USER MOD reduce.3.24.130724 H: found=0, std=0, add=948, rem=0, adj=32 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 72:sc= 1.15 USER MOD Set 1.2: A 133 MET CE :methyl 165:sc= -1.04 (180deg=-1.48) USER MOD Set 2.1: A 113 GLN : amide:sc= 0.82 K(o=1.5,f=-0.47) USER MOD Set 2.2: A 149 SER OG : rot -150:sc= 0.714 USER MOD Set 3.1: A 110 ASN : amide:sc= 1.01 K(o=2.1,f=-1.1) USER MOD Set 3.2: A 144 GLN : amide:sc= 1.13 K(o=2.1,f=-0.14) USER MOD Set 4.1: A 102 HIS : no HD1:sc= 0 X(o=0,f=0.0021) USER MOD Set 4.2: A 104 SER OG : rot 180:sc= 0 USER MOD Set 5.1: A 62 SER OG : rot 180:sc= 0 USER MOD Set 5.2: A 94 HIS : no HD1:sc= -0.0185 X(o=-0.018,f=0.27) USER MOD Single : A 2 MET CE :methyl 160:sc= -0.0859 (180deg=-0.533) USER MOD Single : A 4 SER OG : rot 180:sc= 0 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 -20:sc= 0.686 USER MOD Single : A 26 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 67 SER OG : rot 180:sc=0.000448 USER MOD Single : A 68 HIS : no HD1:sc= 0 X(o=0,f=-0.0055) USER MOD Single : A 71 GLN : amide:sc= 0 K(o=0,f=-0.56) USER MOD Single : A 72 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 73 THR OG1 : rot 88:sc= 1.23 USER MOD Single : A 76 GLN : amide:sc= -1.16 K(o=-1.2,f=-5.6!) USER MOD Single : A 77 GLN :FLIP amide:sc= 0.518 F(o=-1.2,f=0.52) USER MOD Single : A 79 MET CE :methyl 164:sc= -0.0974 (180deg=-0.435) USER MOD Single : A 82 THR OG1 : rot 180:sc= 0 USER MOD Single : A 84 GLN :FLIP amide:sc= -0.0213 F(o=-0.97,f=-0.021) USER MOD Single : A 86 GLN : amide:sc= -1.35! X(o=-1.3!,f=-1) USER MOD Single : A 87 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 88 SER OG : rot 180:sc= -0.0291 USER MOD Single : A 90 GLN : amide:sc= -0.676 X(o=-0.68,f=-0.26) USER MOD Single : A 100 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 106 LYS NZ :NH3+ -172:sc= 0 (180deg=-0.0621) USER MOD Single : A 111 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 115 GLN :FLIP amide:sc=-0.00174 F(o=-1.2,f=-0.0017) USER MOD Single : A 116 MET CE :methyl -148:sc= -0.239 (180deg=-1.24) USER MOD Single : A 118 SER OG : rot 180:sc= 0 USER MOD Single : A 120 HIS : no HD1:sc= -0.262 X(o=-0.26,f=-0.015) USER MOD Single : A 121 SER OG : rot 180:sc= 0.0698 USER MOD Single : A 122 HIS : no HD1:sc= -0.013 X(o=-0.013,f=-0.23) USER MOD Single : A 136 THR OG1 : rot 180:sc= 0 USER MOD Single : A 137 GLN : amide:sc= 0.0024 X(o=0.0024,f=-0.44) USER MOD Single : A 141 SER OG : rot -27:sc= 0.126 USER MOD Single : A 147 GLN : amide:sc= -1.5! C(o=-1.5!,f=-6.8!) USER MOD Single : A 148 SER OG : rot 180:sc= 0 USER MOD Single : A 151 SER OG : rot 180:sc= 0 USER MOD Single : A 152 SER OG : rot -122:sc= 0.973 USER MOD Single : A 158 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 159 GLN : amide:sc= 0 K(o=0,f=-0.73) USER MOD Single : A 160 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 161 SER OG : rot 180:sc= 0 USER MOD Single : A 162 SER OG : rot 180:sc= 0 USER MOD Single : A 163 SER OG : rot 180:sc= 0 USER MOD Single : A 164 GLN :FLIP amide:sc= -0.0116 F(o=-1,f=-0.012) USER MOD Single : A 165 GLN : amide:sc= 0 K(o=0,f=-0.89) USER MOD Single : A 166 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 167 SER OG : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 21 N MET A 2 37.749 59.403 35.127 1.00 53.21 N ATOM 22 CA MET A 2 37.728 58.446 34.036 1.00 44.24 C ATOM 23 C MET A 2 39.099 57.820 33.879 1.00 10.23 C ATOM 24 O MET A 2 40.116 58.506 33.993 1.00 64.21 O ATOM 25 CB MET A 2 37.297 59.108 32.717 1.00 0.11 C ATOM 26 CG MET A 2 35.849 59.591 32.695 1.00 44.32 C ATOM 27 SD MET A 2 35.557 61.032 33.746 1.00 35.42 S ATOM 28 CE MET A 2 36.513 62.283 32.885 1.00 23.42 C ATOM 0 HA MET A 2 36.998 57.673 34.276 1.00 44.24 H new ATOM 0 HB2 MET A 2 37.953 59.956 32.520 1.00 0.11 H new ATOM 0 HB3 MET A 2 37.442 58.397 31.904 1.00 0.11 H new ATOM 0 HG2 MET A 2 35.571 59.836 31.670 1.00 44.32 H new ATOM 0 HG3 MET A 2 35.198 58.778 33.016 1.00 44.32 H new ATOM 0 HE1 MET A 2 36.166 63.273 33.180 1.00 23.42 H new ATOM 0 HE2 MET A 2 37.567 62.176 33.142 1.00 23.42 H new ATOM 0 HE3 MET A 2 36.388 62.160 31.809 1.00 23.42 H new ATOM 38 N ALA A 3 39.127 56.526 33.618 1.00 31.34 N ATOM 39 CA ALA A 3 40.374 55.790 33.482 1.00 12.41 C ATOM 40 C ALA A 3 40.093 54.384 32.971 1.00 62.43 C ATOM 41 O ALA A 3 39.091 54.154 32.292 1.00 4.11 O ATOM 42 CB ALA A 3 41.100 55.732 34.829 1.00 2.22 C ATOM 0 H ALA A 3 38.290 55.956 33.494 1.00 31.34 H new ATOM 0 HA ALA A 3 41.014 56.303 32.764 1.00 12.41 H new ATOM 0 HB1 ALA A 3 42.032 55.179 34.716 1.00 2.22 H new ATOM 0 HB2 ALA A 3 41.318 56.745 35.169 1.00 2.22 H new ATOM 0 HB3 ALA A 3 40.467 55.231 35.562 1.00 2.22 H new ATOM 48 N SER A 4 40.962 53.454 33.307 1.00 50.42 N ATOM 49 CA SER A 4 40.822 52.083 32.881 1.00 30.43 C ATOM 50 C SER A 4 41.576 51.171 33.839 1.00 24.45 C ATOM 51 O SER A 4 42.027 51.619 34.895 1.00 54.45 O ATOM 52 CB SER A 4 41.355 51.930 31.454 1.00 21.22 C ATOM 53 OG SER A 4 42.671 52.460 31.336 1.00 32.24 O ATOM 0 H SER A 4 41.785 53.630 33.884 1.00 50.42 H new ATOM 0 HA SER A 4 39.769 51.801 32.889 1.00 30.43 H new ATOM 0 HB2 SER A 4 41.358 50.876 31.175 1.00 21.22 H new ATOM 0 HB3 SER A 4 40.690 52.442 30.758 1.00 21.22 H new ATOM 0 HG SER A 4 42.988 52.348 30.415 1.00 32.24 H new ATOM 59 N ASP A 5 41.710 49.907 33.490 1.00 62.24 N ATOM 60 CA ASP A 5 42.426 48.976 34.346 1.00 4.33 C ATOM 61 C ASP A 5 43.926 49.148 34.172 1.00 0.34 C ATOM 62 O ASP A 5 44.676 49.125 35.147 1.00 51.12 O ATOM 63 CB ASP A 5 42.013 47.531 34.051 1.00 11.32 C ATOM 64 CG ASP A 5 42.684 46.535 34.978 1.00 44.04 C ATOM 65 OD1 ASP A 5 42.389 46.551 36.198 1.00 10.10 O ATOM 66 OD2 ASP A 5 43.506 45.732 34.501 1.00 45.44 O ATOM 0 H ASP A 5 41.338 49.502 32.631 1.00 62.24 H new ATOM 0 HA ASP A 5 42.166 49.195 35.382 1.00 4.33 H new ATOM 0 HB2 ASP A 5 40.931 47.439 34.146 1.00 11.32 H new ATOM 0 HB3 ASP A 5 42.264 47.288 33.019 1.00 11.32 H new ATOM 71 N ASP A 6 44.340 49.365 32.922 1.00 15.45 N ATOM 72 CA ASP A 6 45.753 49.554 32.560 1.00 52.42 C ATOM 73 C ASP A 6 46.591 48.349 32.942 1.00 24.50 C ATOM 74 O ASP A 6 47.085 48.245 34.070 1.00 1.21 O ATOM 75 CB ASP A 6 46.337 50.833 33.176 1.00 32.53 C ATOM 76 CG ASP A 6 47.800 51.030 32.819 1.00 3.33 C ATOM 77 OD1 ASP A 6 48.111 51.191 31.622 1.00 63.43 O ATOM 78 OD2 ASP A 6 48.650 51.040 33.739 1.00 21.54 O ATOM 0 H ASP A 6 43.704 49.415 32.126 1.00 15.45 H new ATOM 0 HA ASP A 6 45.786 49.662 31.476 1.00 52.42 H new ATOM 0 HB2 ASP A 6 45.763 51.694 32.833 1.00 32.53 H new ATOM 0 HB3 ASP A 6 46.232 50.792 34.260 1.00 32.53 H new ATOM 83 N ARG A 7 46.747 47.438 32.007 1.00 14.21 N ATOM 84 CA ARG A 7 47.503 46.232 32.250 1.00 31.14 C ATOM 85 C ARG A 7 48.362 45.863 31.045 1.00 2.35 C ATOM 86 O ARG A 7 48.010 46.175 29.902 1.00 14.23 O ATOM 87 CB ARG A 7 46.565 45.074 32.666 1.00 61.45 C ATOM 88 CG ARG A 7 45.326 44.875 31.782 1.00 75.41 C ATOM 89 CD ARG A 7 45.673 44.257 30.437 1.00 60.42 C ATOM 90 NE ARG A 7 46.415 43.005 30.590 1.00 32.12 N ATOM 91 CZ ARG A 7 47.171 42.457 29.639 1.00 23.05 C ATOM 92 NH1 ARG A 7 47.283 43.045 28.450 1.00 61.40 N ATOM 93 NH2 ARG A 7 47.820 41.323 29.879 1.00 51.25 N ATOM 0 H ARG A 7 46.358 47.511 31.067 1.00 14.21 H new ATOM 0 HA ARG A 7 48.185 46.419 33.080 1.00 31.14 H new ATOM 0 HB2 ARG A 7 47.140 44.148 32.669 1.00 