81 6.342 -5.588 -0.879 1.00 42.41 O ATOM 1132 CB PHE A 81 4.430 -2.855 -1.321 1.00 60.23 C ATOM 1133 CG PHE A 81 4.130 -1.623 -0.523 1.00 71.34 C ATOM 1134 CD1 PHE A 81 4.515 -0.374 -0.971 1.00 65.45 C ATOM 1135 CD2 PHE A 81 3.447 -1.719 0.677 1.00 53.13 C ATOM 1136 CE1 PHE A 81 4.228 0.756 -0.238 1.00 44.13 C ATOM 1137 CE2 PHE A 81 3.158 -0.594 1.416 1.00 64.35 C ATOM 1138 CZ PHE A 81 3.549 0.645 0.958 1.00 71.42 C ATOM 0 H PHE A 81 6.182 -1.646 -2.583 1.00 74.13 H new ATOM 0 HA PHE A 81 6.306 -3.164 -0.303 1.00 72.34 H new ATOM 0 HB2 PHE A 81 4.124 -2.686 -2.354 1.00 60.23 H new ATOM 0 HB3 PHE A 81 3.823 -3.676 -0.939 1.00 60.23 H new ATOM 0 HD1 PHE A 81 5.047 -0.283 -1.906 1.00 65.45 H new ATOM 0 HD2 PHE A 81 3.137 -2.688 1.038 1.00 53.13 H new ATOM 0 HE1 PHE A 81 4.534 1.727 -0.599 1.00 44.13 H new ATOM 0 HE2 PHE A 81 2.626 -0.683 2.352 1.00 64.35 H new ATOM 0 HZ PHE A 81 3.324 1.530 1.535 1.00 71.42 H new ATOM 1148 N THR A 82 5.684 -5.059 -2.956 1.00 21.31 N ATOM 1149 CA THR A 82 5.689 -6.446 -3.422 1.00 62.13 C ATOM 1150 C THR A 82 7.112 -7.022 -3.463 1.00 51.40 C ATOM 1151 O THR A 82 7.301 -8.239 -3.421 1.00 15.24 O ATOM 1152 CB THR A 82 4.987 -6.604 -4.809 1.00 43.21 C ATOM 1153 OG1 THR A 82 4.943 -7.980 -5.192 1.00 42.04 O ATOM 1154 CG2 THR A 82 5.699 -5.810 -5.892 1.00 65.51 C ATOM 0 H THR A 82 5.431 -4.373 -3.667 1.00 21.31 H new ATOM 0 HA THR A 82 5.112 -7.020 -2.697 1.00 62.13 H new ATOM 0 HB THR A 82 3.974 -6.216 -4.703 1.00 43.21 H new ATOM 0 HG1 THR A 82 4.499 -8.063 -6.062 1.00 42.04 H new ATOM 0 HG21 THR A 82 5.182 -5.945 -6.842 1.00 65.51 H new ATOM 0 HG22 THR A 82 5.700 -4.753 -5.627 1.00 65.51 H new ATOM 0 HG23 THR A 82 6.726 -6.162 -5.985 1.00 65.51 H new ATOM 1162 N ARG A 83 8.106 -6.145 -3.531 1.00 21.22 N ATOM 1163 CA ARG A 83 9.500 -6.574 -3.536 1.00 10.21 C ATOM 1164 C ARG A 83 9.914 -7.080 -2.163 1.00 51.42 C ATOM 1165 O ARG A 83 10.450 -8.175 -2.030 1.00 15.15 O ATOM 1166 CB ARG A 83 10.422 -5.431 -3.960 1.00 71.00 C ATOM 1167 CG ARG A 83 10.308 -5.039 -5.420 1.00 25.11 C ATOM 1168 CD ARG A 83 10.700 -6.183 -6.340 1.00 4.33 C ATOM 1169 NE ARG A 83 10.787 -5.749 -7.729 1.00 13.13 N ATOM 1170 CZ ARG A 83 11.146 -6.530 -8.747 1.00 52.55 C ATOM 1171 NH1 ARG A 83 11.422 -7.811 -8.544 1.00 22.14 N ATOM 1172 NH2 ARG A 83 11.221 -6.023 -9.969 1.00 31.22 N ATOM 0 H ARG A 83 7.974 -5.135 -3.583 1.00 21.22 H new ATOM 0 HA ARG A 83 9.592 -7.387 -4.257 1.00 10.21 H new ATOM 0 HB2 ARG A 83 10.204 -4.558 -3.345 1.00 71.00 H new ATOM 0 HB3 ARG A 83 11.453 -5.717 -3.753 1.00 71.00 H new ATOM 0 HG2 ARG A 83 9.285 -4.732 -5.636 1.00 25.11 H new ATOM 0 HG3 ARG A 83 10.947 -4.178 -5.617 1.00 25.11 H new ATOM 0 HD2 ARG A 83 11.660 -6.591 -6.025 1.00 4.33 H new ATOM 0 HD3 ARG A 83 9.968 -6.987 -6.254 1.00 4.33 H new ATOM 0 HE ARG A 83 10.556 -4.777 -7.936 1.00 13.13 H new ATOM 0 HH11 ARG A 83 11.360 -8.203 -7.605 1.00 22.14 H new ATOM 0 HH12 ARG A 83 11.696 -8.404 -9.327 1.00 22.14 H new ATOM 0 HH21 ARG A 83 11.004 -5.039 -10.127 1.00 31.22 H new ATOM 0 HH22 ARG A 83 11.495 -6.617 -10.752 1.00 31.22 H new ATOM 1186 N GLN A 84 9.661 -6.273 -1.144 1.00 52.11 N ATOM 1187 CA GLN A 84 10.031 -6.626 0.223 1.00 0.14 C ATOM 1188 C GLN A 84 8.997 -7.546 0.868 1.00 34.43 C ATOM 1189 O GLN A 84 9.309 -8.289 1.794 1.00 14.22 O ATOM 1190 CB GLN A 84 10.196 -5.368 1.073 1.00 40.34 C ATOM 1191 CG GLN A 84 11.212 -4.381 0.533 1.00 41.20 C ATOM 1192 CD GLN A 84 11.429 -3.210 1.467 1.00 22.31 C ATOM 1193 OE1 GLN A 84 12.303 -3.247 2.334 1.00 11.42 O ATOM 1194 NE2 GLN A 84 10.628 -2.175 1.318 1.00 43.42 N ATOM 0 H GLN A 84 9.200 -5.367 -1.235 1.00 52.11 H new ATOM 0 HA GLN A 84 10.980 -7.160 0.174 1.00 0.14 H new ATOM 0 HB2 GLN A 84 9.230 -4.869 1.155 1.00 40.34 H new ATOM 0 HB3 GLN A 84 10.490 -5.660 2.081 1.00 40.34 H new ATOM 0 HG2 GLN A 84 12.160 -4.893 0.369 1.00 41.20 H new ATOM 0 HG3 GLN A 84 10.877 -4.012 -0.436 1.00 41.20 H new ATOM 0 HE21 GLN A 84 9.916 -2.182 0.588 1.00 43.42 H new ATOM 0 HE22 GLN A 84 10.720 -1.366 1.933 1.00 43.42 H new ATOM 1203 N GLY A 85 7.773 -7.483 0.380 1.00 50.04 N ATOM 1204 CA GLY A 85 6.705 -8.273 0.955 1.00 13.11 C ATOM 1205 C GLY A 85 5.990 -7.508 2.047 1.00 53.40 C ATOM 1206 O GLY A 85 5.627 -8.066 3.079 1.00 62.24 O ATOM 0 H GLY A 85 7.496 -6.897 -0.408 1.00 50.04 H new ATOM 0 HA2 GLY A 85 5.995 -8.551 0.177 1.00 13.11 H new ATOM 0 HA3 GLY A 85 7.112 -9.199 1.362 1.00 13.11 H new ATOM 1210 N GLN A 86 5.795 -6.217 1.812 1.00 43.22 N ATOM 1211 CA GLN A 86 5.166 -5.332 2.787 1.00 12.14 C ATOM 1212 C GLN A 86 3.653 -5.428 2.746 1.00 42.42 C ATOM 1213 O GLN A 86 3.080 -6.256 2.032 1.00 33.34 O ATOM 1214 CB GLN A 86 5.577 -3.882 2.539 1.00 20.45 C ATOM 1215 CG GLN A 86 7.045 -3.616 2.743 1.00 11.54 C ATOM 1216 CD GLN A 86 7.413 -2.170 2.500 1.00 43.04 C ATOM 1217 OE1 GLN A 86 7.756 -1.783 1.385 1.00 23.32 O ATOM 1218 NE2 GLN A 86 7.337 -1.362 3.540 1.00 34.13 N ATOM 0 H GLN A 86 6.067 -5.754 0.945 1.00 43.22 H new ATOM 0 HA GLN A 86 5.507 -5.653 3.771 1.00 12.14 H new ATOM 0 HB2 GLN A 86 5.307 -3.609 1.519 1.00 20.45 H new ATOM 0 HB3 GLN A 86 5.005 -3.235 3.204 1.00 20.45 H new ATOM 0 HG2 GLN A 86 7.322 -3.892 3.760 1.00 11.54 H new ATOM 0 HG3 GLN A 86 7.622 -4.252 2.072 1.00 11.54 H new ATOM 0 HE21 GLN A 86 7.048 -1.725 4.448 1.00 34.13 H new ATOM 0 HE22 GLN A 86 7.568 -0.374 3.436 1.00 34.13 H new ATOM 1227 N GLN A 87 3.018 -4.571 3.522 1.00 21.41 N ATOM 1228 CA GLN A 87 1.571 -4.499 3.573 1.00 73.23 C ATOM 1229 C GLN A 87 1.115 -3.114 4.032 1.00 31.32 C ATOM 1230 O GLN A 87 -0.011 -2.701 3.770 1.00 71.22 O ATOM 1231 CB GLN A 87 0.998 -5.578 4.514 1.00 41.15 C ATOM 1232 CG GLN A 87 1.316 -5.377 6.001 1.00 2.44 C ATOM 1233 CD GLN A 87 2.794 -5.501 6.325 1.00 12.33 C ATOM 1234 OE1 GLN A 87 3.537 -4.514 6.294 1.00 62.13 O ATOM 1235 NE2 GLN A 87 3.229 -6.703 6.642 1.00 40.30 N ATOM 0 H GLN A 87 3.490 -3.906 4.134 1.00 21.41 H new ATOM 0 HA GLN A 87 1.193 -4.679 2.566 1.00 73.23 H new ATOM 0 HB2 GLN A 87 -0.085 -5.609 4.390 1.00 41.15 H new ATOM 0 HB3 GLN A 87 1.382 -6.550 4.204 1.00 41.15 H new ATOM 0 HG2 GLN A 87 0.966 -4.392 6.310 1.00 2.44 H new ATOM 0 HG3 GLN A 87 0.761 -6.111 6.586 1.00 2.44 H new ATOM 0 HE21 GLN A 87 2.583 -7.492 6.656 1.00 40.30 H new ATOM 0 HE22 GLN A 87 4.212 -6.845 6.874 1.00 40.30 H new ATOM 1244 N SER A 88 1.985 -2.416 4.737 1.00 44.42 N ATOM 1245 CA SER A 88 1.709 -1.070 5.188 1.00 4.13 C ATOM 1246 C SER A 88 3.012 -0.305 5.301 1.00 52.11 C ATOM 1247 O SER A 88 4.018 -0.863 5.734 1.00 20.40 O ATOM 1248 CB SER A 88 0.998 -1.099 6.542 1.00 2.23 C ATOM 1249 OG SER A 88 -0.209 -1.840 6.462 1.00 11.14 O ATOM 0 H SER A 88 2.902 -2.768 5.012 1.00 44.42 H new ATOM 0 HA SER A 88 1.057 -0.575 4.468 1.00 4.13 H new ATOM 0 HB2 SER A 88 1.653 -1.542 7.292 1.00 2.23 H new ATOM 0 HB3 SER A 88 0.784 -0.081 6.867 1.00 2.23 H new ATOM 0 HG SER A 88 -0.647 -1.847 7.339 1.00 11.14 H new ATOM 1255 N ALA A 89 3.003 0.956 4.903 1.00 60.35 N ATOM 1256 CA ALA A 89 4.202 1.770 4.959 1.00 75.21 C ATOM 1257 C ALA A 89 3.866 3.244 4.890 1.00 44.42 C ATOM 1258 O ALA A 89 2.802 3.631 4.387 1.00 20.15 O ATOM 1259 CB ALA A 89 5.175 1.396 3.849 1.00 63.43 C ATOM 0 H ALA A 89 2.180 1.436 4.539 1.00 60.35 H new ATOM 0 HA ALA A 89 4.684 1.573 5.916 1.00 75.21 H new ATOM 0 HB1 ALA A 89 6.064 2.023 3.917 1.00 63.43 H new ATOM 0 HB2 ALA A 89 5.461 0.349 3.953 1.00 63.43 H new ATOM 0 HB3 ALA A 89 4.698 1.547 2.881 1.00 63.43 H new ATOM 1265 N GLN A 90 4.766 4.055 5.410 1.00 15.01 N ATOM 1266 CA GLN A 90 4.635 5.495 5.387 1.00 73.11 C ATOM 1267 C GLN A 90 5.949 6.114 4.946 1.00 14.03 C ATOM 1268 O GLN A 90 7.009 5.795 5.490 1.00 21.34 O ATOM 1269 CB GLN A 90 4.228 6.032 6.764 1.00 72.35 C ATOM 1270 CG GLN A 90 2.837 5.604 7.200 1.00 71.11 C ATOM 1271 CD GLN A 90 2.433 6.192 8.533 1.00 15.41 C ATOM 1272 OE1 GLN A 90 1.859 7.282 8.594 1.00 23.53 O ATOM 1273 NE2 GLN A 90 2.710 5.474 9.601 1.00 54.21 N ATOM 0 H GLN A 90 5.618 3.727 5.865 1.00 15.01 H new ATOM 0 HA GLN A 90 3.851 5.765 4.679 1.00 73.11 H new ATOM 0 HB2 GLN A 90 4.952 5.693 7.505 1.00 72.35 H new ATOM 0 HB3 GLN A 90 4.275 7.121 6.748 1.00 72.35 H new ATOM 0 HG2 GLN A 90 2.115 5.906 6.441 1.00 71.11 H new ATOM 0 HG3 GLN A 90 2.799 4.516 7.262 1.00 71.11 H new ATOM 0 HE21 GLN A 90 3.186 4.577 9.503 1.00 54.21 H new ATOM 0 HE22 GLN A 90 2.448 5.814 10.526 1.00 54.21 H new ATOM 1282 N LEU A 91 5.884 6.978 3.959 1.00 2.42 N ATOM 1283 CA LEU A 91 7.070 7.613 3.417 1.00 33.11 C ATOM 1284 C LEU A 91 6.843 9.119 3.329 1.00 40.43 C ATOM 1285 O LEU A 91 5.711 9.585 3.485 1.00 50.21 O ATOM 1286 CB LEU A 91 7.368 7.039 2.020 1.00 64.23 C ATOM 1287 CG LEU A 91 8.760 7.325 1.446 1.00 45.21 C ATOM 1288 CD1 LEU A 91 9.821 6.537 2.196 1.00 74.31 C ATOM 1289 CD2 LEU A 91 8.803 6.998 -0.038 1.00 73.12 C ATOM 0 H LEU A 91 5.014 7.261 3.509 1.00 2.42 H new ATOM 0 HA LEU A 91 7.922 7.419 4.069 1.00 33.11 H new ATOM 0 HB2 LEU A 91 7.230 5.958 2.059 1.00 64.23 H new ATOM 0 HB3 LEU A 91 6.625 7.430 1.325 1.00 64.23 H new ATOM 0 HG LEU A 91 8.970 8.387 1.571 1.00 45.21 H new ATOM 0 HD11 LEU A 91 10.802 6.754 1.773 1.00 74.31 H new ATOM 0 HD12 LEU A 91 9.809 6.820 3.248 