61.45 H new ATOM 0 HB3 ARG A 7 46.235 45.248 33.690 1.00 61.45 H new ATOM 0 HG2 ARG A 7 44.611 44.236 32.300 1.00 75.41 H new ATOM 0 HG3 ARG A 7 44.837 45.836 31.623 1.00 75.41 H new ATOM 0 HD2 ARG A 7 44.758 44.071 29.875 1.00 60.42 H new ATOM 0 HD3 ARG A 7 46.266 44.962 29.855 1.00 60.42 H new ATOM 0 HE ARG A 7 46.349 42.519 31.484 1.00 32.12 H new ATOM 0 HH11 ARG A 7 46.789 43.918 28.264 1.00 61.40 H new ATOM 0 HH12 ARG A 7 47.863 42.623 27.725 1.00 61.40 H new ATOM 0 HH21 ARG A 7 47.739 40.872 30.791 1.00 51.25 H new ATOM 0 HH22 ARG A 7 48.399 40.903 29.152 1.00 51.25 H new ATOM 107 N ALA A 8 49.483 45.214 31.311 1.00 20.51 N ATOM 108 CA ALA A 8 50.411 44.793 30.275 1.00 34.24 C ATOM 109 C ALA A 8 51.410 43.806 30.851 1.00 74.14 C ATOM 110 O ALA A 8 51.954 44.025 31.934 1.00 1.33 O ATOM 111 CB ALA A 8 51.141 45.996 29.687 1.00 33.34 C ATOM 0 H ALA A 8 49.776 44.963 32.255 1.00 20.51 H new ATOM 0 HA ALA A 8 49.848 44.309 29.477 1.00 34.24 H new ATOM 0 HB1 ALA A 8 51.831 45.660 28.913 1.00 33.34 H new ATOM 0 HB2 ALA A 8 50.416 46.685 29.253 1.00 33.34 H new ATOM 0 HB3 ALA A 8 51.698 46.504 30.474 1.00 33.34 H new ATOM 117 N THR A 9 51.644 42.724 30.139 1.00 2.31 N ATOM 118 CA THR A 9 52.564 41.709 30.597 1.00 24.11 C ATOM 119 C THR A 9 53.211 40.999 29.411 1.00 2.41 C ATOM 120 O THR A 9 52.607 40.878 28.338 1.00 63.25 O ATOM 121 CB THR A 9 51.848 40.677 31.509 1.00 74.32 C ATOM 122 OG1 THR A 9 52.790 39.740 32.044 1.00 71.42 O ATOM 123 CG2 THR A 9 50.772 39.923 30.741 1.00 45.23 C ATOM 0 H THR A 9 51.208 42.526 29.239 1.00 2.31 H new ATOM 0 HA THR A 9 53.341 42.202 31.181 1.00 24.11 H new ATOM 0 HB THR A 9 51.380 41.228 32.325 1.00 74.32 H new ATOM 0 HG1 THR A 9 52.323 39.098 32.618 1.00 71.42 H new ATOM 0 HG21 THR A 9 50.286 39.207 31.404 1.00 45.23 H new ATOM 0 HG22 THR A 9 50.032 40.629 30.364 1.00 45.23 H new ATOM 0 HG23 THR A 9 51.226 39.393 29.904 1.00 45.23 H new ATOM 131 N GLY A 10 54.439 40.552 29.597 1.00 64.40 N ATOM 132 CA GLY A 10 55.133 39.847 28.549 1.00 25.32 C ATOM 133 C GLY A 10 56.094 38.813 29.097 1.00 52.53 C ATOM 134 O GLY A 10 57.307 39.039 29.112 1.00 35.30 O ATOM 0 H GLY A 10 54.969 40.666 30.461 1.00 64.40 H new ATOM 0 HA2 GLY A 10 54.407 39.358 27.899 1.00 25.32 H new ATOM 0 HA3 GLY A 10 55.681 40.561 27.934 1.00 25.32 H new ATOM 138 N PRO A 11 55.578 37.667 29.576 1.00 3.33 N ATOM 139 CA PRO A 11 56.403 36.583 30.119 1.00 35.20 C ATOM 140 C PRO A 11 57.150 35.837 29.023 1.00 4.33 C ATOM 141 O PRO A 11 56.628 35.649 27.916 1.00 24.24 O ATOM 142 CB PRO A 11 55.382 35.650 30.801 1.00 4.33 C ATOM 143 CG PRO A 11 54.093 36.410 30.808 1.00 3.42 C ATOM 144 CD PRO A 11 54.155 37.336 29.637 1.00 62.21 C ATOM 0 HA PRO A 11 57.171 36.956 30.797 1.00 35.20 H new ATOM 0 HB2 PRO A 11 55.282 34.711 30.256 1.00 4.33 H new ATOM 0 HB3 PRO A 11 55.695 35.398 31.814 1.00 4.33 H new ATOM 0 HG2 PRO A 11 53.241 35.735 30.727 1.00 3.42 H new ATOM 0 HG3 PRO A 11 53.972 36.965 31.738 1.00 3.42 H new ATOM 0 HD2 PRO A 11 53.809 36.857 28.721 1.00 62.21 H new ATOM 0 HD3 PRO A 11 53.538 38.222 29.786 1.00 62.21 H new ATOM 209 N LEU A 16 62.743 23.689 27.421 1.00 35.34 N ATOM 210 CA LEU A 16 63.671 22.581 27.302 1.00 15.53 C ATOM 211 C LEU A 16 62.943 21.257 27.367 1.00 61.22 C ATOM 212 O LEU A 16 61.863 21.158 27.954 1.00 72.42 O ATOM 213 CB LEU A 16 64.799 22.659 28.367 1.00 32.33 C ATOM 214 CG LEU A 16 64.380 22.941 29.827 1.00 1.45 C ATOM 215 CD1 LEU A 16 63.664 21.751 30.451 1.00 21.42 C ATOM 216 CD2 LEU A 16 65.595 23.320 30.656 1.00 51.31 C ATOM 0 HA LEU A 16 64.147 22.655 26.324 1.00 15.53 H new ATOM 0 HB2 LEU A 16 65.345 21.716 28.349 1.00 32.33 H new ATOM 0 HB3 LEU A 16 65.498 23.437 28.061 1.00 32.33 H new ATOM 0 HG LEU A 16 63.679 23.775 29.815 1.00 1.45 H new ATOM 0 HD11 LEU A 16 63.386 21.991 31.477 1.00 21.42 H new ATOM 0 HD12 LEU A 16 62.766 21.524 29.876 1.00 21.42 H new ATOM 0 HD13 LEU A 16 64.326 20.885 30.447 1.00 21.42 H new ATOM 0 HD21 LEU A 16 65.288 23.517 31.683 1.00 51.31 H new ATOM 0 HD22 LEU A 16 66.314 22.501 30.643 1.00 51.31 H new ATOM 0 HD23 LEU A 16 66.056 24.215 30.238 1.00 51.31 H new ATOM 228 N VAL A 17 63.519 20.255 26.751 1.00 3.23 N ATOM 229 CA VAL A 17 62.931 18.934 26.734 1.00 64.43 C ATOM 230 C VAL A 17 63.435 18.103 27.905 1.00 64.40 C ATOM 231 O VAL A 17 64.287 18.551 28.675 1.00 24.25 O ATOM 232 CB VAL A 17 63.225 18.196 25.410 1.00 45.30 C ATOM 233 CG1 VAL A 17 62.638 18.959 24.234 1.00 70.53 C ATOM 234 CG2 VAL A 17 64.722 17.990 25.223 1.00 34.01 C ATOM 0 H VAL A 17 64.404 20.328 26.249 1.00 3.23 H new ATOM 0 HA VAL A 17 61.852 19.062 26.823 1.00 64.43 H new ATOM 0 HB VAL A 17 62.753 17.215 25.455 1.00 45.30 H new ATOM 0 HG11 VAL A 17 62.855 18.425 23.309 1.00 70.53 H new ATOM 0 HG12 VAL A 17 61.559 19.046 24.359 1.00 70.53 H new ATOM 0 HG13 VAL A 17 63.079 19.955 24.190 1.00 70.53 H new ATOM 0 HG21 VAL A 17 64.903 17.468 24.283 1.00 34.01 H new ATOM 0 HG22 VAL A 17 65.223 18.958 25.203 1.00 34.01 H new ATOM 0 HG23 VAL A 17 65.114 17.396 26.049 1.00 34.01 H new ATOM 244 N VAL A 18 62.907 16.906 28.038 1.00 65.42 N ATOM 245 CA VAL A 18 63.310 16.006 29.094 1.00 52.24 C ATOM 246 C VAL A 18 63.099 14.553 28.666 1.00 23.23 C ATOM 247 O VAL A 18 61.976 14.135 28.361 1.00 1.00 O ATOM 248 CB VAL A 18 62.554 16.306 30.425 1.00 1.14 C ATOM 249 CG1 VAL A 18 61.042 16.277 30.233 1.00 4.44 C ATOM 250 CG2 VAL A 18 62.980 15.337 31.516 1.00 51.31 C ATOM 0 H VAL A 18 62.188 16.531 27.419 1.00 65.42 H new ATOM 0 HA VAL A 18 64.372 16.165 29.280 1.00 52.24 H new ATOM 0 HB VAL A 18 62.824 17.315 30.736 1.00 1.14 H new ATOM 0 HG11 VAL A 18 60.551 16.490 31.182 1.00 4.44 H new ATOM 0 HG12 VAL A 18 60.754 17.029 29.498 1.00 4.44 H new ATOM 0 HG13 VAL A 18 60.739 15.291 29.881 1.00 4.44 H new ATOM 0 HG21 VAL A 18 62.441 15.564 32.435 1.00 51.31 H new ATOM 0 HG22 VAL A 18 62.754 14.317 31.205 1.00 51.31 H new ATOM 0 HG23 VAL A 18 64.052 15.434 31.691 1.00 51.31 H new ATOM 260 N ALA A 19 64.183 13.794 28.620 1.00 42.42 N ATOM 261 CA ALA A 19 64.127 12.403 28.205 1.00 55.42 C ATOM 262 C ALA A 19 65.426 11.687 28.537 1.00 5.43 C ATOM 263 O ALA A 19 66.519 12.159 28.190 1.00 52.24 O ATOM 264 CB ALA A 19 63.842 12.304 26.710 1.00 65.04 C ATOM 0 H ALA A 19 65.117 14.122 28.867 1.00 42.42 H new ATOM 0 HA ALA A 19 63.317 11.920 28.751 1.00 55.42 H new ATOM 0 HB1 ALA A 19 63.803 11.255 26.416 1.00 65.04 H new ATOM 0 HB2 ALA A 19 62.886 12.778 26.490 1.00 65.04 H new ATOM 0 HB3 ALA A 19 64.633 12.808 26.155 1.00 65.04 H new ATOM 270 N ALA A 20 65.301 10.551 29.201 1.00 1.13 N ATOM 271 CA ALA A 20 66.442 9.746 29.598 1.00 2.35 C ATOM 272 C ALA A 20 65.975 8.388 30.095 1.00 41.32 C ATOM 273 O ALA A 20 65.465 8.270 31.211 1.00 12.34 O ATOM 274 CB ALA A 20 67.255 10.453 30.678 1.00 65.14 C ATOM 0 H ALA A 20 64.401 10.160 29.481 1.00 1.13 H new ATOM 0 HA ALA A 20 67.082 9.604 28.728 1.00 2.35 H new ATOM 0 HB1 ALA A 20 68.105 9.831 30.960 1.00 65.14 H new ATOM 0 HB2 ALA A 20 67.615 11.408 30.296 1.00 65.14 H new ATOM 0 HB3 ALA A 20 66.627 10.626 31.552 1.00 65.14 H new ATOM 280 N ALA A 21 66.130 7.377 29.260 1.00 24.14 N ATOM 281 CA ALA A 21 65.730 6.017 29.595 1.00 22.21 C ATOM 282 C ALA A 21 66.262 5.055 28.552 1.00 63.14 C ATOM 283 O ALA A 21 66.166 5.322 27.351 1.00 31.01 O ATOM 284 CB ALA A 21 64.213 5.906 29.685 1.00 62.33 C ATOM 0 H ALA A 21 66.537 7.473 28.329 1.00 24.14 H new ATOM 0 HA ALA A 21 66.149 5.761 30.568 1.00 22.21 H new ATOM 0 HB1 ALA A 21 63.937 4.882 29.936 1.00 62.33 H new ATOM 0 HB2 ALA A 21 63.844 6.581 30.457 1.00 62.33 H new ATOM 0 HB3 ALA A 21 63.771 6.176 28.726 1.00 62.33 H new ATOM 290 N ALA A 22 66.814 3.942 29.002 1.00 14.23 N ATOM 291 CA ALA A 22 67.378 2.946 28.105 1.00 62.23 C ATOM 292 C ALA A 22 67.607 1.639 28.839 1.00 22.25 C ATOM 293 O ALA A 22 67.653 1.606 30.071 1.00 5.11 O ATOM 294 CB ALA A 22 68.689 3.448 27.504 1.00 63.15 C ATOM 0 H ALA A 22 66.884 3.703 29.991 1.00 14.23 H new ATOM 0 HA ALA A 22 66.668 2.773 27.297 1.00 62.23 H new ATOM 0 HB1 ALA A 22 69.097 2.690 26.835 1.00 63.15 H new ATOM 0 HB2 ALA A 22 68.505 4.365 26.944 1.00 63.15 H new ATOM 0 HB3 ALA A 22 69.402 3.648 28.303 1.00 63.15 H new ATOM 300 N THR A 23 67.753 0.567 28.086 1.00 34.34 N ATOM 301 CA THR A 23 67.981 -0.738 28.656 1.00 23.43 C ATOM 302 C THR A 23 68.751 -1.625 27.672 1.00 33.14 C ATOM 303 O THR A 23 68.200 -2.119 26.685 1.00 13.20 O ATOM 304 CB THR A 23 66.642 -1.415 29.091 1.00 52.41 C ATOM 305 OG1 THR A 23 66.882 -2.744 29.578 1.00 45.43 O ATOM 306 CG2 THR A 23 65.631 -1.453 27.944 1.00 21.44 C ATOM 0 H THR A 23 67.717 0.580 27.067 1.00 34.34 H new ATOM 0 HA THR A 23 68.587 -0.611 29.553 1.00 23.43 H new ATOM 0 HB THR A 23 66.219 -0.812 29.894 1.00 52.41 H new ATOM 0 HG1 THR A 23 66.033 -3.152 29.847 1.00 45.43 H new ATOM 0 HG21 THR A 23 64.712 -1.931 28.284 1.00 21.44 H new ATOM 0 HG22 THR A 23 65.412 -0.436 27.618 1.00 21.44 H new ATOM 0 HG23 THR A 23 66.047 -2.019 27.111 1.00 21.44 H new ATOM 314 N SER A 24 70.036 -1.804 27.938 1.00 3.12 N ATOM 315 CA SER A 24 70.904 -2.595 27.073 1.00 71.32 C ATOM 316 C SER A 24 72.170 -3.001 27.816 1.00 55.10 C ATOM 317 O SER A 24 73.011 -2.158 28.127 1.00 14.25 O ATOM 318 CB SER A 24 71.306 -1.786 25.828 1.00 31.35 C ATOM 319 OG SER A 24 70.174 -1.299 25.118 1.00 62.51 O ATOM 0 H SER A 24 70.506 -1.409 28.753 1.00 3.12 H new ATOM 0 HA SER A 24 70.352 -3.485 26.772 1.00 71.32 H new ATOM 0 HB2 SER A 24 71.933 -0.947 26.128 1.00 31.35 H new ATOM 0 HB3 SER A 24 71.906 -2.412 25.167 1.00 31.35 H new ATOM 0 HG SER A 24 69.383 -1.823 25.364 1.00 62.51 H new ATOM 325 N ALA A 25 72.289 -4.280 28.121 1.00 24.00 N ATOM 326 CA ALA A 25 73.476 -4.801 28.773 1.00 55.30 C ATOM 327 C ALA A 25 74.606 -4.948 27.762 1.00 44.43 C ATOM 328 O ALA A 25 75.733 -5.290 28.121 1.00 11.41 O ATOM 329 CB ALA A 25 73.178 -6.133 29.447 1.00 13.30 C ATOM 0 H ALA A 25 71.574 -4.981 27.926 1.00 24.00 H new ATOM 0 HA ALA A 25 73.789 -4.097 29.544 1.00 55.30 H new ATOM 0 HB1 ALA A 25 74.081 -6.506 29.930 1.00 13.30 H new ATOM 0 HB2 ALA A 25 72.397 -5.996 30.195 1.00 13.30 H new ATOM 0 HB3 ALA A 25 72.842 -6.852 28.700 1.00 13.30 H new ATOM 335 N LYS A 26 74.269 -4.705 26.482 1.00 53.10 N ATOM 336 CA LYS A 26 75.212 -4.782 25.366 1.00 71.12 C ATOM 337 C LYS A 26 75.512 -6.246 25.044 1.00 20.44 C ATOM 338 O LYS A 26 76.603 -6.603 24.582 1.00 10.32 O ATOM 339 CB LYS A 26 76.496 -3.979 25.681 1.00 73.03 C ATOM 340 CG LYS A 26 77.433 -3.773 24.493 1.00 54.44 C ATOM 341 CD LYS A 26 78.560 -2.805 24.839 1.00 34.12 C ATOM 342 CE LYS A 26 79.390 -3.302 26.015 1.00 51.52 C ATOM 343 NZ LYS A 26 80.417 -2.314 26.425 1.00 43.01 N ATOM 0 H LYS A 26 73.324 -4.448 26.197 1.00 53.10 H new ATOM 0 HA LYS A 26 74.765 -4.330 24.481 1.00 71.12 H new ATOM 0 HB2 LYS A 26 76.210 -3.003 26.073 1.00 73.03 H new ATOM 0 HB3 LYS A 26 77.043 -4.492 26.472 1.00 73.03 H new ATOM 0 HG2 LYS A 26 77.854 -4.731 24.188 1.00 54.44 H new ATOM 0 HG3 LYS A 26 76.868 -3.389 23.644 1.00 54.44 H new ATOM 0 HD2 LYS A 26 79.204 -2.671 23.970 1.00 34.12 H new ATOM 0 HD3 LYS A 26 78.140 -1.828 25.078 1.00 34.12 H new ATOM 0 HE2 LYS A 26 78.733 -3.514 26.859 1.00 51.52 H new ATOM 0 HE3 LYS A 26 79.876 -4.240 25.746 1.00 51.52 H new ATOM 0 HZ1 LYS A 26 80.960 -2.691 27.228 1.00 43.01 H new ATOM 0 HZ2 LYS A 26 81.060 -2.130 25.628 1.00 43.01 H new ATOM 0 HZ3 LYS A 26 79.953 -1.427 26.707 1.00 43.01 H new ATOM 357 N VAL A 27 74.515 -7.090 25.272 1.00 0.51 N ATOM 358 CA VAL A 27 74.636 -8.517 25.023 1.00 63.32 C ATOM 359 C VAL A 27 73.242 -9.123 24.741 1.00 3.31 C ATOM 360 O VAL A 27 72.997 -10.316 24.945 1.00 30.01 O ATOM 361 CB VAL A 27 75.322 -9.228 26.229 1.00 53.11 C ATOM 362 CG1 VAL A 27 74.433 -9.221 27.465 1.00 72.43 C ATOM 363 CG2 VAL A 27 75.765 -10.642 25.865 1.00 24.14 C ATOM 0 H VAL A 27 73.605 -6.805 25.633 1.00 0.51 H new ATOM 0 HA VAL A 27 75.263 -8.671 24.145 1.00 63.32 H new ATOM 0 HB VAL A 27 76.219 -8.658 26.474 1.00 53.11 H new ATOM 0 HG11 VAL A 27 74.945 -9.725 28.284 1.00 72.43 H new ATOM 0 HG12 VAL A 27 74.216 -8.192 27.751 1.00 72.43 H new ATOM 0 HG13 VAL A 27 73.500 -9.741 27.245 1.00 72.43 H new ATOM 0 HG21 VAL A 27 76.239 -11.108 26.729 1.00 24.14 H new ATOM 0 HG22 VAL A 27 74.897 -11.230 25.566 1.00 24.14 H new ATOM 0 HG23 VAL A 27 76.476 -10.599 25.040 1.00 24.14 H new ATOM 799 N VAL A 60 11.710 9.590 -1.911 1.00 25.03 N ATOM 800 CA VAL A 60 10.390 10.110 -1.595 1.00 60.43 C ATOM 801 C VAL A 60 9.661 10.556 -2.851 1.00 44.42 C ATOM 802 O VAL A 60 10.273 10.763 -3.904 1.00 75.11 O ATOM 803 CB VAL A 60 10.456 11.291 -0.596 1.00 62.45 C ATOM 804 CG1 VAL A 60 11.065 10.843 0.719 1.00 52.13 C ATOM 805 CG2 VAL A 60 11.240 12.459 -1.181 1.00 73.44 C ATOM 0 HA VAL A 60 9.839 9.293 -1.129 1.00 60.43 H new ATOM 0 HB VAL A 60 9.438 11.631 -0.407 1.00 62.45 H new ATOM 0 HG11 VAL A 60 11.103 11.686 1.408 1.00 52.13 H new ATOM 0 HG12 VAL A 60 10.456 10.049 1.150 1.00 52.13 H new ATOM 0 HG13 VAL A 60 12.075 10.471 0.544 1.00 52.13 H new ATOM 0 HG21 VAL A 60 11.271 13.275 -0.459 1.00 73.44 H new ATOM 0 HG22 VAL A 60 12.256 12.137 -1.409 1.00 73.44 H new ATOM 0 HG23 VAL A 60 10.755 12.802 -2.095 1.00 73.44 H new ATOM 815 N LEU A 61 8.355 10.694 -2.741 1.00 71.30 N ATOM 816 CA LEU A 61 7.542 11.109 -3.856 1.00 13.31 C ATOM 817 C LEU A 61 7.331 12.617 -3.831 1.00 54.02 C ATOM 818 O LEU A 61 6.442 13.124 -3.151 1.00 33.20 O ATOM 819 CB LEU A 61 6.198 10.364 -3.842 1.00 72.45 C ATOM 820 CG LEU A 61 5.206 10.730 -4.953 1.00 53.04 C ATOM 821 CD1 LEU A 61 5.841 10.568 -6.321 1.00 21.31 C ATOM 822 CD2 LEU A 61 3.959 9.871 -4.850 1.00 11.35 C ATOM 0 H LEU A 61 7.835 10.522 -1.881 1.00 71.30 H new ATOM 0 HA LEU A 61 8.061 10.857 -4.781 1.00 13.31 H new ATOM 0 HB2 LEU A 61 6.399 9.294 -3.902 1.00 72.45 H new ATOM 0 HB3 LEU A 61 5.717 10.545 -2.881 1.00 72.45 H new ATOM 0 HG LEU A 61 4.926 11.776 -4.827 1.00 53.04 H new ATOM 0 HD11 LEU A 61 5.117 10.834 -7.092 1.00 21.31 H new ATOM 0 HD12 LEU A 61 6.710 11.221 -6.398 1.00 21.31 H new ATOM 0 HD13 LEU A 61 6.153 9.532 -6.457 1.00 21.31 H new ATOM 0 HD21 LEU A 61 3.264 10.142 -5.645 1.00 11.35 H new ATOM 0 HD22 LEU A 61 4.232 8.820 -4.949 1.00 11.35 H new ATOM 0 HD23 LEU A 61 3.484 10.033 -3.882 1.00 11.35 H new ATOM 834 N SER A 62 8.179 13.329 -4.541 1.00 44.04 N ATOM 835 CA SER A 62 8.071 14.768 -4.627 1.00 53.34 C ATOM 836 C SER A 62 8.085 15.212 -6.074 1.00 12.12 C ATOM 837 O SER A 62 9.125 15.572 -6.627 1.00 30.04 O ATOM 838 CB SER A 62 9.190 15.446 -3.840 1.00 4.23 C ATOM 839 OG SER A 62 9.183 15.021 -2.484 1.00 33.42 O ATOM 0 H SER A 62 8.955 12.931 -5.070 1.00 44.04 H new ATOM 0 HA SER A 62 7.121 15.068 -4.184 1.00 53.34 H new ATOM 0 