1.00 74.31 H new ATOM 0 HD13 LEU A 91 9.614 5.471 2.105 1.00 74.31 H new ATOM 0 HD21 LEU A 91 9.799 7.207 -0.428 1.00 73.12 H new ATOM 0 HD22 LEU A 91 8.570 5.943 -0.185 1.00 73.12 H new ATOM 0 HD23 LEU A 91 8.071 7.608 -0.566 1.00 73.12 H new ATOM 1301 N ARG A 92 7.903 9.876 3.078 1.00 52.55 N ATOM 1302 CA ARG A 92 7.780 11.318 2.951 1.00 13.51 C ATOM 1303 C ARG A 92 7.242 11.651 1.564 1.00 35.25 C ATOM 1304 O ARG A 92 7.977 11.693 0.573 1.00 4.52 O ATOM 1305 CB ARG A 92 9.139 12.000 3.217 1.00 23.42 C ATOM 1306 CG ARG A 92 9.074 13.513 3.432 1.00 5.23 C ATOM 1307 CD ARG A 92 9.131 14.284 2.121 1.00 53.24 C ATOM 1308 NE ARG A 92 9.049 15.732 2.334 1.00 42.54 N ATOM 1309 CZ ARG A 92 9.813 16.638 1.715 1.00 33.01 C ATOM 1310 NH1 ARG A 92 10.757 16.255 0.861 1.00 52.51 N ATOM 1311 NH2 ARG A 92 9.635 17.928 1.958 1.00 44.44 N ATOM 0 H ARG A 92 8.850 9.517 2.959 1.00 52.55 H new ATOM 0 HA ARG A 92 7.080 11.698 3.695 1.00 13.51 H new ATOM 0 HB2 ARG A 92 9.592 11.543 4.097 1.00 23.42 H new ATOM 0 HB3 ARG A 92 9.801 11.796 2.376 1.00 23.42 H new ATOM 0 HG2 ARG A 92 8.154 13.764 3.959 1.00 5.23 H new ATOM 0 HG3 ARG A 92 9.901 13.823 4.070 1.00 5.23 H new ATOM 0 HD2 ARG A 92 10.058 14.046 1.600 1.00 53.24 H new ATOM 0 HD3 ARG A 92 8.312 13.965 1.476 1.00 53.24 H new ATOM 0 HE ARG A 92 8.359 16.073 3.003 1.00 42.54 H new ATOM 0 HH11 ARG A 92 10.903 15.263 0.673 1.00 52.51 H new ATOM 0 HH12 ARG A 92 11.335 16.953 0.393 1.00 52.51 H new ATOM 0 HH21 ARG A 92 8.916 18.229 2.616 1.00 44.44 H new ATOM 0 HH22 ARG A 92 10.217 18.621 1.487 1.00 44.44 H new ATOM 1325 N LEU A 93 5.947 11.837 1.514 1.00 15.35 N ATOM 1326 CA LEU A 93 5.257 12.104 0.268 1.00 2.52 C ATOM 1327 C LEU A 93 4.925 13.576 0.105 1.00 31.33 C ATOM 1328 O LEU A 93 5.121 14.379 1.016 1.00 2.41 O ATOM 1329 CB LEU A 93 3.983 11.252 0.139 1.00 21.23 C ATOM 1330 CG LEU A 93 4.163 9.730 0.286 1.00 34.11 C ATOM 1331 CD1 LEU A 93 2.942 8.995 -0.239 1.00 33.32 C ATOM 1332 CD2 LEU A 93 5.412 9.249 -0.427 1.00 53.20 C ATOM 0 H LEU A 93 5.338 11.809 2.332 1.00 15.35 H new ATOM 0 HA LEU A 93 5.941 11.826 -0.534 1.00 2.52 H new ATOM 0 HB2 LEU A 93 3.270 11.587 0.892 1.00 21.23 H new ATOM 0 HB3 LEU A 93 3.535 11.451 -0.835 1.00 21.23 H new ATOM 0 HG LEU A 93 4.276 9.512 1.348 1.00 34.11 H new ATOM 0 HD11 LEU A 93 3.088 7.921 -0.127 1.00 33.32 H new ATOM 0 HD12 LEU A 93 2.062 9.303 0.325 1.00 33.32 H new ATOM 0 HD13 LEU A 93 2.799 9.234 -1.293 1.00 33.32 H new ATOM 0 HD21 LEU A 93 5.509 8.170 -0.303 1.00 53.20 H new ATOM 0 HD22 LEU A 93 5.340 9.488 -1.488 1.00 53.20 H new ATOM 0 HD23 LEU A 93 6.286 9.743 -0.003 1.00 53.20 H new ATOM 1344 N HIS A 94 4.444 13.917 -1.072 1.00 5.31 N ATOM 1345 CA HIS A 94 4.032 15.266 -1.390 1.00 75.12 C ATOM 1346 C HIS A 94 2.589 15.250 -1.868 1.00 11.51 C ATOM 1347 O HIS A 94 2.105 14.207 -2.304 1.00 12.12 O ATOM 1348 CB HIS A 94 4.948 15.881 -2.454 1.00 3.11 C ATOM 1349 CG HIS A 94 6.228 16.424 -1.899 1.00 73.32 C ATOM 1350 ND1 HIS A 94 7.428 15.762 -1.981 1.00 42.01 N ATOM 1351 CD2 HIS A 94 6.491 17.587 -1.257 1.00 21.11 C ATOM 1352 CE1 HIS A 94 8.369 16.487 -1.418 1.00 63.42 C ATOM 1353 NE2 HIS A 94 7.828 17.601 -0.970 1.00 23.24 N ATOM 0 H HIS A 94 4.327 13.258 -1.842 1.00 5.31 H new ATOM 0 HA HIS A 94 4.108 15.882 -0.494 1.00 75.12 H new ATOM 0 HB2 HIS A 94 5.179 15.125 -3.204 1.00 3.11 H new ATOM 0 HB3 HIS A 94 4.413 16.683 -2.963 1.00 3.11 H new ATOM 0 HD1 HIS A 94 7.568 14.848 -2.412 1.00 42.01 H new ATOM 0 HD2 HIS A 94 5.777 18.361 -1.016 1.00 21.11 H new ATOM 0 HE1 HIS A 94 9.411 16.215 -1.337 1.00 63.42 H new ATOM 1362 N PRO A 95 1.870 16.393 -1.816 1.00 12.10 N ATOM 1363 CA PRO A 95 2.403 17.696 -1.362 1.00 1.24 C ATOM 1364 C PRO A 95 2.885 17.702 0.094 1.00 0.24 C ATOM 1365 O PRO A 95 2.605 16.785 0.869 1.00 32.21 O ATOM 1366 CB PRO A 95 1.207 18.647 -1.523 1.00 42.21 C ATOM 1367 CG PRO A 95 0.015 17.763 -1.546 1.00 61.35 C ATOM 1368 CD PRO A 95 0.460 16.495 -2.205 1.00 13.34 C ATOM 0 HA PRO A 95 3.286 17.972 -1.938 1.00 1.24 H new ATOM 0 HB2 PRO A 95 1.155 19.359 -0.699 1.00 42.21 H new ATOM 0 HB3 PRO A 95 1.285 19.228 -2.442 1.00 42.21 H new ATOM 0 HG2 PRO A 95 -0.350 17.572 -0.537 1.00 61.35 H new ATOM 0 HG3 PRO A 95 -0.803 18.224 -2.099 1.00 61.35 H new ATOM 0 HD2 PRO A 95 -0.116 15.637 -1.859 1.00 13.34 H new ATOM 0 HD3 PRO A 95 0.343 16.541 -3.288 1.00 13.34 H new ATOM 1376 N GLU A 96 3.598 18.765 0.440 1.00 54.52 N ATOM 1377 CA GLU A 96 4.152 18.928 1.781 1.00 5.51 C ATOM 1378 C GLU A 96 3.026 18.947 2.814 1.00 63.34 C ATOM 1379 O GLU A 96 3.168 18.406 3.909 1.00 21.32 O ATOM 1380 CB GLU A 96 5.011 20.196 1.870 1.00 10.14 C ATOM 1381 CG GLU A 96 4.304 21.459 1.421 1.00 64.43 C ATOM 1382 CD GLU A 96 5.206 22.663 1.425 1.00 12.25 C ATOM 1383 OE1 GLU A 96 5.330 23.316 2.484 1.00 50.53 O ATOM 1384 OE2 GLU A 96 5.793 22.967 0.376 1.00 43.41 O ATOM 0 H GLU A 96 3.809 19.535 -0.195 1.00 54.52 H new ATOM 0 HA GLU A 96 4.801 18.079 1.996 1.00 5.51 H new ATOM 0 HB2 GLU A 96 5.342 20.325 2.900 1.00 10.14 H new ATOM 0 HB3 GLU A 96 5.906 20.058 1.263 1.00 10.14 H new ATOM 0 HG2 GLU A 96 3.907 21.311 0.417 1.00 64.43 H new ATOM 0 HG3 GLU A 96 3.453 21.646 2.075 1.00 64.43 H new ATOM 1391 N GLU A 97 1.926 19.611 2.445 1.00 53.52 N ATOM 1392 CA GLU A 97 0.687 19.644 3.235 1.00 14.23 C ATOM 1393 C GLU A 97 0.378 18.279 3.877 1.00 71.24 C ATOM 1394 O GLU A 97 0.129 18.192 5.083 1.00 2.32 O ATOM 1395 CB GLU A 97 -0.479 20.065 2.335 1.00 64.51 C ATOM 1396 CG GLU A 97 -1.772 20.342 3.076 1.00 21.54 C ATOM 1397 CD GLU A 97 -1.629 21.470 4.064 1.00 61.00 C ATOM 1398 OE1 GLU A 97 -1.365 22.612 3.632 1.00 42.11 O ATOM 1399 OE2 GLU A 97 -1.777 21.224 5.278 1.00 33.51 O ATOM 0 H GLU A 97 1.868 20.148 1.579 1.00 53.52 H new ATOM 0 HA GLU A 97 0.822 20.366 4.041 1.00 14.23 H new ATOM 0 HB2 GLU A 97 -0.192 20.960 1.783 1.00 64.51 H new ATOM 0 HB3 GLU A 97 -0.657 19.280 1.600 1.00 64.51 H new ATOM 0 HG2 GLU A 97 -2.555 20.586 2.358 1.00 21.54 H new ATOM 0 HG3 GLU A 97 -2.090 19.440 3.600 1.00 21.54 H new ATOM 1406 N LEU A 98 0.409 17.222 3.067 1.00 30.00 N ATOM 1407 CA LEU A 98 0.116 15.871 3.549 1.00 65.34 C ATOM 1408 C LEU A 98 1.081 15.431 4.648 1.00 35.20 C ATOM 1409 O LEU A 98 0.657 14.836 5.641 1.00 30.32 O ATOM 1410 CB LEU A 98 0.148 14.862 2.395 1.00 33.23 C ATOM 1411 CG LEU A 98 -0.894 15.065 1.292 1.00 53.01 C ATOM 1412 CD1 LEU A 98 -0.746 13.998 0.219 1.00 30.41 C ATOM 1413 CD2 LEU A 98 -2.304 15.044 1.870 1.00 2.43 C ATOM 0 H LEU A 98 0.634 17.274 2.073 1.00 30.00 H new ATOM 0 HA LEU A 98 -0.887 15.898 3.975 1.00 65.34 H new ATOM 0 HB2 LEU A 98 1.138 14.892 1.941 1.00 33.23 H new ATOM 0 HB3 LEU A 98 0.018 13.862 2.810 1.00 33.23 H new ATOM 0 HG LEU A 98 -0.725 16.042 0.838 1.00 53.01 H new ATOM 0 HD11 LEU A 98 -1.494 14.157 -0.558 1.00 30.41 H new ATOM 0 HD12 LEU A 98 0.250 14.058 -0.219 1.00 30.41 H new ATOM 0 HD13 LEU A 98 -0.888 13.013 0.663 1.00 30.41 H new ATOM 0 HD21 LEU A 98 -3.028 15.190 1.068 1.00 2.43 H new ATOM 0 HD22 LEU A 98 -2.485 14.083 2.352 1.00 2.43 H new ATOM 0 HD23 LEU A 98 -2.409 15.844 2.603 1.00 2.43 H new ATOM 1425 N GLY A 99 2.360 15.774 4.502 1.00 3.11 N ATOM 1426 CA GLY A 99 3.391 15.367 5.462 1.00 43.33 C ATOM 1427 C GLY A 99 3.662 13.864 5.534 1.00 42.32 C ATOM 1428 O GLY A 99 4.818 13.443 5.555 1.00 41.33 O ATOM 0 H GLY A 99 2.710 16.335 3.726 1.00 3.11 H new ATOM 0 HA2 GLY A 99 4.321 15.875 5.208 1.00 43.33 H new ATOM 0 HA3 GLY A 99 3.098 15.714 6.453 1.00 43.33 H new ATOM 1432 N GLN A 100 2.618 13.069 5.567 1.00 43.12 N ATOM 1433 CA GLN A 100 2.754 11.635 5.665 1.00 23.41 C ATOM 1434 C GLN A 100 1.551 10.952 5.040 1.00 2.52 C ATOM 1435 O GLN A 100 0.469 11.538 4.962 1.00 51.13 O ATOM 1436 CB GLN A 100 2.922 11.207 7.130 1.00 41.03 C ATOM 1437 CG GLN A 100 1.770 11.617 8.036 1.00 45.42 C ATOM 1438 CD GLN A 100 2.070 11.374 9.500 1.00 53.24 C ATOM 1439 OE1 GLN A 100 2.598 12.249 10.191 1.00 73.12 O ATOM 1440 NE2 GLN A 100 1.748 10.189 9.982 1.00 3.03 N ATOM 0 H GLN A 100 1.653 13.397 5.527 1.00 43.12 H new ATOM 0 HA GLN A 100 3.647 11.331 5.120 1.00 23.41 H new ATOM 0 HB2 GLN A 100 3.033 10.123 7.170 1.00 41.03 H new ATOM 0 HB3 GLN A 100 3.846 11.636 7.519 1.00 41.03 H new ATOM 0 HG2 GLN A 100 1.551 12.674 7.884 1.00 45.42 H new ATOM 0 HG3 GLN A 100 0.875 11.062 7.755 1.00 45.42 H new ATOM 0 HE21 GLN A 100 1.313 9.493 9.376 1.00 3.03 H new ATOM 0 HE22 GLN A 100 1.934 9.969 10.960 1.00 3.03 H new ATOM 1449 N VAL A 101 1.743 9.722 4.612 1.00 63.25 N ATOM 1450 CA VAL A 101 0.680 8.941 3.988 1.00 52.12 C ATOM 1451 C VAL A 101 0.827 7.481 4.381 1.00 45.40 C ATOM 1452 O VAL A 101 1.940 6.966 4.445 1.00 53.11 O ATOM 1453 CB VAL A 101 0.685 9.063 2.431 1.00 41.22 C ATOM 1454 CG1 VAL A 101 -0.429 8.223 1.813 1.00 30.25 C ATOM 1455 CG2 VAL A 101 0.546 10.518 1.991 1.00 64.45 C ATOM 0 H VAL A 101 2.634 9.231 4.683 1.00 63.25 H new ATOM 0 HA VAL A 101 -0.270 9.340 4.344 1.00 52.12 H new ATOM 0 HB VAL A 101 1.644 8.685 2.078 1.00 41.22 H new ATOM 0 HG11 VAL A 101 -0.403 8.326 0.728 1.00 30.25 H new ATOM 0 HG12 VAL A 101 -0.287 7.176 2.082 1.00 30.25 H new ATOM 0 HG13 VAL A 101 -1.394 8.566 2.187 1.00 30.25 H new ATOM 0 HG21 VAL A 