HB2 SER A 62 10.153 15.212 -4.294 1.00 4.23 H new ATOM 0 HB3 SER A 62 9.070 16.528 -3.887 1.00 4.23 H new ATOM 0 HG SER A 62 9.908 15.466 -1.998 1.00 33.42 H new ATOM 845 N ALA A 63 6.937 15.119 -6.691 1.00 4.33 N ATOM 846 CA ALA A 63 6.764 15.508 -8.062 1.00 53.35 C ATOM 847 C ALA A 63 5.463 16.290 -8.200 1.00 32.41 C ATOM 848 O ALA A 63 4.603 16.209 -7.315 1.00 74.32 O ATOM 849 CB ALA A 63 6.754 14.268 -8.939 1.00 60.43 C ATOM 0 H ALA A 63 6.088 14.767 -6.249 1.00 4.33 H new ATOM 0 HA ALA A 63 7.587 16.147 -8.381 1.00 53.35 H new ATOM 0 HB1 ALA A 63 6.623 14.560 -9.981 1.00 60.43 H new ATOM 0 HB2 ALA A 63 7.699 13.736 -8.828 1.00 60.43 H new ATOM 0 HB3 ALA A 63 5.933 13.617 -8.639 1.00 60.43 H new ATOM 855 N PRO A 64 5.302 17.077 -9.278 1.00 61.50 N ATOM 856 CA PRO A 64 4.070 17.837 -9.517 1.00 74.43 C ATOM 857 C PRO A 64 2.852 16.917 -9.605 1.00 42.42 C ATOM 858 O PRO A 64 2.867 15.919 -10.336 1.00 72.31 O ATOM 859 CB PRO A 64 4.321 18.518 -10.870 1.00 34.52 C ATOM 860 CG PRO A 64 5.801 18.541 -11.017 1.00 42.51 C ATOM 861 CD PRO A 64 6.302 17.304 -10.337 1.00 13.40 C ATOM 0 HA PRO A 64 3.856 18.539 -8.711 1.00 74.43 H new ATOM 0 HB2 PRO A 64 3.852 17.965 -11.684 1.00 34.52 H new ATOM 0 HB3 PRO A 64 3.906 19.526 -10.888 1.00 34.52 H new ATOM 0 HG2 PRO A 64 6.089 18.552 -12.068 1.00 42.51 H new ATOM 0 HG3 PRO A 64 6.225 19.436 -10.561 1.00 42.51 H new ATOM 0 HD2 PRO A 64 6.359 16.461 -11.025 1.00 13.40 H new ATOM 0 HD3 PRO A 64 7.301 17.447 -9.925 1.00 13.40 H new ATOM 869 N LEU A 65 1.801 17.256 -8.879 1.00 23.12 N ATOM 870 CA LEU A 65 0.599 16.443 -8.857 1.00 31.11 C ATOM 871 C LEU A 65 -0.144 16.549 -10.179 1.00 64.21 C ATOM 872 O LEU A 65 -0.492 17.643 -10.628 1.00 5.44 O ATOM 873 CB LEU A 65 -0.324 16.820 -7.682 1.00 3.10 C ATOM 874 CG LEU A 65 -0.667 18.309 -7.532 1.00 11.43 C ATOM 875 CD1 LEU A 65 -2.080 18.471 -7.004 1.00 34.51 C ATOM 876 CD2 LEU A 65 0.319 18.992 -6.588 1.00 74.02 C ATOM 0 H LEU A 65 1.756 18.091 -8.295 1.00 23.12 H new ATOM 0 HA LEU A 65 0.906 15.407 -8.712 1.00 31.11 H new ATOM 0 HB2 LEU A 65 -1.256 16.264 -7.788 1.00 3.10 H new ATOM 0 HB3 LEU A 65 0.145 16.483 -6.758 1.00 3.10 H new ATOM 0 HG LEU A 65 -0.597 18.778 -8.513 1.00 11.43 H new ATOM 0 HD11 LEU A 65 -2.311 19.531 -6.902 1.00 34.51 H new ATOM 0 HD12 LEU A 65 -2.783 18.012 -7.699 1.00 34.51 H new ATOM 0 HD13 LEU A 65 -2.163 17.987 -6.031 1.00 34.51 H new ATOM 0 HD21 LEU A 65 0.061 20.047 -6.493 1.00 74.02 H new ATOM 0 HD22 LEU A 65 0.272 18.518 -5.608 1.00 74.02 H new ATOM 0 HD23 LEU A 65 1.329 18.900 -6.988 1.00 74.02 H new ATOM 888 N GLY A 66 -0.361 15.413 -10.803 1.00 1.22 N ATOM 889 CA GLY A 66 -1.022 15.380 -12.086 1.00 25.33 C ATOM 890 C GLY A 66 -0.067 14.953 -13.168 1.00 61.33 C ATOM 891 O GLY A 66 -0.453 14.285 -14.130 1.00 74.15 O ATOM 0 H GLY A 66 -0.089 14.499 -10.441 1.00 1.22 H new ATOM 0 HA2 GLY A 66 -1.866 14.692 -12.048 1.00 25.33 H new ATOM 0 HA3 GLY A 66 -1.425 16.366 -12.318 1.00 25.33 H new ATOM 895 N SER A 67 1.187 15.351 -13.006 1.00 13.04 N ATOM 896 CA SER A 67 2.247 14.996 -13.928 1.00 70.30 C ATOM 897 C SER A 67 2.446 13.483 -13.963 1.00 71.42 C ATOM 898 O SER A 67 2.227 12.790 -12.959 1.00 54.24 O ATOM 899 CB SER A 67 3.553 15.690 -13.518 1.00 51.40 C ATOM 900 OG SER A 67 4.619 15.348 -14.391 1.00 41.32 O ATOM 0 H SER A 67 1.495 15.932 -12.226 1.00 13.04 H new ATOM 0 HA SER A 67 1.964 15.329 -14.926 1.00 70.30 H new ATOM 0 HB2 SER A 67 3.409 16.770 -13.523 1.00 51.40 H new ATOM 0 HB3 SER A 67 3.812 15.407 -12.498 1.00 51.40 H new ATOM 0 HG SER A 67 5.436 15.807 -14.105 1.00 41.32 H new ATOM 906 N HIS A 68 2.873 12.977 -15.108 1.00 43.12 N ATOM 907 CA HIS A 68 3.134 11.556 -15.261 1.00 22.33 C ATOM 908 C HIS A 68 4.306 11.141 -14.395 1.00 21.22 C ATOM 909 O HIS A 68 4.376 10.007 -13.941 1.00 25.03 O ATOM 910 CB HIS A 68 3.411 11.201 -16.723 1.00 21.51 C ATOM 911 CG HIS A 68 2.198 11.248 -17.596 1.00 22.21 C ATOM 912 ND1 HIS A 68 1.978 12.236 -18.528 1.00 4.31 N ATOM 913 CD2 HIS A 68 1.137 10.415 -17.681 1.00 31.13 C ATOM 914 CE1 HIS A 68 0.838 12.009 -19.144 1.00 63.30 C ATOM 915 NE2 HIS A 68 0.308 10.911 -18.650 1.00 23.44 N ATOM 0 H HIS A 68 3.046 13.531 -15.947 1.00 43.12 H new ATOM 0 HA HIS A 68 2.244 11.014 -14.941 1.00 22.33 H new ATOM 0 HB2 HIS A 68 4.159 11.888 -17.119 1.00 21.51 H new ATOM 0 HB3 HIS A 68 3.842 10.201 -16.769 1.00 21.51 H new ATOM 0 HD2 HIS A 68 0.974 9.524 -17.093 1.00 31.13 H new ATOM 0 HE1 HIS A 68 0.409 12.621 -19.924 1.00 63.30 H new ATOM 0 HE2 HIS A 68 -0.577 10.497 -18.942 1.00 23.44 H new ATOM 924 N GLU A 69 5.215 12.083 -14.150 1.00 42.05 N ATOM 925 CA GLU A 69 6.386 11.832 -13.319 1.00 64.44 C ATOM 926 C GLU A 69 5.972 11.412 -11.912 1.00 50.11 C ATOM 927 O GLU A 69 6.541 10.480 -11.333 1.00 12.12 O ATOM 928 CB GLU A 69 7.271 13.076 -13.263 1.00 41.32 C ATOM 929 CG GLU A 69 8.467 12.936 -12.340 1.00 31.54 C ATOM 930 CD GLU A 69 9.389 14.125 -12.409 1.00 30.21 C ATOM 931 OE1 GLU A 69 9.125 15.131 -11.723 1.00 54.31 O ATOM 932 OE2 GLU A 69 10.385 14.058 -13.154 1.00 15.52 O ATOM 0 H GLU A 69 5.160 13.032 -14.519 1.00 42.05 H new ATOM 0 HA GLU A 69 6.954 11.016 -13.765 1.00 64.44 H new ATOM 0 HB2 GLU A 69 7.625 13.304 -14.268 1.00 41.32 H new ATOM 0 HB3 GLU A 69 6.669 13.924 -12.936 1.00 41.32 H new ATOM 0 HG2 GLU A 69 8.118 12.809 -11.315 1.00 31.54 H new ATOM 0 HG3 GLU A 69 9.021 12.035 -12.602 1.00 31.54 H new ATOM 939 N TRP A 70 4.970 12.087 -11.374 1.00 21.22 N ATOM 940 CA TRP A 70 4.460 11.780 -10.051 1.00 52.43 C ATOM 941 C TRP A 70 3.789 10.415 -10.056 1.00 43.22 C ATOM 942 O TRP A 70 3.978 9.619 -9.137 1.00 73.10 O ATOM 943 CB TRP A 70 3.457 12.869 -9.642 1.00 12.51 C ATOM 944 CG TRP A 70 2.889 12.722 -8.263 1.00 62.44 C ATOM 945 CD1 TRP A 70 3.417 13.203 -7.103 1.00 41.41 C ATOM 946 CD2 TRP A 70 1.668 12.066 -7.907 1.00 41.21 C ATOM 947 NE1 TRP A 70 2.603 12.881 -6.046 1.00 60.31 N ATOM 948 CE2 TRP A 70 1.524 12.182 -6.513 1.00 20.53 C ATOM 949 CE3 TRP A 70 0.687 11.390 -8.632 1.00 62.42 C ATOM 950 CZ2 TRP A 70 0.437 11.648 -5.831 1.00 54.20 C ATOM 951 CZ3 TRP A 70 -0.389 10.862 -7.954 1.00 34.34 C ATOM 952 CH2 TRP A 70 -0.507 10.994 -6.567 1.00 43.41 C ATOM 0 H TRP A 70 4.491 12.858 -11.839 1.00 21.22 H new ATOM 0 HA TRP A 70 5.281 11.754 -9.334 1.00 52.43 H new ATOM 0 HB2 TRP A 70 3.948 13.840 -9.715 1.00 12.51 H new ATOM 0 HB3 TRP A 70 2.636 12.873 -10.358 1.00 12.51 H new ATOM 0 HD1 TRP A 70 4.341 13.757 -7.026 1.00 41.41 H new ATOM 0 HE1 TRP A 70 2.775 13.124 -5.070 1.00 60.31 H new ATOM 0 HE3 TRP A 70 0.770 11.283 -9.703 1.00 62.42 H new ATOM 0 HZ2 TRP A 70 0.343 11.747 -4.760 1.00 54.20 H new ATOM 0 HZ3 TRP A 70 -1.156 10.336 -8.504 1.00 34.34 H new ATOM 0 HH2 TRP A 70 -1.365 10.569 -6.067 1.00 43.41 H new ATOM 963 N GLN A 71 3.042 10.139 -11.108 1.00 2.52 N ATOM 964 CA GLN A 71 2.373 8.859 -11.253 1.00 51.21 C ATOM 965 C GLN A 71 3.396 7.723 -11.352 1.00 62.22 C ATOM 966 O GLN A 71 3.287 6.708 -10.656 1.00 53.43 O ATOM 967 CB GLN A 71 1.483 8.871 -12.485 1.00 11.53 C ATOM 968 CG GLN A 71 0.381 9.906 -12.424 1.00 40.53 C ATOM 969 CD GLN A 71 -0.505 9.877 -13.641 1.00 4.13 C ATOM 970 OE1 GLN A 71 -0.062 9.545 -14.741 1.00 33.11 O ATOM 971 NE2 GLN A 71 -1.759 10.215 -13.458 1.00 62.12 N ATOM 0 H GLN A 71 2.882 10.788 -11.879 1.00 2.52 H new ATOM 0 HA GLN A 71 1.755 8.690 -10.371 