101 0.553 10.571 0.902 1.00 64.45 H new ATOM 0 HG22 VAL A 101 -0.392 10.924 2.368 1.00 64.45 H new ATOM 0 HG23 VAL A 101 1.378 11.099 2.388 1.00 64.45 H new ATOM 1465 N HIS A 102 -0.286 6.817 4.638 1.00 4.42 N ATOM 1466 CA HIS A 102 -0.263 5.417 5.020 1.00 23.32 C ATOM 1467 C HIS A 102 -0.842 4.582 3.896 1.00 2.50 C ATOM 1468 O HIS A 102 -2.042 4.649 3.621 1.00 25.51 O ATOM 1469 CB HIS A 102 -1.054 5.183 6.322 1.00 35.12 C ATOM 1470 CG HIS A 102 -0.983 3.764 6.841 1.00 11.31 C ATOM 1471 ND1 HIS A 102 -0.277 3.408 7.965 1.00 32.10 N ATOM 1472 CD2 HIS A 102 -1.545 2.616 6.380 1.00 1.22 C ATOM 1473 CE1 HIS A 102 -0.400 2.113 8.172 1.00 70.34 C ATOM 1474 NE2 HIS A 102 -1.167 1.606 7.225 1.00 41.54 N ATOM 0 H HIS A 102 -1.219 7.226 4.589 1.00 4.42 H new ATOM 0 HA HIS A 102 0.770 5.120 5.202 1.00 23.32 H new ATOM 0 HB2 HIS A 102 -0.677 5.859 7.090 1.00 35.12 H new ATOM 0 HB3 HIS A 102 -2.098 5.445 6.152 1.00 35.12 H new ATOM 0 HD2 HIS A 102 -2.174 2.518 5.508 1.00 1.22 H new ATOM 0 HE1 HIS A 102 0.051 1.559 8.981 1.00 70.34 H new ATOM 0 HE2 HIS A 102 -1.434 0.625 7.137 1.00 41.54 H new ATOM 1483 N ILE A 103 0.003 3.826 3.232 1.00 5.30 N ATOM 1484 CA ILE A 103 -0.442 2.979 2.145 1.00 14.24 C ATOM 1485 C ILE A 103 -0.669 1.553 2.636 1.00 4.32 C ATOM 1486 O ILE A 103 0.209 0.955 3.265 1.00 1.44 O ATOM 1487 CB ILE A 103 0.568 2.970 0.956 1.00 11.22 C ATOM 1488 CG1 ILE A 103 0.726 4.379 0.355 1.00 63.21 C ATOM 1489 CG2 ILE A 103 0.131 1.985 -0.122 1.00 53.43 C ATOM 1490 CD1 ILE A 103 1.734 5.253 1.076 1.00 44.14 C ATOM 0 H ILE A 103 1.004 3.779 3.425 1.00 5.30 H new ATOM 0 HA ILE A 103 -1.382 3.394 1.783 1.00 14.24 H new ATOM 0 HB ILE A 103 1.535 2.651 1.346 1.00 11.22 H new ATOM 0 HG12 ILE A 103 1.025 4.285 -0.689 1.00 63.21 H new ATOM 0 HG13 ILE A 103 -0.243 4.877 0.366 1.00 63.21 H new ATOM 0 HG21 ILE A 103 0.851 1.997 -0.940 1.00 53.43 H new ATOM 0 HG22 ILE A 103 0.080 0.982 0.301 1.00 53.43 H new ATOM 0 HG23 ILE A 103 -0.851 2.270 -0.499 1.00 53.43 H new ATOM 0 HD11 ILE A 103 1.784 6.227 0.590 1.00 44.14 H new ATOM 0 HD12 ILE A 103 1.428 5.381 2.114 1.00 44.14 H new ATOM 0 HD13 ILE A 103 2.715 4.780 1.043 1.00 44.14 H new ATOM 1502 N SER A 104 -1.858 1.040 2.381 1.00 62.12 N ATOM 1503 CA SER A 104 -2.211 -0.312 2.744 1.00 52.03 C ATOM 1504 C SER A 104 -2.114 -1.205 1.507 1.00 25.13 C ATOM 1505 O SER A 104 -2.048 -0.704 0.379 1.00 4.11 O ATOM 1506 CB SER A 104 -3.628 -0.348 3.328 1.00 64.44 C ATOM 1507 OG SER A 104 -3.910 -1.602 3.931 1.00 55.44 O ATOM 0 H SER A 104 -2.606 1.554 1.915 1.00 62.12 H new ATOM 0 HA SER A 104 -1.522 -0.680 3.504 1.00 52.03 H new ATOM 0 HB2 SER A 104 -3.738 0.445 4.067 1.00 64.44 H new ATOM 0 HB3 SER A 104 -4.353 -0.151 2.538 1.00 64.44 H new ATOM 0 HG SER A 104 -4.820 -1.593 4.295 1.00 55.44 H new ATOM 1513 N LEU A 105 -2.132 -2.509 1.707 1.00 14.44 N ATOM 1514 CA LEU A 105 -1.964 -3.444 0.613 1.00 32.45 C ATOM 1515 C LEU A 105 -2.666 -4.758 0.919 1.00 20.31 C ATOM 1516 O LEU A 105 -2.276 -5.477 1.844 1.00 12.52 O ATOM 1517 CB LEU A 105 -0.477 -3.689 0.334 1.00 24.02 C ATOM 1518 CG LEU A 105 -0.160 -4.678 -0.795 1.00 60.21 C ATOM 1519 CD1 LEU A 105 -0.714 -4.183 -2.122 1.00 1.04 C ATOM 1520 CD2 LEU A 105 1.337 -4.906 -0.894 1.00 53.14 C ATOM 0 H LEU A 105 -2.262 -2.945 2.620 1.00 14.44 H new ATOM 0 HA LEU A 105 -2.416 -3.008 -0.278 1.00 32.45 H new ATOM 0 HB2 LEU A 105 -0.010 -2.733 0.095 1.00 24.02 H new ATOM 0 HB3 LEU A 105 -0.011 -4.052 1.250 1.00 24.02 H new ATOM 0 HG LEU A 105 -0.641 -5.628 -0.561 1.00 60.21 H new ATOM 0 HD11 LEU A 105 -0.476 -4.902 -2.906 1.00 1.04 H new ATOM 0 HD12 LEU A 105 -1.796 -4.073 -2.046 1.00 1.04 H new ATOM 0 HD13 LEU A 105 -0.268 -3.219 -2.366 1.00 1.04 H new ATOM 0 HD21 LEU A 105 1.545 -5.610 -1.700 1.00 53.14 H new ATOM 0 HD22 LEU A 105 1.836 -3.959 -1.101 1.00 53.14 H new ATOM 0 HD23 LEU A 105 1.706 -5.313 0.048 1.00 53.14 H new ATOM 1532 N LYS A 106 -3.699 -5.067 0.167 1.00 12.34 N ATOM 1533 CA LYS A 106 -4.407 -6.323 0.340 1.00 0.13 C ATOM 1534 C LYS A 106 -4.252 -7.171 -0.906 1.00 44.41 C ATOM 1535 O LYS A 106 -4.306 -6.658 -2.020 1.00 74.22 O ATOM 1536 CB LYS A 106 -5.891 -6.083 0.629 1.00 50.13 C ATOM 1537 CG LYS A 106 -6.703 -7.368 0.764 1.00 0.54 C ATOM 1538 CD LYS A 106 -8.192 -7.089 0.866 1.00 23.14 C ATOM 1539 CE LYS A 106 -8.541 -6.327 2.133 1.00 72.05 C ATOM 1540 NZ LYS A 106 -9.978 -5.977 2.175 1.00 30.21 N ATOM 0 H LYS A 106 -4.070 -4.468 -0.571 1.00 12.34 H new ATOM 0 HA LYS A 106 -3.977 -6.847 1.193 1.00 0.13 H new ATOM 0 HB2 LYS A 106 -5.985 -5.506 1.549 1.00 50.13 H new ATOM 0 HB3 LYS A 106 -6.315 -5.478 -0.172 1.00 50.13 H new ATOM 0 HG2 LYS A 106 -6.512 -8.010 -0.096 1.00 0.54 H new ATOM 0 HG3 LYS A 106 -6.375 -7.914 1.649 1.00 0.54 H new ATOM 0 HD2 LYS A 106 -8.514 -6.515 -0.003 1.00 23.14 H new ATOM 0 HD3 LYS A 106 -8.740 -8.031 0.847 1.00 23.14 H new ATOM 0 HE2 LYS A 106 -8.287 -6.931 3.004 1.00 72.05 H new ATOM 0 HE3 LYS A 106 -7.942 -5.418 2.189 1.00 72.05 H new ATOM 0 HZ1 LYS A 106 -10.187 -5.472 3.060 1.00 30.21 H new ATOM 0 HZ2 LYS A 106 -10.210 -5.367 1.366 1.00 30.21 H new ATOM 0 HZ3 LYS A 106 -10.548 -6.845 2.129 1.00 30.21 H new ATOM 1554 N LEU A 107 -4.068 -8.459 -0.724 1.00 70.54 N ATOM 1555 CA LEU A 107 -3.897 -9.362 -1.837 1.00 11.10 C ATOM 1556 C LEU A 107 -4.750 -10.601 -1.632 1.00 5.03 C ATOM 1557 O LEU A 107 -4.435 -11.445 -0.796 1.00 62.21 O ATOM 1558 CB LEU A 107 -2.420 -9.745 -2.003 1.00 5.24 C ATOM 1559 CG LEU A 107 -2.091 -10.665 -3.187 1.00 21.20 C ATOM 1560 CD1 LEU A 107 -2.473 -10.010 -4.505 1.00 40.15 C ATOM 1561 CD2 LEU A 107 -0.616 -11.027 -3.183 1.00 13.12 C ATOM 0 H LEU A 107 -4.033 -8.906 0.192 1.00 70.54 H new ATOM 0 HA LEU A 107 -4.219 -8.859 -2.749 1.00 11.10 H new ATOM 0 HB2 LEU A 107 -1.838 -8.830 -2.107 1.00 5.24 H new ATOM 0 HB3 LEU A 107 -2.087 -10.232 -1.087 1.00 5.24 H new ATOM 0 HG LEU A 107 -2.675 -11.579 -3.080 1.00 21.20 H new ATOM 0 HD11 LEU A 107 -2.230 -10.681 -5.329 1.00 40.15 H new ATOM 0 HD12 LEU A 107 -3.543 -9.801 -4.511 1.00 40.15 H new ATOM 0 HD13 LEU A 107 -1.920 -9.078 -4.622 1.00 40.15 H new ATOM 0 HD21 LEU A 107 -0.399 -11.680 -4.029 1.00 13.12 H new ATOM 0 HD22 LEU A 107 -0.018 -10.119 -3.263 1.00 13.12 H new ATOM 0 HD23 LEU A 107 -0.370 -11.543 -2.255 1.00 13.12 H new ATOM 1573 N ASP A 108 -5.830 -10.708 -2.377 1.00 11.14 N ATOM 1574 CA ASP A 108 -6.716 -11.854 -2.266 1.00 10.03 C ATOM 1575 C ASP A 108 -6.625 -12.664 -3.533 1.00 14.24 C ATOM 1576 O ASP A 108 -6.734 -12.106 -4.622 1.00 54.40 O ATOM 1577 CB ASP A 108 -8.167 -11.413 -2.027 1.00 2.32 C ATOM 1578 CG ASP A 108 -9.145 -12.582 -2.056 1.00 50.31 C ATOM 1579 OD1 ASP A 108 -9.295 -13.272 -1.024 1.00 43.14 O ATOM 1580 OD2 ASP A 108 -9.769 -12.814 -3.106 1.00 14.50 O ATOM 0 H ASP A 108 -6.118 -10.015 -3.068 1.00 11.14 H new ATOM 0 HA ASP A 108 -6.408 -12.457 -1.412 1.00 10.03 H new ATOM 0 HB2 ASP A 108 -8.236 -10.910 -1.063 1.00 2.32 H new ATOM 0 HB3 ASP A 108 -8.452 -10.686 -2.787 1.00 2.32 H new ATOM 1585 N ASP A 109 -6.449 -13.971 -3.382 1.00 33.42 N ATOM 1586 CA ASP A 109 -6.273 -14.905 -4.504 1.00 13.31 C ATOM 1587 C ASP A 109 -5.178 -14.444 -5.482 1.00 61.52 C ATOM 1588 O ASP A 109 -4.025 -14.868 -5.380 1.00 43.24 O ATOM 1589 CB ASP A 109 -7.599 -15.143 -5.238 1.00 14.02 C ATOM 1590 CG ASP A 109 -7.525 -16.314 -6.195 1.00 44.44 C ATOM 1591 OD1 ASP A 109 -7.103 -16.119 -7.349 1.00 55.22 O ATOM 1592 OD2 ASP A 109 -7.890 -17.440 -5.794 1.00 32.43 O ATOM 0 H ASP A 109 -6.423 -14.425 -2.469 1.00 33.42 H new ATOM 0 HA ASP A 109 -5.942 -15.852 -4.078 1.00 13.31 H new ATOM 0 HB2 ASP A 109 -8.388 -15.323 -4.508 1.00 14.02 H new ATOM 0 HB3 ASP A 109 -7.873 -14.243 -5.789 1.00 14.02 H new ATOM 1597 N ASN A 110 -5.543 -13.580 -6.421 1.00 25.40 N ATOM 1598 CA ASN A 110 -4.599 -13.054 -7.395 1.00 11.43 C ATOM 1599 C ASN A 110 -5.005 -11.630 -7.799 1.00 41.12 C ATOM 1600 O ASN A 110 -4.745 -11.179 -8.914 1.00 35.23 O ATOM 1601 CB ASN A 110 -4.538 -13.977 -8.628 1.00 62.45 C ATOM 1602 CG ASN A 110 -3.370 -13.663 -9.565 1.00 64.43 C ATOM 1603 OD1 ASN A 110 -3.473 -13.834 -10.782 1.00 31.30 O ATOM 1604 ND2 ASN A 110 -2.251 -13.228 -9.008 1.00 32.33 N ATOM 0 H ASN A 110 -6.494 -13.227 -6.528 1.00 25.40 H new ATOM 0 HA ASN A 110 -3.606 -13.017 -6.948 1.00 11.43 H new ATOM 0 HB2 ASN A 110 -4.458 -15.012 -8.294 1.00 62.45 H new ATOM 0 HB3 ASN A 110 -5.472 -13.892 -9.183 1.00 62.45 H new ATOM 0 HD21 ASN A 110 -1.438 -13.023 -9.589 1.00 32.33 H new ATOM 0 HD22 ASN A 110 -2.201 -13.098 -7.998 1.00 32.33 H new ATOM 1611 N GLN A 111 -5.607 -10.915 -6.863 1.00 45.34 N ATOM 1612 CA GLN A 111 -6.030 -9.544 -7.097 1.00 74.22 C ATOM 1613 C GLN A 111 -5.641 -8.685 -5.907 1.00 73.34 C ATOM 1614 O GLN A 111 -5.790 -9.102 -4.751 1.00 72.35 O ATOM 1615 CB GLN A 111 -7.549 -9.454 -7.398 1.00 22.05 C ATOM 1616 CG GLN A 111 -8.478 -9.794 -6.229 1.00 63.35 C ATOM 1617 CD GLN A 111 -9.047 -8.556 -5.538 1.00 64.44 C ATOM 1618 OE1 GLN A 111 -10.095 -8.042 -5.924 1.00 61.05 O ATOM 1619 NE2 GLN A 111 -8.369 -8.079 -4.514 1.00 22.42 N ATOM 0 H GLN A 111 -5.815 -11.264 -5.928 1.00 45.34 H new ATOM 0 HA GLN A 111 -5.520 -9.167 -7.983 1.00 74.22 H new ATOM 0 HB2 