1.00 51.21 H new ATOM 0 HB2 GLN A 71 2.098 9.058 -13.366 1.00 11.53 H new ATOM 0 HB3 GLN A 71 1.037 7.884 -12.611 1.00 11.53 H new ATOM 0 HG2 GLN A 71 -0.224 9.736 -11.534 1.00 40.53 H new ATOM 0 HG3 GLN A 71 0.823 10.897 -12.324 1.00 40.53 H new ATOM 0 HE21 GLN A 71 -2.084 10.484 -12.529 1.00 62.12 H new ATOM 0 HE22 GLN A 71 -2.409 10.209 -14.244 1.00 62.12 H new ATOM 980 N GLN A 72 4.382 7.897 -12.232 1.00 62.31 N ATOM 981 CA GLN A 72 5.446 6.910 -12.423 1.00 64.40 C ATOM 982 C GLN A 72 6.199 6.637 -11.128 1.00 14.04 C ATOM 983 O GLN A 72 6.419 5.482 -10.767 1.00 41.42 O ATOM 984 CB GLN A 72 6.425 7.370 -13.502 1.00 74.31 C ATOM 985 CG GLN A 72 5.817 7.466 -14.891 1.00 63.44 C ATOM 986 CD GLN A 72 6.802 7.984 -15.916 1.00 24.35 C ATOM 987 OE1 GLN A 72 6.912 9.193 -16.137 1.00 72.41 O ATOM 988 NE2 GLN A 72 7.527 7.084 -16.540 1.00 55.42 N ATOM 0 H GLN A 72 4.466 8.720 -12.829 1.00 62.31 H new ATOM 0 HA GLN A 72 4.970 5.983 -12.743 1.00 64.40 H new ATOM 0 HB2 GLN A 72 6.824 8.345 -13.224 1.00 74.31 H new ATOM 0 HB3 GLN A 72 7.267 6.678 -13.533 1.00 74.31 H new ATOM 0 HG2 GLN A 72 5.461 6.483 -15.198 1.00 63.44 H new ATOM 0 HG3 GLN A 72 4.949 8.124 -14.860 1.00 63.44 H new ATOM 0 HE21 GLN A 72 7.405 6.094 -16.328 1.00 55.42 H new ATOM 0 HE22 GLN A 72 8.212 7.375 -17.237 1.00 55.42 H new ATOM 997 N THR A 73 6.581 7.696 -10.425 1.00 3.11 N ATOM 998 CA THR A 73 7.318 7.550 -9.180 1.00 64.15 C ATOM 999 C THR A 73 6.450 6.856 -8.123 1.00 24.54 C ATOM 1000 O THR A 73 6.923 5.979 -7.396 1.00 34.11 O ATOM 1001 CB THR A 73 7.802 8.920 -8.655 1.00 41.33 C ATOM 1002 OG1 THR A 73 8.487 9.624 -9.705 1.00 31.03 O ATOM 1003 CG2 THR A 73 8.746 8.746 -7.471 1.00 24.42 C ATOM 0 H THR A 73 6.393 8.661 -10.696 1.00 3.11 H new ATOM 0 HA THR A 73 8.194 6.933 -9.379 1.00 64.15 H new ATOM 0 HB THR A 73 6.931 9.489 -8.329 1.00 41.33 H new ATOM 0 HG1 THR A 73 7.840 10.141 -10.229 1.00 31.03 H new ATOM 0 HG21 THR A 73 9.073 9.725 -7.119 1.00 24.42 H new ATOM 0 HG22 THR A 73 8.228 8.226 -6.666 1.00 24.42 H new ATOM 0 HG23 THR A 73 9.614 8.163 -7.780 1.00 24.42 H new ATOM 1011 N PHE A 74 5.179 7.255 -8.048 1.00 33.41 N ATOM 1012 CA PHE A 74 4.225 6.615 -7.149 1.00 62.54 C ATOM 1013 C PHE A 74 4.157 5.116 -7.428 1.00 10.32 C ATOM 1014 O PHE A 74 4.227 4.299 -6.507 1.00 24.53 O ATOM 1015 CB PHE A 74 2.833 7.248 -7.305 1.00 71.31 C ATOM 1016 CG PHE A 74 1.745 6.528 -6.555 1.00 53.34 C ATOM 1017 CD1 PHE A 74 1.674 6.591 -5.173 1.00 60.40 C ATOM 1018 CD2 PHE A 74 0.795 5.780 -7.237 1.00 75.34 C ATOM 1019 CE1 PHE A 74 0.679 5.924 -4.485 1.00 12.40 C ATOM 1020 CE2 PHE A 74 -0.202 5.113 -6.556 1.00 43.31 C ATOM 1021 CZ PHE A 74 -0.261 5.184 -5.179 1.00 62.41 C ATOM 0 H PHE A 74 4.789 8.019 -8.600 1.00 33.41 H new ATOM 0 HA PHE A 74 4.562 6.765 -6.123 1.00 62.54 H new ATOM 0 HB2 PHE A 74 2.875 8.281 -6.961 1.00 71.31 H new ATOM 0 HB3 PHE A 74 2.574 7.275 -8.363 1.00 71.31 H new ATOM 0 HD1 PHE A 74 2.405 7.168 -4.627 1.00 60.40 H new ATOM 0 HD2 PHE A 74 0.837 5.720 -8.314 1.00 75.34 H new ATOM 0 HE1 PHE A 74 0.635 5.980 -3.407 1.00 12.40 H new ATOM 0 HE2 PHE A 74 -0.935 4.536 -7.100 1.00 43.31 H new ATOM 0 HZ PHE A 74 -1.041 4.662 -4.644 1.00 62.41 H new ATOM 1031 N SER A 75 4.025 4.764 -8.704 1.00 21.10 N ATOM 1032 CA SER A 75 3.964 3.374 -9.121 1.00 30.14 C ATOM 1033 C SER A 75 5.194 2.598 -8.650 1.00 21.35 C ATOM 1034 O SER A 75 5.069 1.488 -8.141 1.00 44.00 O ATOM 1035 CB SER A 75 3.834 3.288 -10.644 1.00 41.12 C ATOM 1036 OG SER A 75 2.712 4.028 -11.101 1.00 64.53 O ATOM 0 H SER A 75 3.958 5.433 -9.471 1.00 21.10 H new ATOM 0 HA SER A 75 3.086 2.921 -8.660 1.00 30.14 H new ATOM 0 HB2 SER A 75 4.741 3.670 -11.112 1.00 41.12 H new ATOM 0 HB3 SER A 75 3.734 2.245 -10.946 1.00 41.12 H new ATOM 0 HG SER A 75 2.897 4.987 -11.020 1.00 64.53 H new ATOM 1042 N GLN A 76 6.375 3.194 -8.818 1.00 73.32 N ATOM 1043 CA GLN A 76 7.631 2.573 -8.383 1.00 32.14 C ATOM 1044 C GLN A 76 7.576 2.174 -6.910 1.00 3.22 C ATOM 1045 O GLN A 76 7.972 1.063 -6.544 1.00 11.25 O ATOM 1046 CB GLN A 76 8.815 3.511 -8.633 1.00 15.12 C ATOM 1047 CG GLN A 76 9.155 3.695 -10.105 1.00 4.23 C ATOM 1048 CD GLN A 76 9.757 2.446 -10.734 1.00 15.44 C ATOM 1049 OE1 GLN A 76 9.471 1.322 -10.325 1.00 63.01 O ATOM 1050 NE2 GLN A 76 10.590 2.637 -11.733 1.00 15.14 N ATOM 0 H GLN A 76 6.490 4.109 -9.253 1.00 73.32 H new ATOM 0 HA GLN A 76 7.770 1.667 -8.973 1.00 32.14 H new ATOM 0 HB2 GLN A 76 8.593 4.485 -8.197 1.00 15.12 H new ATOM 0 HB3 GLN A 76 9.691 3.121 -8.114 1.00 15.12 H new ATOM 0 HG2 GLN A 76 8.252 3.971 -10.650 1.00 4.23 H new ATOM 0 HG3 GLN A 76 9.856 4.523 -10.210 1.00 4.23 H new ATOM 0 HE21 GLN A 76 10.803 3.584 -12.045 1.00 15.14 H new ATOM 0 HE22 GLN A 76 11.023 1.838 -12.196 1.00 15.14 H new ATOM 1059 N GLN A 77 7.073 3.077 -6.073 1.00 30.33 N ATOM 1060 CA GLN A 77 6.933 2.805 -4.645 1.00 5.43 C ATOM 1061 C GLN A 77 6.048 1.582 -4.409 1.00 5.15 C ATOM 1062 O GLN A 77 6.351 0.741 -3.571 1.00 10.30 O ATOM 1063 CB GLN A 77 6.359 4.020 -3.903 1.00 52.52 C ATOM 1064 CG GLN A 77 6.050 3.757 -2.427 1.00 63.13 C ATOM 1065 CD GLN A 77 7.291 3.453 -1.598 1.00 31.13 C ATOM 1066 OE1 GLN A 77 7.852 4.474 -0.991 1.00 33.24 O flip ATOM 1067 NE2 GLN A 77 7.719 2.305 -1.486 1.00 72.13 N flip ATOM 0 H GLN A 77 6.756 4.003 -6.358 1.00 30.33 H new ATOM 0 HA GLN A 77 7.928 2.599 -4.250 1.00 5.43 H new ATOM 0 HB2 GLN A 77 7.068 4.845 -3.974 1.00 52.52 H new ATOM 0 HB3 GLN A 77 5.445 4.341 -4.404 1.00 52.52 H new ATOM 0 HG2 GLN A 77 5.545 4.627 -2.008 1.00 63.13 H new ATOM 0 HG3 GLN A 77 5.357 2.919 -2.351 1.00 63.13 H new ATOM 0 HE21 GLN A 77 7.256 1.538 -1.973 1.00 72.13 H new ATOM 0 HE22 GLN A 77 8.537 2.120 -0.906 1.00 72.13 H new ATOM 1076 N VAL A 78 4.978 1.466 -5.186 1.00 73.13 N ATOM 1077 CA VAL A 78 4.042 0.367 -5.010 1.00 13.33 C ATOM 1078 C VAL A 78 4.603 -0.919 -5.610 1.00 30.35 C ATOM 1079 O VAL A 78 4.323 -2.018 -5.123 1.00 71.03 O ATOM 1080 CB VAL A 78 2.661 0.677 -5.637 1.00 21.34 C ATOM 1081 CG1 VAL A 78 1.668 -0.432 -5.315 1.00 73.31 C ATOM 1082 CG2 VAL A 78 2.141 2.022 -5.147 1.00 53.41 C ATOM 0 H VAL A 78 4.740 2.114 -5.937 1.00 73.13 H new ATOM 0 HA VAL A 78 3.903 0.235 -3.937 1.00 13.33 H new ATOM 0 HB VAL A 78 2.778 0.729 -6.719 1.00 21.34 H new ATOM 0 HG11 VAL A 78 0.703 -0.198 -5.764 1.00 73.31 H new ATOM 0 HG12 VAL A 78 2.035 -1.377 -5.716 1.00 73.31 H new ATOM 0 HG13 VAL A 78 1.555 -0.517 -4.234 1.00 73.31 H new ATOM 0 HG21 VAL A 78 1.169 2.223 -5.598 1.00 53.41 H new ATOM 0 HG22 VAL A 78 2.039 1.999 -4.062 1.00 53.41 H new ATOM 0 HG23 VAL A 78 2.842 2.808 -5.429 1.00 53.41 H new ATOM 1092 N MET A 79 5.406 -0.781 -6.652 1.00 55.44 N ATOM 1093 CA MET A 79 6.060 -1.930 -7.256 1.00 73.45 C ATOM 1094 C MET A 79 7.016 -2.553 -6.248 1.00 72.31 C ATOM 1095 O MET A 79 6.956 -3.747 -5.980 1.00 24.31 O ATOM 1096 CB MET A 79 6.803 -1.530 -8.540 1.00 22.40 C ATOM 1097 CG MET A 79 5.875 -1.114 -9.675 1.00 11.34 C ATOM 1098 SD MET A 79 6.758 -0.533 -11.144 1.00 62.02 S ATOM 1099 CE MET A 79 7.706 -1.990 -11.578 1.00 32.01 C ATOM 0 H MET A 79 5.620 0.112 -7.096 1.00 55.44 H new ATOM 0 HA MET A 79 5.303 -2.664 -7.533 1.00 73.45 H new ATOM 0 HB2 MET A 79 7.482 -0.707 -8.316 1.00 22.40 H new ATOM 0 HB3 MET A 79 7.416 -2.368 -8.871 1.00 22.40 H new ATOM 0 HG2 MET A 79 5.245 -1.960 -9.949 1.00 11.34 H new ATOM 0 HG3 