GLN A 111 -7.775 -8.442 -7.735 1.00 22.05 H new ATOM 0 HB3 GLN A 111 -7.777 -10.125 -8.226 1.00 22.05 H new ATOM 0 HG2 GLN A 111 -9.300 -10.410 -6.593 1.00 63.35 H new ATOM 0 HG3 GLN A 111 -7.931 -10.391 -5.499 1.00 63.35 H new ATOM 0 HE21 GLN A 111 -7.503 -8.531 -4.221 1.00 22.42 H new ATOM 0 HE22 GLN A 111 -8.710 -7.258 -4.014 1.00 22.42 H new ATOM 1628 N ALA A 112 -5.129 -7.510 -6.178 1.00 20.21 N ATOM 1629 CA ALA A 112 -4.665 -6.635 -5.124 1.00 64.43 C ATOM 1630 C ALA A 112 -5.572 -5.432 -4.948 1.00 41.14 C ATOM 1631 O ALA A 112 -6.006 -4.816 -5.923 1.00 70.34 O ATOM 1632 CB ALA A 112 -3.240 -6.188 -5.396 1.00 64.32 C ATOM 0 H ALA A 112 -5.022 -7.135 -7.120 1.00 20.21 H new ATOM 0 HA ALA A 112 -4.688 -7.202 -4.193 1.00 64.43 H new ATOM 0 HB1 ALA A 112 -2.906 -5.530 -4.594 1.00 64.32 H new ATOM 0 HB2 ALA A 112 -2.588 -7.060 -5.445 1.00 64.32 H new ATOM 0 HB3 ALA A 112 -3.202 -5.652 -6.344 1.00 64.32 H new ATOM 1638 N GLN A 113 -5.882 -5.134 -3.703 1.00 23.51 N ATOM 1639 CA GLN A 113 -6.670 -3.971 -3.360 1.00 10.23 C ATOM 1640 C GLN A 113 -5.789 -2.928 -2.698 1.00 1.15 C ATOM 1641 O GLN A 113 -5.256 -3.154 -1.604 1.00 55.24 O ATOM 1642 CB GLN A 113 -7.826 -4.346 -2.428 1.00 65.01 C ATOM 1643 CG GLN A 113 -8.671 -3.154 -1.992 1.00 33.52 C ATOM 1644 CD GLN A 113 -9.737 -3.525 -0.981 1.00 24.53 C ATOM 1645 OE1 GLN A 113 -9.565 -4.446 -0.189 1.00 23.12 O ATOM 1646 NE2 GLN A 113 -10.840 -2.810 -1.000 1.00 63.32 N ATOM 0 H GLN A 113 -5.594 -5.693 -2.900 1.00 23.51 H new ATOM 0 HA GLN A 113 -7.091 -3.560 -4.278 1.00 10.23 H new ATOM 0 HB2 GLN A 113 -8.467 -5.070 -2.931 1.00 65.01 H new ATOM 0 HB3 GLN A 113 -7.423 -4.838 -1.543 1.00 65.01 H new ATOM 0 HG2 GLN A 113 -8.021 -2.391 -1.563 1.00 33.52 H new ATOM 0 HG3 GLN A 113 -9.146 -2.712 -2.868 1.00 33.52 H new ATOM 0 HE21 GLN A 113 -10.945 -2.052 -1.674 1.00 63.32 H new ATOM 0 HE22 GLN A 113 -11.591 -3.013 -0.340 1.00 63.32 H new ATOM 1655 N LEU A 114 -5.624 -1.805 -3.359 1.00 24.41 N ATOM 1656 CA LEU A 114 -4.815 -0.727 -2.825 1.00 63.50 C ATOM 1657 C LEU A 114 -5.678 0.272 -2.085 1.00 41.22 C ATOM 1658 O LEU A 114 -6.792 0.594 -2.522 1.00 32.24 O ATOM 1659 CB LEU A 114 -4.013 -0.029 -3.931 1.00 0.03 C ATOM 1660 CG LEU A 114 -2.604 -0.588 -4.209 1.00 53.33 C ATOM 1661 CD1 LEU A 114 -1.698 -0.395 -3.002 1.00 32.21 C ATOM 1662 CD2 LEU A 114 -2.665 -2.054 -4.595 1.00 21.11 C ATOM 0 H LEU A 114 -6.040 -1.612 -4.270 1.00 24.41 H new ATOM 0 HA LEU A 114 -4.105 -1.162 -2.121 1.00 63.50 H new ATOM 0 HB2 LEU A 114 -4.589 -0.079 -4.855 1.00 0.03 H new ATOM 0 HB3 LEU A 114 -3.918 1.025 -3.671 1.00 0.03 H new ATOM 0 HG LEU A 114 -2.185 -0.032 -5.048 1.00 53.33 H new ATOM 0 HD11 LEU A 114 -0.709 -0.797 -3.221 1.00 32.21 H new ATOM 0 HD12 LEU A 114 -1.615 0.668 -2.775 1.00 32.21 H new ATOM 0 HD13 LEU A 114 -2.120 -0.917 -2.143 1.00 32.21 H new ATOM 0 HD21 LEU A 114 -1.657 -2.422 -4.785 1.00 21.11 H new ATOM 0 HD22 LEU A 114 -3.113 -2.626 -3.782 1.00 21.11 H new ATOM 0 HD23 LEU A 114 -3.269 -2.168 -5.495 1.00 21.11 H new ATOM 1674 N GLN A 115 -5.165 0.749 -0.960 1.00 54.04 N ATOM 1675 CA GLN A 115 -5.875 1.692 -0.111 1.00 33.04 C ATOM 1676 C GLN A 115 -4.888 2.677 0.494 1.00 65.52 C ATOM 1677 O GLN A 115 -3.783 2.295 0.885 1.00 73.14 O ATOM 1678 CB GLN A 115 -6.605 0.945 1.012 1.00 12.11 C ATOM 1679 CG GLN A 115 -7.652 -0.044 0.530 1.00 34.52 C ATOM 1680 CD GLN A 115 -8.044 -1.031 1.601 1.00 1.34 C ATOM 1681 OE1 GLN A 115 -8.967 -0.796 2.378 1.00 53.05 O ATOM 1682 NE2 GLN A 115 -7.342 -2.145 1.653 1.00 73.31 N ATOM 0 H GLN A 115 -4.242 0.492 -0.610 1.00 54.04 H new ATOM 0 HA GLN A 115 -6.606 2.231 -0.714 1.00 33.04 H new ATOM 0 HB2 GLN A 115 -5.870 0.412 1.615 1.00 12.11 H new ATOM 0 HB3 GLN A 115 -7.085 1.674 1.665 1.00 12.11 H new ATOM 0 HG2 GLN A 115 -8.537 0.500 0.199 1.00 34.52 H new ATOM 0 HG3 GLN A 115 -7.267 -0.584 -0.335 1.00 34.52 H new ATOM 0 HE21 GLN A 115 -6.584 -2.301 0.989 1.00 73.31 H new ATOM 0 HE22 GLN A 115 -7.557 -2.851 2.357 1.00 73.31 H new ATOM 1691 N MET A 116 -5.277 3.936 0.573 1.00 41.12 N ATOM 1692 CA MET A 116 -4.408 4.972 1.112 1.00 2.42 C ATOM 1693 C MET A 116 -5.198 5.880 2.032 1.00 45.22 C ATOM 1694 O MET A 116 -6.409 6.044 1.860 1.00 52.22 O ATOM 1695 CB MET A 116 -3.757 5.814 -0.006 1.00 70.43 C ATOM 1696 CG MET A 116 -2.912 5.022 -0.998 1.00 61.10 C ATOM 1697 SD MET A 116 -3.906 4.183 -2.251 1.00 65.20 S ATOM 1698 CE MET A 116 -2.631 3.369 -3.194 1.00 22.34 C ATOM 0 H MET A 116 -6.192 4.269 0.270 1.00 41.12 H new ATOM 0 HA MET A 116 -3.612 4.477 1.669 1.00 2.42 H new ATOM 0 HB2 MET A 116 -4.543 6.333 -0.554 1.00 70.43 H new ATOM 0 HB3 MET A 116 -3.130 6.579 0.453 1.00 70.43 H new ATOM 0 HG2 MET A 116 -2.210 5.696 -1.489 1.00 61.10 H new ATOM 0 HG3 MET A 116 -2.320 4.284 -0.456 1.00 61.10 H new ATOM 0 HE1 MET A 116 -3.087 2.669 -3.894 1.00 22.34 H new ATOM 0 HE2 MET A 116 -2.057 4.112 -3.747 1.00 22.34 H new ATOM 0 HE3 MET A 116 -1.969 2.827 -2.519 1.00 22.34 H new ATOM 1708 N VAL A 117 -4.529 6.443 3.016 1.00 43.25 N ATOM 1709 CA VAL A 117 -5.167 7.363 3.942 1.00 55.04 C ATOM 1710 C VAL A 117 -4.722 8.794 3.658 1.00 63.03 C ATOM 1711 O VAL A 117 -3.568 9.153 3.917 1.00 54.54 O ATOM 1712 CB VAL A 117 -4.828 7.007 5.409 1.00 53.11 C ATOM 1713 CG1 VAL A 117 -5.486 7.982 6.366 1.00 41.44 C ATOM 1714 CG2 VAL A 117 -5.252 5.585 5.726 1.00 63.15 C ATOM 0 H VAL A 117 -3.539 6.280 3.198 1.00 43.25 H new ATOM 0 HA VAL A 117 -6.244 7.278 3.801 1.00 55.04 H new ATOM 0 HB VAL A 117 -3.748 7.081 5.534 1.00 53.11 H new ATOM 0 HG11 VAL A 117 -5.234 7.712 7.391 1.00 41.44 H new ATOM 0 HG12 VAL A 117 -5.130 8.991 6.159 1.00 41.44 H new ATOM 0 HG13 VAL A 117 -6.568 7.945 6.237 1.00 41.44 H new ATOM 0 HG21 VAL A 117 -5.005 5.354 6.762 1.00 63.15 H new ATOM 0 HG22 VAL A 117 -6.327 5.484 5.578 1.00 63.15 H new ATOM 0 HG23 VAL A 117 -4.729 4.894 5.066 1.00 63.15 H new ATOM 1724 N SER A 118 -5.626 9.597 3.114 1.00 21.54 N ATOM 1725 CA SER A 118 -5.331 10.986 2.798 1.00 24.11 C ATOM 1726 C SER A 118 -6.631 11.784 2.630 1.00 61.32 C ATOM 1727 O SER A 118 -7.618 11.254 2.119 1.00 52.33 O ATOM 1728 CB SER A 118 -4.497 11.057 1.511 1.00 31.34 C ATOM 1729 OG SER A 118 -5.113 10.316 0.466 1.00 13.54 O ATOM 0 H SER A 118 -6.576 9.307 2.881 1.00 21.54 H new ATOM 0 HA SER A 118 -4.762 11.423 3.619 1.00 24.11 H new ATOM 0 HB2 SER A 118 -4.381 12.097 1.205 1.00 31.34 H new ATOM 0 HB3 SER A 118 -3.497 10.666 1.699 1.00 31.34 H new ATOM 0 HG SER A 118 -4.566 10.377 -0.345 1.00 13.54 H new ATOM 1735 N PRO A 119 -6.648 13.062 3.080 1.00 45.54 N ATOM 1736 CA PRO A 119 -7.824 13.951 2.958 1.00 11.42 C ATOM 1737 C PRO A 119 -8.307 14.102 1.508 1.00 13.02 C ATOM 1738 O PRO A 119 -7.661 13.627 0.569 1.00 53.33 O ATOM 1739 CB PRO A 119 -7.311 15.297 3.486 1.00 34.53 C ATOM 1740 CG PRO A 119 -6.170 14.945 4.372 1.00 14.21 C ATOM 1741 CD PRO A 119 -5.524 13.740 3.753 1.00 2.40 C ATOM 0 HA PRO A 119 -8.682 13.557 3.503 1.00 11.42 H new ATOM 0 HB2 PRO A 119 -6.993 15.947 2.671 1.00 34.53 H new ATOM 0 HB3 PRO A 119 -8.088 15.830 4.034 1.00 34.53 H new ATOM 0 HG2 PRO A 119 -5.464 15.772 4.446 1.00 14.21 H new ATOM 0 HG3 PRO A 119 -6.514 14.728 5.383 1.00 14.21 H new ATOM 0 HD2 PRO A 119 -4.742 14.020 3.047 1.00 2.40 H new ATOM 0 HD3 PRO A 119 -5.060 13.101 4.505 1.00 2.40 H new ATOM 1749 N HIS A 120 -9.418 14.795 1.321 1.00 70.05 N ATOM 1750 CA HIS A 120 -9.991 14.958 -0.006 1.00 61.44 C ATOM 1751 C HIS A 120 -9.345 16.147 -0.696 1.00 64.22 C ATOM 1752 O HIS A 120 -9.462 17.284 -0.236 1.00 73.34 O ATOM 1753 CB HIS A 120 -11.513 15.166 0.099 1.00 1.01 C ATOM 1754 CG HIS A 120 -12.232 15.170 -1.224 1.00 64.44 C ATOM 1755 ND1 HIS A 120 -13.053 14.148 -1.630 1.00 63.21 N ATOM 1756 CD2 HIS A 120 -12.252 16.082 -2.226 1.00 14.04 C ATOM 1757 CE1 HIS A 120 -13.544 14.423 -2.821 1.00 73.01 C ATOM 1758 NE2 HIS A 120 -13.074 15.592 -3.206 1.00 42.23 N ATOM 0 H HIS A 120 -9.940 15.253 2.068 1.00 70.05 H new ATOM 0 HA HIS A 120 -9.802 14.059 -0.593 1.00 61.44 H new ATOM 0 HB2 HIS A 120 -11.933 14.378 0.725 1.00 1.01 H new ATOM 0 HB3 HIS A 120 -11.704 16.112 0.606 1.00 1.01 H new ATOM 0 HD2 HIS A 120 -11.719 17.021 -2.248 1.00 14.04 H new ATOM 0 HE1 HIS A 120 -14.218 13.796 -3.386 1.00 73.01 H new ATOM 0 HE2 HIS A 120 -13.287 16.056 -4.089 1.00 42.23 H new ATOM 1767 N SER A 121 -8.667 15.878 -1.796 1.00 21.43 N ATOM 1768 CA SER A 121 -7.946 16.901 -2.521 1.00 4.15 C ATOM 1769 C SER A 121 -7.736 16.487 -3.980 1.00 15.03 C ATOM 1770 O SER A 121 -7.987 15.337 -4.350 1.00 53.31 O ATOM 1771 CB SER A 121 -6.603 17.148 -1.836 1.00 11.20 C ATOM 1772 OG SER A 121 -5.953 15.917 -1.558 1.00 63.31 O ATOM 0 H SER A 121 -8.602 14.948 -2.209 1.00 21.43 H new ATOM 0 HA SER A 121 -8.530 17.821 -2.517 1.00 4.15 H new ATOM 0 HB2 SER A 121 -5.970 17.764 -2.475 1.00 11.20 H new ATOM 0 HB3 SER A 121 -6.757 17.702 -0.910 1.00 11.20 H new ATOM 0 HG SER A 121 -5.094 16.092 -1.121 1.00 63.31 H new ATOM 1778 N HIS A 122 -7.262 17.419 -4.798 1.00 50.30 N ATOM 1779 CA HIS A 122 -7.043 17.156 -6.214 1.00 53.31 C ATOM 1780 C HIS A 122 -5.928 16.130 -6.418 1.00 42.21 C ATOM 1781 O HIS A 122 -5.938 15.371 -7.389 1.00 32.24 O ATOM 1782 CB HIS A 