MET A 79 5.212 -0.324 -9.322 1.00 11.34 H new ATOM 0 HE1 MET A 79 8.074 -1.894 -12.600 1.00 32.01 H new ATOM 0 HE2 MET A 79 8.551 -2.091 -10.896 1.00 32.01 H new ATOM 0 HE3 MET A 79 7.071 -2.873 -11.502 1.00 32.01 H new ATOM 1109 N LEU A 80 7.883 -1.730 -5.678 1.00 43.22 N ATOM 1110 CA LEU A 80 8.799 -2.186 -4.639 1.00 53.24 C ATOM 1111 C LEU A 80 8.000 -2.711 -3.439 1.00 14.11 C ATOM 1112 O LEU A 80 8.339 -3.737 -2.846 1.00 1.01 O ATOM 1113 CB LEU A 80 9.723 -1.044 -4.204 1.00 14.34 C ATOM 1114 CG LEU A 80 10.810 -1.413 -3.190 1.00 51.14 C ATOM 1115 CD1 LEU A 80 11.806 -2.390 -3.799 1.00 64.43 C ATOM 1116 CD2 LEU A 80 11.519 -0.164 -2.691 1.00 32.14 C ATOM 0 H LEU A 80 7.973 -0.742 -5.916 1.00 43.22 H new ATOM 0 HA LEU A 80 9.414 -2.993 -5.037 1.00 53.24 H new ATOM 0 HB2 LEU A 80 10.205 -0.634 -5.092 1.00 14.34 H new ATOM 0 HB3 LEU A 80 9.111 -0.249 -3.778 1.00 14.34 H new ATOM 0 HG LEU A 80 10.334 -1.901 -2.339 1.00 51.14 H new ATOM 0 HD11 LEU A 80 12.569 -2.638 -3.062 1.00 64.43 H new ATOM 0 HD12 LEU A 80 11.285 -3.298 -4.103 1.00 64.43 H new ATOM 0 HD13 LEU A 80 12.277 -1.934 -4.669 1.00 64.43 H new ATOM 0 HD21 LEU A 80 12.288 -0.445 -1.971 1.00 32.14 H new ATOM 0 HD22 LEU A 80 11.981 0.353 -3.532 1.00 32.14 H new ATOM 0 HD23 LEU A 80 10.797 0.497 -2.211 1.00 32.14 H new ATOM 1128 N PHE A 81 6.934 -1.992 -3.108 1.00 45.52 N ATOM 1129 CA PHE A 81 6.012 -2.349 -2.028 1.00 11.34 C ATOM 1130 C PHE A 81 5.528 -3.804 -2.162 1.00 64.34 C ATOM 1131 O PHE A 81 5.693 -4.611 -1.241 1.00 42.32 O ATOM 1132 CB PHE A 81 4.822 -1.377 -2.065 1.00 73.14 C ATOM 1133 CG PHE A 81 3.788 -1.556 -0.996 1.00 44.25 C ATOM 1134 CD1 PHE A 81 3.995 -1.063 0.278 1.00 12.02 C ATOM 1135 CD2 PHE A 81 2.593 -2.193 -1.276 1.00 43.41 C ATOM 1136 CE1 PHE A 81 3.033 -1.203 1.254 1.00 25.54 C ATOM 1137 CE2 PHE A 81 1.630 -2.339 -0.306 1.00 22.10 C ATOM 1138 CZ PHE A 81 1.849 -1.843 0.963 1.00 53.12 C ATOM 0 H PHE A 81 6.679 -1.129 -3.589 1.00 45.52 H new ATOM 0 HA PHE A 81 6.529 -2.271 -1.072 1.00 11.34 H new ATOM 0 HB2 PHE A 81 5.208 -0.360 -2.001 1.00 73.14 H new ATOM 0 HB3 PHE A 81 4.333 -1.472 -3.034 1.00 73.14 H new ATOM 0 HD1 PHE A 81 4.923 -0.562 0.512 1.00 12.02 H new ATOM 0 HD2 PHE A 81 2.414 -2.580 -2.268 1.00 43.41 H new ATOM 0 HE1 PHE A 81 3.207 -0.812 2.245 1.00 25.54 H new ATOM 0 HE2 PHE A 81 0.702 -2.842 -0.537 1.00 22.10 H new ATOM 0 HZ PHE A 81 1.093 -1.957 1.726 1.00 53.12 H new ATOM 1148 N THR A 82 4.962 -4.137 -3.321 1.00 65.10 N ATOM 1149 CA THR A 82 4.440 -5.479 -3.557 1.00 4.22 C ATOM 1150 C THR A 82 5.575 -6.513 -3.675 1.00 51.51 C ATOM 1151 O THR A 82 5.408 -7.675 -3.295 1.00 4.00 O ATOM 1152 CB THR A 82 3.508 -5.537 -4.813 1.00 44.22 C ATOM 1153 OG1 THR A 82 2.916 -6.838 -4.940 1.00 71.34 O ATOM 1154 CG2 THR A 82 4.267 -5.211 -6.090 1.00 53.50 C ATOM 0 H THR A 82 4.854 -3.497 -4.108 1.00 65.10 H new ATOM 0 HA THR A 82 3.835 -5.735 -2.687 1.00 4.22 H new ATOM 0 HB THR A 82 2.729 -4.788 -4.669 1.00 44.22 H new ATOM 0 HG1 THR A 82 2.335 -6.857 -5.729 1.00 71.34 H new ATOM 0 HG21 THR A 82 3.587 -5.261 -6.940 1.00 53.50 H new ATOM 0 HG22 THR A 82 4.685 -4.207 -6.019 1.00 53.50 H new ATOM 0 HG23 THR A 82 5.074 -5.931 -6.228 1.00 53.50 H new ATOM 1162 N ARG A 83 6.736 -6.081 -4.173 1.00 61.34 N ATOM 1163 CA ARG A 83 7.881 -6.981 -4.325 1.00 63.33 C ATOM 1164 C ARG A 83 8.460 -7.370 -2.971 1.00 22.54 C ATOM 1165 O ARG A 83 8.810 -8.527 -2.748 1.00 24.22 O ATOM 1166 CB ARG A 83 8.967 -6.354 -5.204 1.00 1.45 C ATOM 1167 CG ARG A 83 8.561 -6.195 -6.658 1.00 75.42 C ATOM 1168 CD ARG A 83 9.676 -5.584 -7.487 1.00 52.52 C ATOM 1169 NE ARG A 83 9.290 -5.431 -8.888 1.00 24.02 N ATOM 1170 CZ ARG A 83 10.078 -4.927 -9.841 1.00 73.25 C ATOM 1171 NH1 ARG A 83 11.302 -4.504 -9.542 1.00 53.42 N ATOM 1172 NH2 ARG A 83 9.641 -4.849 -11.094 1.00 23.15 N ATOM 0 H ARG A 83 6.907 -5.122 -4.475 1.00 61.34 H new ATOM 0 HA ARG A 83 7.520 -7.884 -4.817 1.00 63.33 H new ATOM 0 HB2 ARG A 83 9.229 -5.376 -4.800 1.00 1.45 H new ATOM 0 HB3 ARG A 83 9.864 -6.971 -5.152 1.00 1.45 H new ATOM 0 HG2 ARG A 83 8.292 -7.168 -7.070 1.00 75.42 H new ATOM 0 HG3 ARG A 83 7.673 -5.566 -6.722 1.00 75.42 H new ATOM 0 HD2 ARG A 83 9.943 -4.611 -7.075 1.00 52.52 H new ATOM 0 HD3 ARG A 83 10.564 -6.213 -7.421 1.00 52.52 H new ATOM 0 HE ARG A 83 8.353 -5.730 -9.157 1.00 24.02 H new ATOM 0 HH11 ARG A 83 11.642 -4.564 -8.582 1.00 53.42 H new ATOM 0 HH12 ARG A 83 11.901 -4.120 -10.272 1.00 53.42 H new ATOM 0 HH21 ARG A 83 8.703 -5.174 -11.328 1.00 23.15 H new ATOM 0 HH22 ARG A 83 10.244 -4.464 -11.821 1.00 23.15 H new ATOM 1186 N GLN A 84 8.549 -6.408 -2.066 1.00 25.24 N ATOM 1187 CA GLN A 84 9.067 -6.674 -0.728 1.00 5.35 C ATOM 1188 C GLN A 84 8.004 -7.351 0.133 1.00 32.35 C ATOM 1189 O GLN A 84 8.317 -8.015 1.123 1.00 52.03 O ATOM 1190 CB GLN A 84 9.557 -5.382 -0.071 1.00 14.52 C ATOM 1191 CG GLN A 84 10.716 -4.725 -0.812 1.00 23.33 C ATOM 1192 CD GLN A 84 11.211 -3.451 -0.146 1.00 44.05 C ATOM 1193 OE1 GLN A 84 10.320 -2.746 0.525 1.00 32.31 O flip ATOM 1194 NE2 GLN A 84 12.392 -3.106 -0.240 1.00 32.41 N flip ATOM 0 H GLN A 84 8.272 -5.440 -2.230 1.00 25.24 H new ATOM 0 HA GLN A 84 9.916 -7.351 -0.817 1.00 5.35 H new ATOM 0 HB2 GLN A 84 8.728 -4.677 -0.011 1.00 14.52 H new ATOM 0 HB3 GLN A 84 9.866 -5.598 0.952 1.00 14.52 H new ATOM 0 HG2 GLN A 84 11.541 -5.434 -0.883 1.00 23.33 H new ATOM 0 HG3 GLN A 84 10.404 -4.496 -1.831 1.00 23.33 H new ATOM 0 HE21 GLN A 84 13.050 -3.679 -0.768 1.00 32.41 H new ATOM 0 HE22 GLN A 84 12.710 -2.248 0.210 1.00 32.41 H new ATOM 1203 N GLY A 85 6.746 -7.159 -0.246 1.00 1.25 N ATOM 1204 CA GLY A 85 5.645 -7.804 0.446 1.00 31.42 C ATOM 1205 C GLY A 85 5.353 -7.183 1.791 1.00 14.34 C ATOM 1206 O GLY A 85 4.855 -7.849 2.695 1.00 64.51 O ATOM 0 H GLY A 85 6.467 -6.564 -1.026 1.00 1.25 H new ATOM 0 HA2 GLY A 85 4.751 -7.751 -0.175 1.00 31.42 H new ATOM 0 HA3 GLY A 85 5.877 -8.860 0.582 1.00 31.42 H new ATOM 1210 N GLN A 86 5.661 -5.910 1.928 1.00 22.04 N ATOM 1211 CA GLN A 86 5.421 -5.207 3.175 1.00 0.40 C ATOM 1212 C GLN A 86 3.956 -4.804 3.282 1.00 54.42 C ATOM 1213 O GLN A 86 3.463 -4.027 2.478 1.00 72.24 O ATOM 1214 CB GLN A 86 6.350 -3.990 3.304 1.00 32.21 C ATOM 1215 CG GLN A 86 6.431 -3.122 2.053 1.00 15.10 C ATOM 1216 CD GLN A 86 7.469 -2.025 2.177 1.00 0.24 C ATOM 1217 OE1 GLN A 86 8.457 -2.170 2.890 1.00 51.32 O ATOM 1218 NE2 GLN A 86 7.264 -0.936 1.472 1.00 2.14 N ATOM 0 H GLN A 86 6.078 -5.339 1.192 1.00 22.04 H new ATOM 0 HA GLN A 86 5.646 -5.879 4.003 1.00 0.40 H new ATOM 0 HB2 GLN A 86 6.009 -3.375 4.136 1.00 32.21 H new ATOM 0 HB3 GLN A 86 7.352 -4.338 3.555 1.00 32.21 H new ATOM 0 HG2 GLN A 86 6.670 -3.749 1.194 1.00 15.10 H new ATOM 0 HG3 GLN A 86 5.456 -2.675 1.860 1.00 15.10 H new ATOM 0 HE21 GLN A 86 6.430 -0.854 0.891 1.00 2.14 H new ATOM 0 HE22 GLN A 86 7.939 -0.172 1.505 1.00 2.14 H new ATOM 1227 N GLN A 87 3.262 -5.369 4.269 1.00 35.34 N ATOM 1228 CA GLN A 87 1.830 -5.114 4.462 1.00 10.33 C ATOM 1229 C GLN A 87 1.516 -3.641 4.745 1.00 42.12 C ATOM 1230 O GLN A 87 0.374 -3.206 4.591 1.00 73.53 O ATOM 1231 CB GLN A 87 1.270 -5.992 5.586 1.00 55.44 C ATOM 1232 CG GLN A 87 1.888 -5.727 6.950 1.00 72.45 C ATOM 1233 CD GLN A 87 1.240 -6.543 8.048 1.00 11.31 C ATOM 1234 OE1 GLN A 87 0.275 -6.106 8.672 1.00 3.22 O ATOM 1235 NE2 GLN A 87 1.763 -7.728 8.288 1.00 1.22 N ATOM 0 H GLN A 87 3.668 -6.009 4.951 1.00 35.34 H new ATOM 0 HA GLN A 87 1.345 -5.371 3.520 1.00 10.33 H new ATOM 0 HB2 GLN A 87 0.193 -5.837 5.651 1.00 55.44 H new ATOM 0 HB3 GLN A 87 1.426 -7.039 5.326 1.00 55.44 H new ATOM 0 HG2 GLN A 87 2.953 -5.955 6.913 1.00 72.45 H new ATOM 0 HG3 GLN A 87 1.796 -4.667 7.187 1.00 72.45 H new ATOM 0 HE21 GLN A 87 2.564 -8.051 7.746 1.00 1.22 H new ATOM 0 HE22 GLN A 87 1.367 -8.322 9.016 1.00 1.22 H new ATOM 1244 N SER A 88 2.502 -2.888 5.183 1.00 61.02 N ATOM 1245 CA SER A 88 2.307 -1.479 5.441 1.00 44.01 C ATOM 1246 C SER A 88 3.591 -0.699 5.186 1.00 10.02 C ATOM 1247 O SER A 88 4.696 -1.208 5.405 1.00 11.31 O ATOM 1248 CB SER A 88 1.824 -1.269 6.879 1.00 54.40 C ATOM 1249 OG SER A 88 0.597 -1.955 7.106 1.00 40.12 O ATOM 0 H SER A 88 3.446 -3.228 5.368 1.00 61.02 H new ATOM 0 HA SER A 88 1.545 -1.104 4.758 1.00 44.01 H new ATOM 0 HB2 SER A 88 2.580 -1.627 7.577 1.00 54.40 H new ATOM 0 HB3 SER A 88 1.691 -0.204 7.071 1.00 54.40 H new ATOM 0 HG SER A 88 0.307 -1.809 8.031 1.00 40.12 H new ATOM 1255 N ALA A 89 3.447 0.526 4.717 1.00 72.33 N ATOM 1256 CA ALA A 89 4.589 1.376 4.437 1.00 24.42 C ATOM 1257 C ALA A 89 4.229 2.836 4.608 1.00 61.11 C ATOM 1258 O ALA A 89 3.079 3.239 4.384 1.00 35.00 O ATOM 1259 CB ALA A 89 5.108 1.127 3.031 1.00 13.11 C ATOM 0 H ALA A 89 2.544 0.957 4.521 1.00 72.33 H new ATOM 0 HA ALA A 89 5.376 1.129 5.150 1.00 24.42 H new ATOM 0 HB1 ALA A 89 5.964 1.774 2.839 1.00 13.11 H new ATOM 0 HB2 ALA A 89 5.412 0.085 2.935 1.00 13.11 H new ATOM 0 HB3 ALA A 89 4.321 1.344 2.309 1.00 13.11 H new ATOM 1265 N GLN A 90 5.198 3.621 5.035 1.00 21.51 N ATOM 1266 CA GLN A 90 5.009 5.042 5.227 1.00 40.42 C ATOM 1267 C GLN A 90 5.628 5.804 4.072 1.00 10.14 C ATOM 1268 O GLN A 90 6.827 5.697 3.816 1.00 31.14 O ATOM 1269 CB GLN A 90 5.632 5.519 6.552 1.00 63.23 C ATOM 1270 CG GLN A 90 4.860 5.135 7.817 1.00 11.11 C ATOM 1271 CD GLN A 90 4.877 3.646 8.115 1.00 31.25 C ATOM 1272 OE1 GLN A 90 5.784 3.142 8.772 1.00 15.10 O ATOM 1273 NE2 GLN A 90 3.864 2.940 7.660 1.00 14.11 N ATOM 0 H GLN A 90 6.137 3.291 5.258 1.00 21.51 H new ATOM 0 HA GLN A 90 3.937 5.235 5.266 1.00 40.42 H new ATOM 0 HB2 GLN A 90 6.641 5.114 6.626 1.00 63.23 H new ATOM 0 HB3 GLN A 90 5.726 6.604 6.520 1.00 63.23 H new ATOM 0 HG2 GLN A 90 5.283 5.671 8.667 1.00 11.11 H new ATOM 0 HG3 GLN A 90 3.826 5.464 7.715 1.00 11.11 H new ATOM 0 HE21 GLN A 90 3.129 3.394 7.118 1.00 14.11 H new ATOM 0 HE22 GLN A 90 3.814 1.939 7.850 1.00 14.11 H new ATOM 1282 N LEU A 91 4.815 6.559 3.381 1.00 51.33 N ATOM 1283 CA LEU A 91 5.275 7.336 2.248 1.00 62.23 C ATOM 1284 C LEU A 91 5.415 8.803 2.659 1.00 33.34 C ATOM 1285 O LEU A 91 4.974 9.190 3.737 1.00 63.22 O ATOM 1286 CB LEU A 91 4.278 7.180 1.080 1.00 4.32 C ATOM 1287 CG LEU A 91 4.632 7.883 -0.241 1.00 34.31 C ATOM 1288 CD1 LEU A 91 5.977 7.411 -0.761 1.00 13.41 C ATOM 1289 CD2 LEU A 91 3.550 7.633 -1.280 1.00 23.25 C ATOM 0 H LEU A 91 3.820 6.656 3.582 1.00 51.33 H new ATOM 0 HA LEU A 91 6.250 6.976 1.919 1.00 62.23 H new ATOM 0 HB2 LEU A 91 4.160 6.116 0.876 1.00 4.32 H new ATOM 0 HB3 LEU A 91 3.308 7.551 1.411 1.00 4.32 H new ATOM 0 HG LEU A 91 4.695 8.954 -0.049 1.00 34.31 H new ATOM 0 HD11 LEU A 91 6.205 7.922 -1.696 1.00 13.41 H new ATOM 0 HD12 LEU A 91 6.750 7.636 -0.026 1.00 13.41 H new ATOM 0 HD13 LEU A 91 5.943 6.335 -0.935 1.00 13.41 H new ATOM 0 HD21 LEU A 91 3.815 8.137 -2.210 1.00 23.25 H new ATOM 0 HD22 LEU A 91 3.460 6.562 -1.461 1.00 23.25 H new ATOM 0 HD23 LEU A 91 2.599 8.021 -0.915 1.00 23.25 H new ATOM 1301 N ARG A 92 6.024 9.603 1.808 1.00 61.33 N ATOM 1302 CA ARG A 92 6.206 11.020 2.075 1.00 24.23 C ATOM 1303 C ARG A 92 5.481 11.778 0.983 1.00 4.13 C ATOM 1304 O ARG A 92 5.831 11.648 -0.193 1.00 73.13 O ATOM 1305 CB ARG A 92 7.698 11.381 2.070 1.00 24.53 C ATOM 1306 CG ARG A 92 8.003 12.759 2.641 1.00 52.54 C ATOM 1307 CD ARG A 92 7.788 12.787 4.145 1.00 2.44 C ATOM 1308 NE ARG A 92 7.858 14.141 4.692 1.00 54.50 N ATOM 1309 CZ ARG A 92 7.482 14.467 5.929 1.00 51.03 C ATOM 1310 NH1 ARG A 92 7.045 13.526 6.765 1.00 63.22 N ATOM 1311 NH2 ARG A 92 7.547 15.732 6.331 1.00 51.52 N ATOM 0 H ARG A 92 6.406 9.294 0.914 1.00 61.33 H new ATOM 0 HA ARG A 92 5.808 11.278 3.056 1.00 24.23 H new ATOM 0 HB2 ARG A 92 8.244 10.632 2.643 1.00 24.53 H new ATOM 0 HB3 ARG A 92 8.070 11.333 1.046 1.00 24.53 H new ATOM 0 HG2 ARG A 92 9.034 13.031 2.413 1.00 52.54 H new ATOM 0 HG3 ARG A 92 7.364 13.503 2.165 1.00 52.54 H new ATOM 0 HD2 ARG A 92 6.816 12.353 4.379 1.00 2.44 H new ATOM 0 HD3 ARG A 92 8.540 12.163 4.629 1.00 2.44 H new ATOM 0 HE ARG A 92 8.217 14.882 4.090 1.00 54.50 H new ATOM 0 HH11 ARG A 92 6.998 12.554 6.459 1.00 63.22 H new ATOM 0 HH12 ARG A 92 6.758 13.778 7.711 1.00 63.22 H new ATOM 0 HH21 ARG A 92 7.884 16.453 5.693 1.00 51.52 H new ATOM 0 HH22 ARG A 92 7.259 15.982 7.277 1.00 51.52 H new ATOM 1325 N LEU A 93 4.473 12.556 1.344 1.00 50.44 N ATOM 1326 CA LEU A 93 3.640 13.191 0.338 1.00 4.02 C ATOM 1327 C LEU A 93 3.466 14.682 0.585 1.00 21.33 C ATOM 1328 O LEU A 93 3.445 15.147 1.726 1.00 24.22 O ATOM 1329 CB LEU A 93 2.264 12.518 0.329 1.00 34.32 C ATOM 1330 CG LEU A 93 1.734 12.027 -1.026 1.00 74.05 C ATOM 1331 CD1 LEU A 93 1.528 13.177 -1.995 1.00 51.53 C ATOM 1332 CD2 LEU A 93 2.664 10.992 -1.622 1.00 15.33 C ATOM 0 H LEU A 93 4.215 12.760 2.310 1.00 50.44 H new ATOM 0 HA LEU A 93 4.138 13.074 -0.625 1.00 4.02 H new ATOM 0 HB2 LEU A 93 2.300 11.665 1.007 1.00 34.32 H new ATOM 0 HB3 LEU A 93 1.540 13.222 0.740 1.00 34.32 H new ATOM 0 HG LEU A 93 0.763 11.563 -0.850 1.00 74.05 H new ATOM 0 HD11 LEU A 93 1.152 12.791 -2.943 1.00 51.53 H new ATOM 0 HD12 LEU A 93 0.807 13.880 -1.578 1.00 51.53 H new ATOM 0 HD13 LEU A 93 2.477 13.687 -2.161 1.00 51.53 H new ATOM 0 HD21 LEU A 93 2.269 10.658 -2.582 1.00 15.33 H new ATOM 0 HD22 LEU A 93 3.651 11.431 -1.769 1.00 15.33 H new ATOM 0 HD23 LEU A 93 2.742 10.141 -0.946 1.00 15.33 H new ATOM 1344 N HIS A 94 3.374 15.415 -0.505 1.00 41.13 N ATOM 1345 CA HIS A 94 3.102 16.838 -0.472 1.00 10.13 C ATOM 1346 C HIS A 94 1.628 17.088 -0.812 1.00 34.23 C ATOM 1347 O HIS A 94 0.998 16.251 -1.450 1.00 63.24 O ATOM 1348 CB HIS A 94 4.016 17.583 -1.451 1.00 24.13 C ATOM 1349 CG HIS A 94 5.461 17.576 -1.049 1.00 22.11 C ATOM 1350 ND1 HIS A 94 6.492 17.697 -1.947 1.00 31.34 N ATOM 1351 CD2 HIS A 94 6.043 17.481 0.173 1.00 74.22 C ATOM 1352 CE1 HIS A 94 7.642 17.677 -1.302 1.00 53.05 C ATOM 1353 NE2 HIS A 94 7.396 17.548 -0.015 1.00 14.25 N ATOM 0 H HIS A 94 3.487 15.038 -1.446 1.00 41.13 H new ATOM 0 HA HIS A 94 3.303 17.216 0.530 1.00 10.13 H new ATOM 0 HB2 HIS A 94 3.920 17.132 -2.439 1.00 24.13 H new ATOM 0 HB3 HIS A 94 3.677 18.615 -1.538 1.00 24.13 H new ATOM 0 HD2 HIS A 94 5.533 17.373 1.119 1.00 74.22 H new ATOM 0 HE1 HIS A 94 8.620 17.754 -1.753 1.00 53.05 H new ATOM 0 HE2 HIS A 94 8.100 17.505 0.722 1.00 14.25 H new ATOM 1362 N PRO A 95 1.046 18.238 -0.400 1.00 41.35 N ATOM 1363 CA PRO A 95 1.744 19.303 0.343 1.00 33.31 C ATOM 1364 C PRO A 95 2.337 18.843 1.679 1.00 35.23 C ATOM 1365 O PRO A 95 1.852 17.900 2.303 1.00 35.55 O ATOM 1366 CB PRO A 95 0.652 20.356 0.585 1.00 64.33 C ATOM 1367 CG PRO A 95 -0.633 19.634 0.389 1.00 64.42 C ATOM 1368 CD PRO A 95 -0.360 18.587 -0.643 1.00 70.24 C ATOM 0 HA PRO A 95 2.602 19.666 -0.223 1.00 