122 -6.721 18.457 -6.959 1.00 2.32 C ATOM 1783 CG HIS A 122 -6.684 18.310 -8.453 1.00 33.10 C ATOM 1784 ND1 HIS A 122 -5.575 18.603 -9.213 1.00 1.12 N ATOM 1785 CD2 HIS A 122 -7.636 17.905 -9.325 1.00 32.23 C ATOM 1786 CE1 HIS A 122 -5.845 18.383 -10.485 1.00 43.14 C ATOM 1787 NE2 HIS A 122 -7.087 17.961 -10.579 1.00 35.10 N ATOM 0 H HIS A 122 -7.022 18.366 -4.504 1.00 50.30 H new ATOM 0 HA HIS A 122 -7.962 16.739 -6.625 1.00 53.31 H new ATOM 0 HB2 HIS A 122 -7.466 19.208 -6.696 1.00 2.32 H new ATOM 0 HB3 HIS A 122 -5.756 18.831 -6.617 1.00 2.32 H new ATOM 0 HD2 HIS A 122 -8.641 17.595 -9.079 1.00 32.23 H new ATOM 0 HE1 HIS A 122 -5.162 18.525 -11.309 1.00 43.14 H new ATOM 0 HE2 HIS A 122 -7.565 17.715 -11.446 1.00 35.10 H new ATOM 1796 N VAL A 123 -4.975 16.099 -5.493 1.00 64.53 N ATOM 1797 CA VAL A 123 -3.874 15.147 -5.574 1.00 21.21 C ATOM 1798 C VAL A 123 -4.367 13.728 -5.323 1.00 34.31 C ATOM 1799 O VAL A 123 -3.849 12.774 -5.891 1.00 44.02 O ATOM 1800 CB VAL A 123 -2.730 15.488 -4.586 1.00 52.53 C ATOM 1801 CG1 VAL A 123 -2.144 16.847 -4.912 1.00 0.42 C ATOM 1802 CG2 VAL A 123 -3.212 15.452 -3.143 1.00 15.22 C ATOM 0 H VAL A 123 -4.942 16.718 -4.683 1.00 64.53 H new ATOM 0 HA VAL A 123 -3.473 15.216 -6.585 1.00 21.21 H new ATOM 0 HB VAL A 123 -1.954 14.730 -4.697 1.00 52.53 H new ATOM 0 HG11 VAL A 123 -1.341 17.075 -4.211 1.00 0.42 H new ATOM 0 HG12 VAL A 123 -1.747 16.838 -5.927 1.00 0.42 H new ATOM 0 HG13 VAL A 123 -2.921 17.607 -4.833 1.00 0.42 H new ATOM 0 HG21 VAL A 123 -2.384 15.696 -2.477 1.00 15.22 H new ATOM 0 HG22 VAL A 123 -4.013 16.179 -3.009 1.00 15.22 H new ATOM 0 HG23 VAL A 123 -3.585 14.455 -2.909 1.00 15.22 H new ATOM 1812 N ARG A 124 -5.395 13.607 -4.495 1.00 2.21 N ATOM 1813 CA ARG A 124 -5.981 12.316 -4.186 1.00 20.23 C ATOM 1814 C ARG A 124 -6.751 11.793 -5.393 1.00 72.21 C ATOM 1815 O ARG A 124 -6.805 10.587 -5.640 1.00 1.31 O ATOM 1816 CB ARG A 124 -6.888 12.424 -2.955 1.00 70.24 C ATOM 1817 CG ARG A 124 -7.743 11.194 -2.690 1.00 30.41 C ATOM 1818 CD ARG A 124 -8.521 11.343 -1.399 1.00 1.22 C ATOM 1819 NE ARG A 124 -9.653 10.419 -1.321 1.00 61.24 N ATOM 1820 CZ ARG A 124 -10.439 10.295 -0.252 1.00 12.01 C ATOM 1821 NH1 ARG A 124 -10.148 10.954 0.868 1.00 73.45 N ATOM 1822 NH2 ARG A 124 -11.498 9.493 -0.295 1.00 22.43 N ATOM 0 H ARG A 124 -5.841 14.394 -4.024 1.00 2.21 H new ATOM 0 HA ARG A 124 -5.185 11.608 -3.954 1.00 20.23 H new ATOM 0 HB2 ARG A 124 -6.268 12.616 -2.079 1.00 70.24 H new ATOM 0 HB3 ARG A 124 -7.543 13.287 -3.077 1.00 70.24 H new ATOM 0 HG2 ARG A 124 -8.433 11.041 -3.519 1.00 30.41 H new ATOM 0 HG3 ARG A 124 -7.108 10.310 -2.636 1.00 30.41 H new ATOM 0 HD2 ARG A 124 -7.855 11.169 -0.554 1.00 1.22 H new ATOM 0 HD3 ARG A 124 -8.885 12.367 -1.313 1.00 1.22 H new ATOM 0 HE ARG A 124 -9.852 9.835 -2.133 1.00 61.24 H new ATOM 0 HH11 ARG A 124 -9.324 11.553 0.907 1.00 73.45 H new ATOM 0 HH12 ARG A 124 -10.749 10.859 1.686 1.00 73.45 H new ATOM 0 HH21 ARG A 124 -11.709 8.972 -1.146 1.00 22.43 H new ATOM 0 HH22 ARG A 124 -12.099 9.398 0.523 1.00 22.43 H new ATOM 1836 N ALA A 125 -7.327 12.715 -6.154 1.00 41.32 N ATOM 1837 CA ALA A 125 -8.045 12.369 -7.366 1.00 41.12 C ATOM 1838 C ALA A 125 -7.089 11.775 -8.391 1.00 71.50 C ATOM 1839 O ALA A 125 -7.374 10.741 -9.002 1.00 61.33 O ATOM 1840 CB ALA A 125 -8.739 13.593 -7.936 1.00 61.54 C ATOM 0 H ALA A 125 -7.308 13.714 -5.948 1.00 41.32 H new ATOM 0 HA ALA A 125 -8.803 11.624 -7.123 1.00 41.12 H new ATOM 0 HB1 ALA A 125 -9.274 13.318 -8.845 1.00 61.54 H new ATOM 0 HB2 ALA A 125 -9.445 13.985 -7.204 1.00 61.54 H new ATOM 0 HB3 ALA A 125 -7.997 14.357 -8.169 1.00 61.54 H new ATOM 1846 N ALA A 126 -5.941 12.428 -8.562 1.00 52.21 N ATOM 1847 CA ALA A 126 -4.922 11.950 -9.488 1.00 64.25 C ATOM 1848 C ALA A 126 -4.268 10.680 -8.961 1.00 51.22 C ATOM 1849 O ALA A 126 -3.801 9.845 -9.735 1.00 34.24 O ATOM 1850 CB ALA A 126 -3.872 13.024 -9.730 1.00 34.22 C ATOM 0 H ALA A 126 -5.696 13.288 -8.071 1.00 52.21 H new ATOM 0 HA ALA A 126 -5.407 11.720 -10.437 1.00 64.25 H new ATOM 0 HB1 ALA A 126 -3.120 12.648 -10.424 1.00 34.22 H new ATOM 0 HB2 ALA A 126 -4.347 13.908 -10.154 1.00 34.22 H new ATOM 0 HB3 ALA A 126 -3.395 13.286 -8.785 1.00 34.22 H new ATOM 1856 N LEU A 127 -4.242 10.542 -7.641 1.00 10.44 N ATOM 1857 CA LEU A 127 -3.705 9.349 -7.000 1.00 61.44 C ATOM 1858 C LEU A 127 -4.597 8.162 -7.317 1.00 5.23 C ATOM 1859 O LEU A 127 -4.124 7.077 -7.643 1.00 53.31 O ATOM 1860 CB LEU A 127 -3.630 9.553 -5.483 1.00 43.01 C ATOM 1861 CG LEU A 127 -2.964 8.431 -4.689 1.00 3.45 C ATOM 1862 CD1 LEU A 127 -1.499 8.313 -5.063 1.00 65.44 C ATOM 1863 CD2 LEU A 127 -3.119 8.669 -3.194 1.00 35.32 C ATOM 0 H LEU A 127 -4.589 11.247 -6.990 1.00 10.44 H new ATOM 0 HA LEU A 127 -2.700 9.160 -7.378 1.00 61.44 H new ATOM 0 HB2 LEU A 127 -3.090 10.480 -5.287 1.00 43.01 H new ATOM 0 HB3 LEU A 127 -4.643 9.688 -5.104 1.00 43.01 H new ATOM 0 HG LEU A 127 -3.458 7.492 -4.938 1.00 3.45 H new ATOM 0 HD11 LEU A 127 -1.040 7.509 -4.488 1.00 65.44 H new ATOM 0 HD12 LEU A 127 -1.412 8.093 -6.127 1.00 65.44 H new ATOM 0 HD13 LEU A 127 -0.991 9.252 -4.843 1.00 65.44 H new ATOM 0 HD21 LEU A 127 -2.638 7.859 -2.645 1.00 35.32 H new ATOM 0 HD22 LEU A 127 -2.652 9.617 -2.926 1.00 35.32 H new ATOM 0 HD23 LEU A 127 -4.178 8.702 -2.939 1.00 35.32 H new ATOM 1875 N GLU A 128 -5.895 8.393 -7.224 1.00 54.11 N ATOM 1876 CA GLU A 128 -6.890 7.388 -7.532 1.00 52.35 C ATOM 1877 C GLU A 128 -6.788 6.998 -9.004 1.00 43.34 C ATOM 1878 O GLU A 128 -6.873 5.826 -9.359 1.00 70.54 O ATOM 1879 CB GLU A 128 -8.279 7.942 -7.217 1.00 73.02 C ATOM 1880 CG GLU A 128 -9.410 6.952 -7.387 1.00 53.22 C ATOM 1881 CD GLU A 128 -10.750 7.574 -7.088 1.00 55.41 C ATOM 1882 OE1 GLU A 128 -11.337 8.198 -7.997 1.00 24.02 O ATOM 1883 OE2 GLU A 128 -11.223 7.457 -5.934 1.00 11.22 O ATOM 0 H GLU A 128 -6.287 9.288 -6.931 1.00 54.11 H new ATOM 0 HA GLU A 128 -6.718 6.498 -6.926 1.00 52.35 H new ATOM 0 HB2 GLU A 128 -8.285 8.306 -6.190 1.00 73.02 H new ATOM 0 HB3 GLU A 128 -8.467 8.801 -7.861 1.00 73.02 H new ATOM 0 HG2 GLU A 128 -9.407 6.569 -8.407 1.00 53.22 H new ATOM 0 HG3 GLU A 128 -9.249 6.100 -6.726 1.00 53.22 H new ATOM 1890 N ALA A 129 -6.607 8.001 -9.853 1.00 64.35 N ATOM 1891 CA ALA A 129 -6.432 7.798 -11.288 1.00 53.43 C ATOM 1892 C ALA A 129 -5.172 6.987 -11.590 1.00 1.40 C ATOM 1893 O ALA A 129 -5.089 6.309 -12.612 1.00 14.51 O ATOM 1894 CB ALA A 129 -6.361 9.147 -11.981 1.00 12.11 C ATOM 0 H ALA A 129 -6.577 8.980 -9.567 1.00 64.35 H new ATOM 0 HA ALA A 129 -7.286 7.233 -11.662 1.00 53.43 H new ATOM 0 HB1 ALA A 129 -6.230 8.999 -13.053 1.00 12.11 H new ATOM 0 HB2 ALA A 129 -7.284 9.698 -11.801 1.00 12.11 H new ATOM 0 HB3 ALA A 129 -5.517 9.714 -11.588 1.00 12.11 H new ATOM 1900 N ALA A 130 -4.200 7.065 -10.703 1.00 4.20 N ATOM 1901 CA ALA A 130 -2.946 6.350 -10.880 1.00 34.13 C ATOM 1902 C ALA A 130 -3.092 4.855 -10.580 1.00 4.42 C ATOM 1903 O ALA A 130 -2.213 4.062 -10.923 1.00 3.04 O ATOM 1904 CB ALA A 130 -1.859 6.966 -10.016 1.00 63.05 C ATOM 0 H ALA A 130 -4.253 7.618 -9.848 1.00 4.20 H new ATOM 0 HA ALA A 130 -2.660 6.443 -11.928 1.00 34.13 H new ATOM 0 HB1 ALA A 130 -0.927 6.420 -10.160 1.00 63.05 H new ATOM 0 HB2 ALA A 130 -1.716 8.009 -10.300 1.00 63.05 H new ATOM 0 HB3 ALA A 130 -2.153 6.912 -8.968 1.00 63.05 H new ATOM 1910 N LEU A 131 -4.203 4.467 -9.969 1.00 34.53 N ATOM 1911 CA LEU A 131 -4.417 3.069 -9.612 1.00 1.02 C ATOM 1912 C LEU A 131 -4.689 2.192 -10.855 1.00 22.13 C ATOM 1913 O LEU A 131 -4.017 1.175 -11.042 1.00 54.52 O ATOM 1914 CB LEU A 131 -5.519 2.916 -8.549 1.00 12.02 C ATOM 1915 CG LEU A 131 -5.277 3.672 -7.237 1.00 53.20 C ATOM 1916 CD1 LEU A 131 -6.420 3.443 -6.266 1.00 21.44 C ATOM 1917 CD2 LEU A 131 -3.954 3.254 -6.613 1.00 75.41 C ATOM 0 H LEU A 131 -4.965 5.094 -9.711 1.00 34.53 H new ATOM 0 HA LEU A 131 -3.490 2.707 -9.167 1.00 1.02 H new ATOM 0 HB2 LEU A 131 -6.462 3.257 -8.976 1.00 12.02 H new ATOM 0 HB3 LEU A 131 -5.636 1.856 -8.322 1.00 12.02 H new ATOM 0 HG LEU A 131 -5.229 4.737 -7.463 1.00 53.20 H new ATOM 0 HD11 LEU A 131 -6.227 3.989 -5.342 1.00 21.44 H new ATOM 0 HD12 LEU A 131 -7.351 3.797 -6.709 1.00 21.44 H new ATOM 0 HD13 LEU A 131 -6.504 2.378 -6.048 1.00 21.44 H new ATOM 0 HD21 LEU A 131 -3.801 3.802 -5.683 1.00 75.41 H new ATOM 0 HD22 LEU A 131 -3.972 2.184 -6.405 1.00 75.41 H new ATOM 0 HD23 LEU A 131 -3.140 3.476 -7.303 1.00 75.41 H new ATOM 1929 N PRO A 132 -5.664 2.567 -11.746 1.00 75.42 N ATOM 1930 CA PRO A 132 -5.920 1.809 -12.981 1.00 75.34 C ATOM 1931 C PRO A 132 -4.681 1.765 -13.869 1.00 64.12 C ATOM 1932 O PRO A 132 -4.539 0.889 -14.717 1.00 30.20 O ATOM 1933 CB PRO A 132 -7.038 2.601 -13.674 1.00 54.21 C ATOM 1934 CG PRO A 132 -7.684 3.379 -12.586 1.00 70.43 C ATOM 1935 CD PRO A 132 -6.591 3.713 -11.617 1.00 44.30 C ATOM 0 HA PRO A 132 -6.187 0.772 -12.780 1.00 75.34 H new ATOM 0 HB2 PRO A 132 -6.637 3.258 -14.446 1.00 54.21 H new ATOM 0 HB3 PRO A 132 -7.751 1.935 -14.161 1.00 54.21 H new ATOM 0 HG2 PRO A 132 -8.150 4.284 -12.976 1.00 70.43 H new ATOM 0 HG3 PRO A 132 -8.470 2.798 -12.104 1.00 70.43 H new ATOM 0 HD2 PRO A 132 -6.104 4.655 -11.868 1.00 44.30 H new ATOM 0 HD3 PRO A 132 -6.971 3.812 -10.600 1.00 44.30 H new ATOM 1943 N MET A 133 -3.802 2.731 -13.680 1.00 70.30 N ATOM 1944 CA MET A 133 -2.552 2.784 -14.411 1.00 42.20 C ATOM 1945 C MET A 133 -1.565 1.757 -13.856 1.00 71.14 C ATOM 1946 O MET A 133 -0.976 0.990 -14.598 1.00 0.43 O ATOM 1947 CB MET A 133 -1.940 4.177 -14.324 1.00 12.21 C ATOM 1948 CG MET A 133 -0.670 4.334 -15.144 1.00 31.05 C ATOM 1949 SD MET A 133 0.275 5.798 -14.690 1.00 22.53 S ATOM 1950 CE MET A 133 0.784 5.354 -13.030 1.00 13.21 C ATOM 0 H MET A 133 -3.934 3.497 -13.019 1.00 70.30 H new ATOM 0 HA MET A 133 -2.760 2.552 -15.455 1.00 42.20 H new ATOM 0 HB2 MET A 133 -2.674 4.909 -14.661 1.00 12.21 H new ATOM 0 HB3 MET A 133 -1.720 4.404 -13.281 1.00 12.21 H new ATOM 0 HG2 MET A 133 -0.047 3.449 -15.013 1.00 31.05 H new ATOM 0 HG3 MET A 133 -0.930 4.388 -16.201 1.00 31.05 H new ATOM 0 HE1 MET A 133 1.724 5.852 -12.792 1.00 13.21 H new ATOM 0 HE2 MET A 133 0.019 5.665 -12.319 1.00 13.21 H new ATOM 0 HE3 MET A 133 0.920 4.274 -12.968 1.00 13.21 H new ATOM 1960 N LEU A 134 -1.429 1.739 -12.532 1.00 34.12 N ATOM 1961 CA LEU A 134 -0.465 0.880 -11.835 1.00 41.35 C ATOM 1962 C LEU A 134 -0.654 -0.604 -12.161 1.00 33.14 C ATOM 1963 O LEU A 134 0.324 -1.354 -12.259 1.00 41.24 O ATOM 1964 CB LEU A 134 -0.580 1.101 -10.318 1.00 2.24 C ATOM 1965 CG LEU A 134 0.229 0.149 -9.427 1.00 14.35 C ATOM 1966 CD1 LEU A 134 1.721 0.297 -9.677 1.00 40.05 C ATOM 1967 CD2 LEU A 134 -0.095 0.395 -7.962 1.00 64.33 C ATOM 0 H LEU A 134 -1.986 2.321 -11.906 1.00 34.12 H new ATOM 0 HA LEU A 134 0.530 1.159 -12.183 1.00 41.35 H new ATOM 0 HB2 LEU A 134 -0.270 2.122 -10.097 1.00 2.24 H new ATOM 0 HB3 LEU A 134 -1.631 1.020 -10.039 1.00 2.24 H new ATOM 0 HG LEU A 134 -0.051 -0.873 -9.681 1.00 14.35 H new ATOM 0 HD11 LEU A 134 2.268 -0.390 -9.031 1.00 40.05 H new ATOM 0 HD12 LEU A 134 1.940 0.067 -10.720 1.00 40.05 H new ATOM 0 HD13 LEU A 134 2.027 1.320 -9.459 1.00 40.05 H new ATOM 0 HD21 LEU A 134 0.486 -0.287 -7.341 1.00 64.33 H new ATOM 0 HD22 LEU A 134 0.154 1.424 -7.702 1.00 64.33 H new ATOM 0 HD23 LEU A 134 -1.158 0.225 -7.791 1.00 64.33 H new ATOM 1979 N ARG A 135 -1.905 -1.019 -12.322 1.00 71.45 N ATOM 1980 CA ARG A 135 -2.221 -2.426 -12.602 1.00 1.42 C ATOM 1981 C ARG A 135 -1.426 -2.994 -13.796 1.00 34.31 C ATOM 1982 O ARG A 135 -1.137 -4.182 -13.823 1.00 33.21 O ATOM 1983 CB ARG A 135 -3.728 -2.640 -12.811 1.00 71.21 C ATOM 1984 CG ARG A 135 -4.278 -2.016 -14.072 1.00 74.01 C ATOM 1985 CD ARG A 135 -5.752 -2.335 -14.262 1.00 1.11 C ATOM 1986 NE ARG A 135 -6.290 -1.726 -15.481 1.00 33.05 N ATOM 1987 CZ ARG A 135 -7.280 -2.247 -16.220 1.00 13.23 C ATOM 1988 NH1 ARG A 135 -7.835 -3.411 -15.880 1.00 22.22 N ATOM 1989 NH2 ARG A 135 -7.706 -1.605 -17.303 1.00 0.25 N ATOM 0 H ARG A 135 -2.719 -0.408 -12.265 1.00 71.45 H new ATOM 0 HA ARG A 135 -1.912 -2.981 -11.716 1.00 1.42 H new ATOM 0 HB2 ARG A 135 -3.931 -3.711 -12.832 1.00 71.21 H new ATOM 0 HB3 ARG A 135 -4.263 -2.230 -11.954 1.00 71.21 H new ATOM 0 HG2 ARG A 135 -4.142 -0.935 -14.032 1.00 74.01 H new ATOM 0 HG3 ARG A 135 -3.714 -2.377 -14.932 1.00 74.01 H new ATOM 0 HD2 ARG A 135 -5.887 -3.416 -14.306 1.00 1.11 H new ATOM 0 HD3 ARG A 135 -6.315 -1.979 -13.399 1.00 1.11 H new ATOM 0 HE ARG A 135 -5.883 -0.843 -15.789 1.00 33.05 H new ATOM 0 HH11 ARG A 135 -7.507 -3.910 -15.053 1.00 22.22 H new ATOM 0 HH12 ARG A 135 -8.588 -3.802 -16.447 1.00 22.22 H new ATOM 0 HH21 ARG A 135 -7.280 -0.718 -17.571 1.00 0.25 H new ATOM 0 HH22 ARG A 135 -8.459 -2.000 -17.867 1.00 0.25 H new ATOM 2003 N THR A 136 -1.058 -2.146 -14.766 1.00 65.04 N ATOM 2004 CA THR A 136 -0.301 -2.622 -15.923 1.00 14.00 C ATOM 2005 C THR A 136 1.095 -3.115 -15.510 1.00 31.23 C ATOM 2006 O THR A 136 1.582 -4.120 -16.028 1.00 10.02 O ATOM 2007 CB THR A 136 -0.182 -1.545 -17.057 1.00 65.42 C ATOM 2008 OG1 THR A 136 0.416 -2.125 -18.225 1.00 21.54 O ATOM 2009 CG2 THR A 136 0.661 -0.355 -16.622 1.00 5.13 C ATOM 0 H THR A 136 -1.268 -1.148 -14.771 1.00 65.04 H new ATOM 0 HA THR A 136 -0.866 -3.460 -16.331 1.00 14.00 H new ATOM 0 HB THR A 136 -1.191 -1.197 -17.277 1.00 65.42 H new ATOM 0 HG1 THR A 136 0.485 -1.446 -18.928 1.00 21.54 H new ATOM 0 HG21 THR A 136 0.718 0.367 -17.436 1.00 5.13 H new ATOM 0 HG22 THR A 136 0.205 0.115 -15.751 1.00 5.13 H new ATOM 0 HG23 THR A 136 1.665 -0.694 -16.367 1.00 5.13 H new ATOM 2017 N GLN A 137 1.726 -2.408 -14.575 1.00 2.14 N ATOM 2018 CA GLN A 137 3.050 -2.780 -14.093 1.00 24.11 C ATOM 2019 C GLN A 137 2.974 -4.029 -13.228 1.00 64.24 C ATOM 2020 O GLN A 137 3.827 -4.912 -13.313 1.00 45.43 O ATOM 2021 CB GLN A 137 3.675 -1.629 -13.295 1.00 53.21 C ATOM 2022 CG GLN A 137 3.749 -0.313 -14.059 1.00 74.02 C ATOM 2023 CD GLN A 137 4.548 -0.421 -15.340 1.00 53.12 C ATOM 2024 OE1 GLN A 137 4.006 -0.733 -16.401 1.00 23.21 O ATOM 2025 NE2 GLN A 137 5.837 -0.159 -15.257 1.00 41.23 N ATOM 0 H GLN A 137 1.339 -1.573 -14.136 1.00 2.14 H new ATOM 0 HA GLN A 137 3.679 -2.991 -14.958 1.00 24.11 H new ATOM 0 HB2 GLN A 137 3.096 -1.476 -12.384 1.00 53.21 H new ATOM 0 HB3 GLN A 137 4.681 -1.917 -12.989 1.00 53.21 H new ATOM 0 HG2 GLN A 137 2.739 0.023 -14.294 1.00 74.02 H new ATOM 0 HG3 GLN A 137 4.197 0.448 -13.420 1.00 74.02 H new ATOM 0 HE21 GLN A 137 6.249 0.096 -14.359 1.00 41.23 H new ATOM 0 HE22 GLN A 137 6.423 -0.211 -16.090 1.00 41.23 H new ATOM 2034 N LEU A 138 1.949 -4.097 -12.395 1.00 70.40 N ATOM 2035 CA LEU A 138 1.763 -5.239 -11.513 1.00 61.05 C ATOM 2036 C LEU A 138 1.370 -6.489 -12.295 1.00 61.32 C ATOM 2037 O LEU A 138 1.684 -7.607 -11.883 1.00 1.33 O ATOM 2038 CB LEU A 138 0.718 -4.926 -10.440 1.00 62.30 C ATOM 2039 CG LEU A 138 1.069 -3.775 -9.490 1.00 34.31 C ATOM 2040 CD1 LEU A 138 -0.039 -3.565 -8.478 1.00 45.41 C ATOM 2041 CD2 LEU A 138 2.393 -4.042 -8.782 1.00 13.22 C ATOM 0 H LEU A 138 1.233 -3.376 -12.310 1.00 70.40 H new ATOM 0 HA LEU A 138 2.716 -5.439 -11.023 1.00 61.05 H new ATOM 0 HB2 LEU A 138 -0.225 -4.691 -10.934 1.00 62.30 H new ATOM 0 HB3 LEU A 138 0.552 -5.825 -9.847 1.00 62.30 H new ATOM 0 HG LEU A 138 1.175 -2.866 -10.082 1.00 34.31 H new ATOM 0 HD11 LEU A 138 0.227 -2.744 -7.812 1.00 45.41 H new ATOM 0 HD12 LEU A 138 -0.966 -3.324 -8.998 1.00 45.41 H new ATOM 0 HD13 LEU A 138 -0.176 -4.476 -7.895 1.00 45.41 H new ATOM 0 HD21 LEU A 138 2.622 -3.212 -8.113 1.00 13.22 H new ATOM 0 HD22 LEU A 138 2.317 -4.963 -8.204 1.00 13.22 H new ATOM 0 HD23 LEU A 138 3.187 -4.142 -9.522 1.00 13.22 H new ATOM 2053 N ALA A 139 0.698 -6.292 -13.429 1.00 64.52 N ATOM 2054 CA ALA A 139 0.267 -7.404 -14.279 1.00 3.33 C ATOM 2055 C ALA A 139 1.463 -8.205 -14.778 1.00 12.23 C ATOM 2056 O ALA A 139 1.367 -9.415 -14.997 1.00 42.25 O ATOM 2057 CB ALA A 139 -0.563 -6.893 -15.446 1.00 43.42 C ATOM 0 H ALA A 139 0.439 -5.371 -13.782 1.00 64.52 H new ATOM 0 HA ALA A 139 -0.355 -8.068 -13.679 1.00 3.33 H new ATOM 0 HB1 ALA A 139 -0.874 -7.733 -16.067 1.00 43.42 H new ATOM 0 HB2 ALA A 139 -1.444 -6.376 -15.067 1.00 43.42 H new ATOM 0 HB3 ALA A 139 0.034 -6.203 -16.042 1.00 43.42 H new ATOM 2063 N GLU A 140 2.594 -7.526 -14.942 1.00 40.11 N ATOM 2064 CA GLU A 140 3.832 -8.185 -15.352 1.00 15.32 C ATOM 2065 C GLU A 140 4.288 -9.178 -14.288 1.00 60.14 C ATOM 2066 O GLU A 140 5.066 -10.094 -14.565 1.00 13.43 O ATOM 2067 CB GLU A 140 4.941 -7.165 -15.589 1.00 41.43 C ATOM 2068 CG GLU A 140 4.682 -6.206 -16.730 1.00 15.14 C ATOM 2069 CD GLU A 140 5.890 -5.351 -17.024 1.00 10.54 C ATOM 2070 OE1 GLU A 140 6.747 -5.781 -17.824 1.00 54.11 O ATOM 2071 OE2 GLU A 140 6.004 -4.250 -16.445 1.00 31.10 O ATOM 0 H GLU A 140 2.680 -6.520 -14.798 1.00 40.11 H new ATOM 0 HA GLU A 140 3.630 -8.715 -16.283 1.00 15.32 H new ATOM 0 HB2 GLU A 140 5.089 -6.590 -14.675 1.00 41.43 H new ATOM 0 HB3 GLU A 140 5.871 -7.698 -15.784 1.00 41.43 H new ATOM 0 HG2 GLU A 140 4.408 -6.768 -17.623 1.00 15.14 H new ATOM 0 HG3 GLU A 140 3.835 -5.566 -16.483 1.00 15.14 H new ATOM 2078 N SER A 141 3.800 -8.990 -13.074 1.00 21.21 N ATOM 2079 CA SER A 141 4.154 -9.844 -11.968 1.00 1.54 C ATOM 2080 C SER A 141 3.015 -10.822 -11.656 1.00 14.42 C ATOM 2081 O SER A 141 3.055 -11.536 -10.651 1.00 23.22 O ATOM 2082 CB SER A 141 4.490 -8.993 -10.733 1.00 4.23 C ATOM 2083 OG SER A 141 5.043 -9.783 -9.692 1.00 54.41 O ATOM 0 H SER A 141 3.150 -8.242 -12.834 1.00 21.21 H new ATOM 0 HA SER A 141 5.034 -10.425 -12.242 1.00 1.54 H new ATOM 0 HB2 SER A 141 5.195 -8.210 -11.011 1.00 4.23 H new ATOM 0 HB3 SER A 141 3.588 -8.497 -10.375 1.00 4.23 H new ATOM 0 HG SER A 141 4.573 -10.642 -9.648 1.00 54.41 H new ATOM 2089 N GLY A 142 2.002 -10.858 -12.519 1.00 3.11 N ATOM 2090 CA GLY A 142 0.892 -11.771 -12.318 1.00 34.25 C ATOM 2091 C GLY A 142 -0.241 -11.172 -11.505 1.00 34.43 C ATOM 2092 O GLY A 142 -1.359 -11.685 -11.523 1.00 54.12 O ATOM 0 H GLY A 142 1.931 -10.272 -13.351 1.00 3.11 H new ATOM 0 HA2 GLY A 142 0.507 -12.083 -13.289 1.00 34.25 H new ATOM 0 HA3 GLY A 142 1.255 -12.668 -11.816 1.00 34.25 H new ATOM 2096 N ILE A 143 0.041 -10.098 -10.794 1.00 55.41 N ATOM 2097 CA ILE A 143 -0.961 -9.453 -9.962 1.00 33.04 C ATOM 2098 C ILE A 143 -1.788 -8.448 -10.771 1.00 62.44 C ATOM 2099 O ILE A 143 -1.309 -7.862 -11.727 1.00 40.41 O ATOM 2100 CB ILE A 143 -0.290 -8.726 -8.759 1.00 4.11 C ATOM 2101 CG1 ILE A 143 0.615 -9.697 -7.990 1.00 12.50 C ATOM 2102 CG2 ILE A 143 -1.338 -8.129 -7.824 1.00 73.31 C ATOM 2103 CD1 ILE A 143 1.353 -9.060 -6.828 1.00 55.33 C ATOM 0 H ILE A 143 0.958 -9.651 -10.775 1.00 55.41 H new ATOM 0 HA ILE A 143 -1.626 -10.231 -9.586 1.00 33.04 H new ATOM 0 HB ILE A 143 0.317 -7.911 -9.152 1.00 4.11 H new ATOM 0 HG12 ILE A 143 0.010 -10.522 -7.615 1.00 12.50 H new ATOM 0 HG13 ILE A 143 1.343 -10.124 -8.680 1.00 12.50 H new ATOM 0 HG21 ILE A 143 -0.841 -7.628 -6.993 1.00 73.31 H new ATOM 0 HG22 ILE A 143 -1.946 -7.409 -8.371 1.00 73.31 H new ATOM 0 HG23 ILE A 143 -1.977 -8.924 -7.438 1.00 73.31 H new ATOM 0 HD11 ILE A 143 1.971 -9.810 -6.335 1.00 55.33 H new ATOM 0 HD12 ILE A 143 1.986 -8.253 -7.197 1.00 55.33 H new ATOM 0 HD13 ILE A 143 0.632 -8.658 -6.116 1.00 55.33 H new ATOM 2115 N GLN A 144 -3.030 -8.263 -10.363 1.00 3.12 N ATOM 2116 CA GLN A 144 -3.942 -7.351 -11.033 1.00 62.21 C ATOM 2117 C GLN A 144 -4.776 -6.612 -10.001 1.00 24.55 C ATOM 2118 O GLN A 144 -5.232 -7.206 -9.020 1.00 12.42 O ATOM 2119 CB GLN A 144 -4.855 -8.091 -12.023 1.00 40.33 C ATOM 2120 CG GLN A 144 -4.121 -8.679 -13.222 1.00 72.43 C ATOM 2121 CD GLN A 144 -5.064 -9.208 -14.283 1.00 51.11 C ATOM 2122 OE1 GLN A 144 -5.462 -8.481 -15.191 1.00 44.53 O ATOM 2123 NE2 GLN A 144 -5.427 -10.471 -14.178 1.00 52.10 N ATOM 0 H GLN A 144 -3.436 -8.740 -9.558 1.00 3.12 H new ATOM 0 HA GLN A 144 -3.349 -6.636 -11.603 1.00 62.21 H new ATOM 0 HB2 GLN A 144 -5.370 -8.894 -11.496 1.00 40.33 H new ATOM 0 HB3 GLN A 144 -5.620 -7.402 -12.380 1.00 40.33 H new ATOM 0 HG2 GLN A 144 -3.479 -7.915 -13.660 1.00 72.43 H new ATOM 0 HG3 GLN A 144 -3.471 -9.486 -12.885 1.00 72.43 H new ATOM 0 HE21 GLN A 144 -5.074 -11.041 -13.409 1.00 52.10 H new ATOM 0 HE22 GLN A 144 -6.061 -10.878 -14.866 1.00 52.10 H new ATOM 2132 N LEU A 145 -4.946 -5.320 -10.193 1.00 41.51 N ATOM 2133 CA LEU A 145 -5.738 -4.523 -9.272 1.00 21.21 C ATOM 2134 C LEU A 145 -7.220 -4.719 -9.516 1.00 22.41 C ATOM 2135 O LEU A 145 -7.755 -4.287 -10.538 1.00 60.22 O ATOM 2136 CB LEU A 145 -5.376 -3.041 -9.376 1.00 54.51 C ATOM 2137 CG LEU A 145 -3.925 -2.692 -9.045 1.00 42.24 C ATOM 2138 CD1 LEU A 145 -3.728 -1.189 -9.009 1.00 35.32 C ATOM 2139 CD2 LEU A 145 -3.519 -3.316 -7.727 1.00 23.20 C ATOM 0 H LEU A 145 -4.549 -4.799 -10.975 1.00 41.51 H new ATOM 0 HA LEU A 145 -5.508 -4.864 -8.262 1.00 21.21 H new ATOM 0 HB2 LEU A 145 -5.590 -2.703 -10.390 1.00 54.51 H new ATOM 0 HB3 LEU A 145 -6.028 -2.478 -8.708 1.00 54.51 H new ATOM 0 HG LEU A 145 -3.287 -3.098 -9.830 1.00 42.24 H new ATOM 0 HD11 LEU A 145 -2.688 -0.964 -8.772 1.00 35.32 H new ATOM 0 HD12 LEU A 145 -3.978 -0.766 -9.982 1.00 35.32 H new ATOM 0 HD13 LEU A 145 -4.376 -0.755 -8.247 1.00 35.32 H new ATOM 0 HD21 LEU A 145 -2.483 -3.058 -7.506 1.00 23.20 H new ATOM 0 HD22 LEU A 145 -4.164 -2.940 -6.933 1.00 23.20 H new ATOM 0 HD23 LEU A 145 -3.617 -4.400 -7.792 1.00 23.20 H new ATOM 2151 N GLY A 146 -7.872 -5.384 -8.584 1.00 23.22 N ATOM 2152 CA GLY A 146 -9.290 -5.615 -8.703 1.00 33.41 C ATOM 2153 C GLY A 146 -10.077 -4.558 -7.978 1.00 2.12 C ATOM 2154 O GLY A 146 -10.879 -3.844 -8.577 1.00 10.13 O ATOM 0 H GLY A 146 -7.443 -5.770 -7.743 1.00 23.22 H new ATOM 0 HA2 GLY A 146 -9.572 -5.624 -9.756 1.00 33.41 H new ATOM 0 HA3 GLY A 146 -9.536 -6.597 -8.298 1.00 33.41 H new ATOM 2158 N GLN A 147 -9.835 -4.443 -6.688 1.00 51.01 N ATOM 2159 CA GLN A 147 -10.509 -3.454 -5.876 1.00 54.22 C ATOM 2160 C GLN A 147 -9.586 -2.283 -5.578 1.00 2.53 C ATOM 2161 O GLN A 147 -8.374 -2.451 -5.432 1.00 71.14 O ATOM 2162 CB GLN A 147 -11.001 -4.069 -4.566 1.00 64.20 C ATOM 2163 CG GLN A 147 -12.118 -5.082 -4.729 1.00 2.32 C ATOM 2164 CD GLN A 147 -12.566 -5.665 -3.404 1.00 65.32 C ATOM 2165 OE1 GLN A 147 -11.771 -5.807 -2.474 1.00 33.30 O ATOM 2166 NE2 GLN A 147 -13.839 -5.987 -3.301 1.00 63.23 N ATOM 0 H GLN A 147 -9.172 -5.027 -6.178 1.00 51.01 H new ATOM 0 HA GLN A 147 -11.369 -3.092 -6.439 1.00 54.22 H new ATOM 0 HB2 GLN A 147 -10.160 -4.551 -4.067 1.00 64.20 H new ATOM 0 HB3 GLN A 147 -11.345 -3.269 -3.910 1.00 64.20 H new ATOM 0 HG2 GLN A 147 -12.967 -4.607 -5.220 1.00 2.32 H new ATOM 0 HG3 GLN A 147 -11.782 -5.887 -5.382 1.00 2.32 H new ATOM 0 HE21 GLN A 147 -14.465 -5.854 -4.095 1.00 63.23 H new ATOM 0 HE22 GLN A 147 -14.199 -6.370 -2.427 1.00 63.23 H new ATOM 2175 N SER A 148 -10.154 -1.106 -5.514 1.00 23.22 N ATOM 2176 CA SER A 148 -9.409 0.091 -5.190 1.00 33.24 C ATOM 2177 C SER A 148 -10.255 0.983 -4.297 1.00 3.11 C ATOM 2178 O SER A 148 -11.425 1.226 -4.587 1.00 13.33 O ATOM 2179 CB SER A 148 -9.024 0.834 -6.471 1.00 10.14 C ATOM 2180 OG SER A 148 -8.301 -0.017 -7.353 1.00 12.41 O ATOM 0 H SER A 148 -11.147 -0.947 -5.685 1.00 23.22 H new ATOM 0 HA SER A 148 -8.495 -0.182 -4.662 1.00 33.24 H new ATOM 0 HB2 SER A 148 -9.922 1.201 -6.968 1.00 10.14 H new ATOM 0 HB3 SER A 148 -8.419 1.706 -6.223 1.00 10.14 H new ATOM 0 HG SER A 148 -8.066 0.478 -8.166 1.00 12.41 H new ATOM 2186 N SER A 149 -9.684 1.439 -3.201 1.00 54.21 N ATOM 2187 CA SER A 149 -10.404 2.290 -2.277 1.00 40.43 C ATOM 2188 C SER A 149 -9.449 3.238 -1.574 1.00 34.51 C ATOM 2189 O SER A 149 -8.334 2.866 -1.237 1.00 2.03 O ATOM 2190 CB SER A 149 -11.162 1.436 -1.252 1.00 61.34 C ATOM 2191 OG SER A 149 -12.044 0.526 -1.901 1.00 74.23 O ATOM 0 H SER A 149 -8.723 1.234 -2.928 1.00 54.21 H new ATOM 0 HA SER A 149 -11.125 2.883 -2.839 1.00 40.43 H new ATOM 0 HB2 SER A 149 -10.452 0.884 -0.637 1.00 61.34 H new ATOM 0 HB3 SER A 149 -11.729 2.083 -0.582 1.00 61.34 H new ATOM 0 HG SER A 149 -12.515 -0.009 -1.228 1.00 74.23 H new ATOM 2197 N ILE A 150 -9.886 4.460 -1.365 1.00 34.41 N ATOM 2198 CA ILE A 150 -9.078 5.464 -0.697 1.00 45.34 C ATOM 2199 C ILE A 150 -9.961 6.216 0.285 1.00 65.24 C ATOM 2200 O ILE A 150 -11.133 6.458 0.004 1.00 60.22 O ATOM 2201 CB ILE A 150 -8.448 6.472 -1.710 1.00 50.53 C ATOM 2202 CG1 ILE A 150 -7.580 5.734 -2.741 1.00 54.45 C ATOM 2203 CG2 ILE A 150 -7.621 7.528 -0.980 1.00 72.34 C ATOM 2204 CD1 ILE A 150 -6.963 6.643 -3.787 1.00 34.05 C ATOM 0 H ILE A 150 -10.808 4.788 -1.651 1.00 34.41 H new ATOM 0 HA ILE A 150 -8.259 4.963 -0.181 1.00 45.34 H new ATOM 0 HB ILE A 150 -9.260 6.974 -2.236 1.00 50.53 H new ATOM 0 HG12 ILE A 150 -6.783 5.204 -2.218 1.00 54.45 H new ATOM 0 HG13 ILE A 150 -8.189 4.981 -3.241 1.00 54.45 H new ATOM 0 HG21 ILE A 150 -7.192 8.219 -1.705 1.00 72.34 H new ATOM 0 HG22 ILE A 150 -8.261 8.078 -0.289 1.00 72.34 H new ATOM 0 HG23 ILE A 150 -6.820 7.042 -0.424 1.00 72.34 H new ATOM 0 HD11 ILE A 150 -6.365 6.049 -4.478 1.00 34.05 H new ATOM 0 HD12 ILE A 150 -7.753 7.154 -4.337 1.00 34.05 H new ATOM 0 HD13 ILE A 150 -6.326 7.381 -3.298 1.00 34.05 H new ATOM 2216 N SER A 151 -9.422 6.564 1.427 1.00 51.31 N ATOM 2217 CA SER A 151 -10.190 7.267 2.426 1.00 72.24 C ATOM 2218 C SER A 151 -9.345 8.338 3.089 1.00 11.24 C ATOM 2219 O SER A 151 -8.125 8.375 2.915 1.00 5.32 O ATOM 2220 CB SER A 151 -10.732 6.283 3.468 1.00 2.24 C ATOM 2221 OG SER A 151 -11.640 6.919 4.350 1.00 42.44 O ATOM 0 H SER A 151 -8.455 6.372 1.689 1.00 51.31 H new ATOM 0 HA SER A 151 -11.035 7.753 1.938 1.00 72.24 H new ATOM 0 HB2 SER A 151 -11.230 5.454 2.965 1.00 2.24 H new ATOM 0 HB3 SER A 151 -9.904 5.860 4.037 1.00 2.24 H new ATOM 0 HG SER A 151 -11.972 6.268 5.003 1.00 42.44 H new ATOM 2227 N SER A 152 -9.991 9.206 3.846 1.00 35.32 N ATOM 2228 CA SER A 152 -9.305 10.278 4.524 1.00 23.51 C ATOM 2229 C SER A 152 -8.738 9.794 5.855 1.00 64.42 C ATOM 2230 O SER A 152 -7.732 10.316 6.336 1.00 44.14 O ATOM 2231 CB SER A 152 -10.255 11.457 4.731 1.00 51.12 C ATOM 2232 OG SER A 152 -10.832 11.861 3.494 1.00 32.30 O ATOM 0 H SER A 152 -10.998 9.184 4.004 1.00 35.32 H new ATOM 0 HA SER A 152 -8.471 10.610 3.906 1.00 23.51 H new ATOM 0 HB2 SER A 152 -11.042 11.178 5.431 1.00 51.12 H new ATOM 0 HB3 SER A 152 -9.714 12.292 5.176 1.00 51.12 H new ATOM 0 HG SER A 152 -11.438 12.616 3.647 1.00 32.30 H new ATOM 2238 N GLU A 153 -9.386 8.780 6.436 1.00 45.41 N ATOM 2239 CA GLU A 153 -8.940 8.189 7.698 1.00 73.13 C ATOM 2240 C GLU A 153 -9.729 6.916 8.015 1.00 55.13 C ATOM 2241 O GLU A 153 -9.166 5.906 8.445 1.00 72.43 O ATOM 2242 CB GLU A 153 -9.053 9.198 8.854 1.00 41.31 C ATOM 2243 CG GLU A 153 -10.449 9.755 9.076 1.00 32.11 C ATOM 2244 CD GLU A 153 -10.507 10.698 10.253 1.00 51.12 C ATOM 2245 OE1 GLU A 153 -10.146 10.279 11.368 1.00 62.02 O ATOM 2246 OE2 GLU A 153 -10.917 11.870 10.069 1.00 53.12 O ATOM 0 H GLU A 153 -10.226 8.350 6.048 1.00 45.41 H new ATOM 0 HA GLU A 153 -7.890 7.921 7.585 1.00 73.13 H new ATOM 0 HB2 GLU A 153 -8.718 8.716 9.773 1.00 41.31 H new ATOM 0 HB3 GLU A 153 -8.372 10.027 8.662 1.00 41.31 H new ATOM 0 HG2 GLU A 153 -10.777 10.278 8.177 1.00 32.11 H new ATOM 0 HG3 GLU A 153 -11.145 8.932 9.238 1.00 32.11 H new ATOM 2284 N ALA A 156 -16.136 4.785 5.176 1.00 4.44 N ATOM 2285 CA ALA A 156 -17.524 4.645 5.562 1.00 73.14 C ATOM 2286 C ALA A 156 -18.420 5.216 4.482 1.00 50.02 C ATOM 2287 O ALA A 156 -17.953 5.944 3.601 1.00 35.20 O ATOM 2288 CB ALA A 156 -17.782 5.347 6.891 1.00 14.34 C ATOM 0 HA ALA A 156 -17.749 3.586 5.685 1.00 73.14 H new ATOM 0 HB1 ALA A 156 -18.830 5.232 7.166 1.00 14.34 H new ATOM 0 HB2 ALA A 156 -17.153 4.905 7.664 1.00 14.34 H new ATOM 0 HB3 ALA A 156 -17.547 6.407 6.794 1.00 14.34 H new ATOM 2294 N GLY A 157 -19.692 4.894 4.546 1.00 40.14 N ATOM 2295 CA GLY A 157 -20.623 5.384 3.563 1.00 24.12 C ATOM 2296 C GLY A 157 -21.769 4.432 3.339 1.00 71.54 C ATOM 2297 O GLY A 157 -21.718 3.588 2.446 1.00 12.31 O ATOM 0 H GLY A 157 -20.101 4.298 5.265 1.00 40.14 H new ATOM 0 HA2 GLY A 157 -21.013 6.350 3.884 1.00 24.12 H new ATOM 0 HA3 GLY A 157 -20.100 5.549 2.621 1.00 24.12 H new ATOM 2301 N GLN A 158 -22.795 4.547 4.163 1.00 13.25 N ATOM 2302 CA GLN A 158 -23.972 3.705 4.034 1.00 5.13 C ATOM 2303 C GLN A 158 -24.844 4.193 2.889 1.00 33.45 C ATOM 2304 O GLN A 158 -25.185 5.379 2.816 1.00 30.13 O ATOM 2305 CB GLN A 158 -24.776 3.687 5.337 1.00 61.41 C ATOM 2306 CG GLN A 158 -24.048 3.045 6.509 1.00 74.34 C ATOM 2307 CD GLN A 158 -23.669 1.601 6.240 1.00 11.40 C ATOM 2308 OE1 GLN A 158 -24.449 0.683 6.494 1.00 14.32 O ATOM 2309 NE2 GLN A 158 -22.469 1.390 5.739 1.00 32.33 N ATOM 0 H GLN A 158 -22.837 5.217 4.931 1.00 13.25 H new ATOM 0 HA GLN A 158 -23.642 2.688 3.821 1.00 5.13 H new ATOM 0 HB2 GLN A 158 -25.038 4.711 5.603 1.00 61.41 H new ATOM 0 HB3 GLN A 158 -25.711 3.152 5.167 1.00 61.41 H new ATOM 0 HG2 GLN A 158 -23.148 3.618 6.730 1.00 74.34 H new ATOM 0 HG3 GLN A 158 -24.681 3.092 7.395 1.00 74.34 H new ATOM 0 HE21 GLN A 158 -21.853 2.178 5.542 1.00 32.33 H new ATOM 0 HE22 GLN A 158 -22.156 0.438 5.548 1.00 32.33 H new ATOM 2318 N GLN A 159 -25.195 3.288 1.997 1.00 71.53 N ATOM 2319 CA GLN A 159 -26.024 3.625 0.852 1.00 10.24 C ATOM 2320 C GLN A 159 -27.492 3.747 1.259 1.00 61.42 C ATOM 2321 O GLN A 159 -27.860 3.440 2.397 1.00 51.24 O ATOM 2322 CB GLN A 159 -25.863 2.578 -0.252 1.00 62.12 C ATOM 2323 CG GLN A 159 -26.290 1.177 0.151 1.00 31.14 C ATOM 2324 CD GLN A 159 -26.122 0.175 -0.970 1.00 23.54 C ATOM 2325 OE1 GLN A 159 -25.071 -0.452 -1.108 1.00 42.12 O ATOM 2326 NE2 GLN A 159 -27.149 0.023 -1.783 1.00 4.42 N ATOM 0 H GLN A 159 -24.918 2.307 2.042 1.00 71.53 H new ATOM 0 HA GLN A 159 -25.695 4.591 0.468 1.00 10.24 H new ATOM 0 HB2 GLN A 159 -26.446 2.888 -1.119 1.00 62.12 H new ATOM 0 HB3 GLN A 159 -24.819 2.552 -0.563 1.00 62.12 H new ATOM 0 HG2 GLN A 159 -25.704 0.856 1.012 1.00 31.14 H new ATOM 0 HG3 GLN A 159 -27.334 1.195 0.465 1.00 31.14 H new ATOM 0 HE21 GLN A 159 -28.002 0.562 -1.634 1.00 4.42 H new ATOM 0 HE22 GLN A 159 -27.090 -0.634 -2.561 1.00 4.42 H new ATOM 2335 N GLN A 160 -28.322 4.188 0.333 1.00 70.31 N ATOM 2336 CA GLN A 160 -29.745 4.350 0.585 1.00 12.22 C ATOM 2337 C GLN A 160 -30.536 4.177 -0.703 1.00 13.54 C ATOM 2338 O GLN A 160 -30.096 4.600 -1.775 1.00 22.21 O ATOM 2339 CB GLN A 160 -30.036 5.724 1.204 1.00 73.32 C ATOM 2340 CG GLN A 160 -29.511 6.897 0.385 1.00 75.55 C ATOM 2341 CD GLN A 160 -29.841 8.246 0.997 1.00 51.04 C ATOM 2342 OE1 GLN A 160 -29.081 9.205 0.856 1.00 13.32 O ATOM 2343 NE2 GLN A 160 -30.978 8.340 1.662 1.00 32.33 N ATOM 0 H GLN A 160 -28.033 4.443 -0.611 1.00 70.31 H new ATOM 0 HA GLN A 160 -30.054 3.581 1.293 1.00 12.22 H new ATOM 0 HB2 GLN A 160 -31.113 5.834 1.328 1.00 73.32 H new ATOM 0 HB3 GLN A 160 -29.595 5.763 2.200 1.00 73.32 H new ATOM 0 HG2 GLN A 160 -28.430 6.806 0.283 1.00 75.55 H new ATOM 0 HG3 GLN A 160 -29.931 6.848 -0.620 1.00 75.55 H new ATOM 0 HE21 GLN A 160 -31.582 7.524 1.758 1.00 32.33 H new ATOM 0 HE22 GLN A 160 -31.252 9.229 2.080 1.00 32.33 H new ATOM 2352 N SER A 161 -31.683 3.541 -0.601 1.00 50.03 N ATOM 2353 CA SER A 161 -32.536 3.324 -1.747 1.00 11.52 C ATOM 2354 C SER A 161 -33.958 3.793 -1.453 1.00 21.50 C ATOM 2355 O SER A 161 -34.692 3.149 -0.698 1.00 52.21 O ATOM 2356 CB SER A 161 -32.535 1.847 -2.126 1.00 33.04 C ATOM 2357 OG SER A 161 -31.206 1.377 -2.339 1.00 41.15 O ATOM 0 H SER A 161 -32.048 3.162 0.273 1.00 50.03 H new ATOM 0 HA SER A 161 -32.149 3.905 -2.584 1.00 11.52 H new ATOM 0 HB2 SER A 161 -33.009 1.264 -1.336 1.00 33.04 H new ATOM 0 HB3 SER A 161 -33.127 1.699 -3.029 1.00 33.04 H new ATOM 0 HG SER A 161 -31.229 0.427 -2.579 1.00 41.15 H new ATOM 2363 N SER A 162 -34.342 4.904 -2.056 1.00 21.31 N ATOM 2364 CA SER A 162 -35.662 5.487 -1.855 1.00 23.02 C ATOM 2365 C SER A 162 -35.978 6.457 -2.991 1.00 71.42 C ATOM 2366 O SER A 162 -35.506 7.600 -3.003 1.00 42.31 O ATOM 2367 CB SER A 162 -35.725 6.237 -0.506 1.00 53.15 C ATOM 2368 OG SER A 162 -35.389 5.386 0.585 1.00 21.33 O ATOM 0 H SER A 162 -33.750 5.429 -2.699 1.00 21.31 H new ATOM 0 HA SER A 162 -36.397 4.682 -1.845 1.00 23.02 H new ATOM 0 HB2 SER A 162 -35.042 7.086 -0.529 1.00 53.15 H new ATOM 0 HB3 SER A 162 -36.728 6.639 -0.359 1.00 53.15 H new ATOM 0 HG SER A 162 -35.484 4.450 0.311 1.00 21.33 H new ATOM 2374 N SER A 163 -36.748 5.988 -3.954 1.00 3.33 N ATOM 2375 CA SER A 163 -37.120 6.796 -5.096 1.00 43.53 C ATOM 2376 C SER A 163 -38.507 7.392 -4.903 1.00 32.45 C ATOM 2377 O SER A 163 -39.504 6.664 -4.812 1.00 61.43 O ATOM 2378 CB SER A 163 -37.062 5.956 -6.376 1.00 64.34 C ATOM 2379 OG SER A 163 -37.736 4.715 -6.208 1.00 51.02 O ATOM 0 H SER A 163 -37.130 5.042 -3.966 1.00 3.33 H new ATOM 0 HA SER A 163 -36.411 7.618 -5.188 1.00 43.53 H new ATOM 0 HB2 SER A 163 -37.514 6.510 -7.198 1.00 64.34 H new ATOM 0 HB3 SER A 163 -36.022 5.774 -6.648 1.00 64.34 H new ATOM 0 HG SER A 163 -38.575 4.862 -5.724 1.00 51.02 H new ATOM 2385 N GLN A 164 -38.569 8.709 -4.831 1.00 54.02 N ATOM 2386 CA GLN A 164 -39.827 9.402 -4.635 1.00 32.55 C ATOM 2387 C GLN A 164 -40.601 9.516 -5.949 1.00 54.23 C ATOM 2388 O GLN A 164 -40.505 10.524 -6.662 1.00 54.35 O ATOM 2389 CB GLN A 164 -39.589 10.789 -4.025 1.00 51.01 C ATOM 2390 CG GLN A 164 -40.862 11.572 -3.741 1.00 54.20 C ATOM 2391 CD GLN A 164 -40.581 12.931 -3.135 1.00 50.34 C ATOM 2392 OE1 GLN A 164 -40.511 13.075 -1.917 1.00 32.32 O ATOM 2393 NE2 GLN A 164 -40.418 13.933 -3.977 1.00 44.43 N ATOM 0 H GLN A 164 -37.757 9.322 -4.906 1.00 54.02 H new ATOM 0 HA GLN A 164 -40.430 8.818 -3.939 1.00 32.55 H new ATOM 0 HB2 GLN A 164 -39.032 10.674 -3.095 1.00 51.01 H new ATOM 0 HB3 GLN A 164 -38.963 11.369 -4.703 1.00 51.01 H new ATOM 0 HG2 GLN A 164 -41.421 11.699 -4.668 1.00 54.20 H new ATOM 0 HG3 GLN A 164 -41.494 10.999 -3.063 1.00 54.20 H new ATOM 0 HE21 GLN A 164 -40.484 13.771 -4.982 1.00 44.43 H new ATOM 0 HE22 GLN A 164 -40.226 14.870 -3.623 1.00 44.43 H new ATOM 2402 N GLN A 165 -41.315 8.461 -6.293 1.00 22.20 N ATOM 2403 CA GLN A 165 -42.139 8.462 -7.485 1.00 62.54 C ATOM 2404 C GLN A 165 -43.461 9.170 -7.217 1.00 71.40 C ATOM 2405 O GLN A 165 -44.200 8.813 -6.295 1.00 62.14 O ATOM 2406 CB GLN A 165 -42.373 7.036 -8.007 1.00 24.15 C ATOM 2407 CG GLN A 165 -42.900 6.065 -6.967 1.00 32.33 C ATOM 2408 CD GLN A 165 -43.257 4.711 -7.547 1.00 23.05 C ATOM 2409 OE1 GLN A 165 -44.147 4.029 -7.049 1.00 41.24 O ATOM 2410 NE2 GLN A 165 -42.566 4.309 -8.599 1.00 52.21 N ATOM 0 H GLN A 165 -41.340 7.591 -5.762 1.00 22.20 H new ATOM 0 HA GLN A 165 -41.606 9.010 -8.262 1.00 62.54 H new ATOM 0 HB2 GLN A 165 -43.078 7.078 -8.837 1.00 24.15 H new ATOM 0 HB3 GLN A 165 -41.435 6.649 -8.404 1.00 24.15 H new ATOM 0 HG2 GLN A 165 -42.149 5.934 -6.188 1.00 32.33 H new ATOM 0 HG3 GLN A 165 -43.782 6.494 -6.491 1.00 32.33 H new ATOM 0 HE21 GLN A 165 -41.833 4.904 -8.985 1.00 52.21 H new ATOM 0 HE22 GLN A 165 -42.766 3.404 -9.025 1.00 52.21 H new ATOM 2419 N GLN A 166 -43.742 10.177 -8.009 1.00 32.43 N ATOM 2420 CA GLN A 166 -44.946 10.961 -7.854 1.00 14.13 C ATOM 2421 C GLN A 166 -45.498 11.341 -9.227 1.00 55.42 C ATOM 2422 O GLN A 166 -44.732 11.513 -10.178 1.00 60.44 O ATOM 2423 CB GLN A 166 -44.635 12.210 -7.019 1.00 3.14 C ATOM 2424 CG GLN A 166 -45.807 13.151 -6.827 1.00 23.32 C ATOM 2425 CD GLN A 166 -45.496 14.276 -5.864 1.00 75.43 C ATOM 2426 OE1 GLN A 166 -44.343 14.688 -5.718 1.00 41.21 O ATOM 2427 NE2 GLN A 166 -46.516 14.789 -5.210 1.00 33.32 N ATOM 0 H GLN A 166 -43.144 10.477 -8.779 1.00 32.43 H new ATOM 0 HA GLN A 166 -45.705 10.376 -7.335 1.00 14.13 H new ATOM 0 HB2 GLN A 166 -44.275 11.895 -6.039 1.00 3.14 H new ATOM 0 HB3 GLN A 166 -43.822 12.757 -7.497 1.00 3.14 H new ATOM 0 HG2 GLN A 166 -46.093 13.571 -7.791 1.00 23.32 H new ATOM 0 HG3 GLN A 166 -46.664 12.588 -6.458 1.00 23.32 H new ATOM 0 HE21 GLN A 166 -47.455 14.420 -5.359 1.00 33.32 H new ATOM 0 HE22 GLN A 166 -46.368 15.556 -4.554 1.00 33.32 H new ATOM 2436 N SER A 167 -46.816 11.448 -9.331 1.00 11.42 N ATOM 2437 CA SER A 167 -47.469 11.805 -10.583 1.00 33.14 C ATOM 2438 C SER A 167 -48.946 12.100 -10.344 1.00 22.15 C ATOM 2439 O SER A 167 -49.455 11.884 -9.238 1.00 72.54 O ATOM 2440 CB SER A 167 -47.310 10.671 -11.603 1.00 64.24 C ATOM 2441 OG SER A 167 -47.701 9.429 -11.043 1.00 62.32 O ATOM 0 H SER A 167 -47.459 11.291 -8.555 1.00 11.42 H new ATOM 0 HA SER A 167 -46.996 12.703 -10.981 1.00 33.14 H new ATOM 0 HB2 SER A 167 -47.914 10.883 -12.485 1.00 64.24 H new ATOM 0 HB3 SER A 167 -46.272 10.616 -11.932 1.00 64.24 H new ATOM 0 HG SER A 167 -47.593 8.720 -11.711 1.00 62.32 H new