33.31 H new ATOM 0 HB2 PRO A 95 0.721 20.772 1.590 1.00 64.33 H new ATOM 0 HB3 PRO A 95 0.746 21.189 -0.112 1.00 64.33 H new ATOM 0 HG2 PRO A 95 -0.975 19.184 1.321 1.00 64.42 H new ATOM 0 HG3 PRO A 95 -1.417 20.315 0.057 1.00 64.42 H new ATOM 0 HD2 PRO A 95 -1.016 17.724 -0.525 1.00 70.24 H new ATOM 0 HD3 PRO A 95 -0.512 18.967 -1.653 1.00 70.24 H new ATOM 1376 N GLU A 96 3.411 19.522 2.056 1.00 13.53 N ATOM 1377 CA GLU A 96 4.130 19.272 3.318 1.00 32.12 C ATOM 1378 C GLU A 96 3.171 19.039 4.509 1.00 33.34 C ATOM 1379 O GLU A 96 3.465 18.239 5.396 1.00 34.53 O ATOM 1380 CB GLU A 96 5.153 20.385 3.622 1.00 10.24 C ATOM 1381 CG GLU A 96 4.729 21.794 3.214 1.00 73.52 C ATOM 1382 CD GLU A 96 3.518 22.305 3.957 1.00 42.23 C ATOM 1383 OE1 GLU A 96 3.677 22.769 5.104 1.00 25.54 O ATOM 1384 OE2 GLU A 96 2.398 22.253 3.398 1.00 24.04 O ATOM 0 H GLU A 96 3.819 20.271 1.496 1.00 13.53 H new ATOM 0 HA GLU A 96 4.686 18.345 3.179 1.00 32.12 H new ATOM 0 HB2 GLU A 96 5.360 20.382 4.692 1.00 10.24 H new ATOM 0 HB3 GLU A 96 6.088 20.144 3.115 1.00 10.24 H new ATOM 0 HG2 GLU A 96 5.562 22.477 3.382 1.00 73.52 H new ATOM 0 HG3 GLU A 96 4.519 21.805 2.145 1.00 73.52 H new ATOM 1391 N GLU A 97 2.042 19.757 4.520 1.00 74.11 N ATOM 1392 CA GLU A 97 0.997 19.584 5.535 1.00 75.15 C ATOM 1393 C GLU A 97 0.596 18.111 5.694 1.00 61.54 C ATOM 1394 O GLU A 97 0.508 17.603 6.814 1.00 72.14 O ATOM 1395 CB GLU A 97 -0.239 20.402 5.165 1.00 0.13 C ATOM 1396 CG GLU A 97 -1.348 20.338 6.203 1.00 13.21 C ATOM 1397 CD GLU A 97 -2.658 20.886 5.692 1.00 43.11 C ATOM 1398 OE1 GLU A 97 -2.807 22.124 5.621 1.00 45.42 O ATOM 1399 OE2 GLU A 97 -3.553 20.082 5.356 1.00 42.22 O ATOM 0 H GLU A 97 1.827 20.473 3.826 1.00 74.11 H new ATOM 0 HA GLU A 97 1.406 19.934 6.483 1.00 75.15 H new ATOM 0 HB2 GLU A 97 0.054 21.442 5.023 1.00 0.13 H new ATOM 0 HB3 GLU A 97 -0.626 20.047 4.210 1.00 0.13 H new ATOM 0 HG2 GLU A 97 -1.489 19.303 6.514 1.00 13.21 H new ATOM 0 HG3 GLU A 97 -1.045 20.899 7.087 1.00 13.21 H new ATOM 1406 N LEU A 98 0.353 17.431 4.573 1.00 41.42 N ATOM 1407 CA LEU A 98 -0.052 16.026 4.597 1.00 40.14 C ATOM 1408 C LEU A 98 1.055 15.171 5.176 1.00 75.33 C ATOM 1409 O LEU A 98 0.795 14.216 5.910 1.00 43.50 O ATOM 1410 CB LEU A 98 -0.411 15.539 3.190 1.00 75.42 C ATOM 1411 CG LEU A 98 -1.495 16.338 2.464 1.00 53.53 C ATOM 1412 CD1 LEU A 98 -1.846 15.681 1.139 1.00 13.32 C ATOM 1413 CD2 LEU A 98 -2.733 16.487 3.337 1.00 10.44 C ATOM 0 H LEU A 98 0.430 17.831 3.638 1.00 41.42 H new ATOM 0 HA LEU A 98 -0.936 15.937 5.228 1.00 40.14 H new ATOM 0 HB2 LEU A 98 0.492 15.552 2.580 1.00 75.42 H new ATOM 0 HB3 LEU A 98 -0.736 14.501 3.257 1.00 75.42 H new ATOM 0 HG LEU A 98 -1.104 17.335 2.259 1.00 53.53 H new ATOM 0 HD11 LEU A 98 -2.619 16.264 0.637 1.00 13.32 H new ATOM 0 HD12 LEU A 98 -0.958 15.637 0.508 1.00 13.32 H new ATOM 0 HD13 LEU A 98 -2.213 14.671 1.320 1.00 13.32 H new ATOM 0 HD21 LEU A 98 -3.490 17.058 2.800 1.00 10.44 H new ATOM 0 HD22 LEU A 98 -3.128 15.500 3.580 1.00 10.44 H new ATOM 0 HD23 LEU A 98 -2.469 17.009 4.257 1.00 10.44 H new ATOM 1425 N GLY A 99 2.287 15.544 4.858 1.00 54.34 N ATOM 1426 CA GLY A 99 3.472 14.876 5.372 1.00 14.55 C ATOM 1427 C GLY A 99 3.683 13.430 4.930 1.00 21.34 C ATOM 1428 O GLY A 99 4.797 13.057 4.576 1.00 34.25 O ATOM 0 H GLY A 99 2.492 16.323 4.233 1.00 54.34 H new ATOM 0 HA2 GLY A 99 4.346 15.455 5.075 1.00 14.55 H new ATOM 0 HA3 GLY A 99 3.431 14.898 6.461 1.00 14.55 H new ATOM 1432 N GLN A 100 2.643 12.622 4.911 1.00 14.45 N ATOM 1433 CA GLN A 100 2.823 11.210 4.657 1.00 33.41 C ATOM 1434 C GLN A 100 1.556 10.553 4.149 1.00 64.43 C ATOM 1435 O GLN A 100 0.499 11.180 4.076 1.00 0.35 O ATOM 1436 CB GLN A 100 3.325 10.498 5.919 1.00 13.21 C ATOM 1437 CG GLN A 100 2.431 10.672 7.132 1.00 45.33 C ATOM 1438 CD GLN A 100 2.986 9.982 8.356 1.00 13.14 C ATOM 1439 OE1 GLN A 100 2.689 8.820 8.614 1.00 5.21 O ATOM 1440 NE2 GLN A 100 3.806 10.686 9.110 1.00 1.32 N ATOM 0 H GLN A 100 1.678 12.914 5.066 1.00 14.45 H new ATOM 0 HA GLN A 100 3.573 11.117 3.872 1.00 33.41 H new ATOM 0 HB2 GLN A 100 3.425 9.434 5.706 1.00 13.21 H new ATOM 0 HB3 GLN A 100 4.321 10.870 6.160 1.00 13.21 H new ATOM 0 HG2 GLN A 100 2.308 11.735 7.341 1.00 45.33 H new ATOM 0 HG3 GLN A 100 1.441 10.274 6.911 1.00 45.33 H new ATOM 0 HE21 GLN A 100 4.027 11.650 8.861 1.00 1.32 H new ATOM 0 HE22 GLN A 100 4.219 10.267 9.943 1.00 1.32 H new ATOM 1449 N VAL A 101 1.686 9.281 3.815 1.00 24.41 N ATOM 1450 CA VAL A 101 0.584 8.450 3.354 1.00 21.34 C ATOM 1451 C VAL A 101 0.780 7.041 3.895 1.00 63.21 C ATOM 1452 O VAL A 101 1.906 6.528 3.912 1.00 61.32 O ATOM 1453 CB VAL A 101 0.482 8.401 1.794 1.00 15.43 C ATOM 1454 CG1 VAL A 101 -0.530 7.353 1.340 1.00 52.43 C ATOM 1455 CG2 VAL A 101 0.096 9.760 1.236 1.00 2.05 C ATOM 0 H VAL A 101 2.577 8.786 3.857 1.00 24.41 H new ATOM 0 HA VAL A 101 -0.345 8.887 3.722 1.00 21.34 H new ATOM 0 HB VAL A 101 1.464 8.125 1.411 1.00 15.43 H new ATOM 0 HG11 VAL A 101 -0.579 7.342 0.251 1.00 52.43 H new ATOM 0 HG12 VAL A 101 -0.223 6.371 1.699 1.00 52.43 H new ATOM 0 HG13 VAL A 101 -1.512 7.596 1.745 1.00 52.43 H new ATOM 0 HG21 VAL A 101 0.031 9.702 0.149 1.00 2.05 H new ATOM 0 HG22 VAL A 101 -0.870 10.059 1.642 1.00 2.05 H new ATOM 0 HG23 VAL A 101 0.850 10.496 1.516 1.00 2.05 H new ATOM 1465 N HIS A 102 -0.293 6.424 4.346 1.00 63.14 N ATOM 1466 CA HIS A 102 -0.215 5.081 4.883 1.00 63.04 C ATOM 1467 C HIS A 102 -0.617 4.081 3.814 1.00 4.12 C ATOM 1468 O HIS A 102 -1.799 3.937 3.504 1.00 3.45 O ATOM 1469 CB HIS A 102 -1.115 4.936 6.115 1.00 73.43 C ATOM 1470 CG HIS A 102 -1.013 3.598 6.793 1.00 52.23 C ATOM 1471 ND1 HIS A 102 -2.049 2.695 6.839 1.00 61.42 N ATOM 1472 CD2 HIS A 102 0.011 3.024 7.468 1.00 14.13 C ATOM 1473 CE1 HIS A 102 -1.671 1.626 7.509 1.00 44.23 C ATOM 1474 NE2 HIS A 102 -0.423 1.798 7.903 1.00 12.32 N ATOM 0 H HIS A 102 -1.228 6.831 4.351 1.00 63.14 H new ATOM 0 HA HIS A 102 0.812 4.884 5.190 1.00 63.04 H new ATOM 0 HB2 HIS A 102 -0.860 5.716 6.833 1.00 73.43 H new ATOM 0 HB3 HIS A 102 -2.150 5.103 5.818 1.00 73.43 H new ATOM 0 HD2 HIS A 102 0.989 3.452 7.633 1.00 14.13 H new ATOM 0 HE1 HIS A 102 -2.280 0.755 7.703 1.00 44.23 H new ATOM 0 HE2 HIS A 102 0.128 1.130 8.442 1.00 12.32 H new ATOM 1483 N ILE A 103 0.361 3.415 3.240 1.00 32.11 N ATOM 1484 CA ILE A 103 0.096 2.438 2.202 1.00 12.44 C ATOM 1485 C ILE A 103 -0.060 1.046 2.802 1.00 24.41 C ATOM 1486 O ILE A 103 0.889 0.482 3.352 1.00 75.53 O ATOM 1487 CB ILE A 103 1.219 2.428 1.135 1.00 11.21 C ATOM 1488 CG1 ILE A 103 1.443 3.843 0.594 1.00 40.31 C ATOM 1489 CG2 ILE A 103 0.861 1.478 -0.003 1.00 40.12 C ATOM 1490 CD1 ILE A 103 2.609 3.951 -0.363 1.00 50.50 C ATOM 0 H ILE A 103 1.347 3.531 3.473 1.00 32.11 H new ATOM 0 HA ILE A 103 -0.836 2.723 1.715 1.00 12.44 H new ATOM 0 HB ILE A 103 2.141 2.079 1.600 1.00 11.21 H new ATOM 0 HG12 ILE A 103 0.537 4.176 0.088 1.00 40.31 H new ATOM 0 HG13 ILE A 103 1.608 4.521 1.432 1.00 40.31 H new ATOM 0 HG21 ILE A 103 1.660 1.482 -0.745 1.00 40.12 H new ATOM 0 HG22 ILE A 103 0.736 0.469 0.391 1.00 40.12 H new ATOM 0 HG23 ILE A 103 -0.069 1.803 -0.469 1.00 40.12 H new ATOM 0 HD11 ILE A 103 2.706 4.982 -0.704 1.00 50.50 H new ATOM 0 HD12 ILE A 103 3.525 3.649 0.144 1.00 50.50 H new ATOM 0 HD13 ILE A 103 2.438 3.300 -1.220 1.00 50.50 H new ATOM 1502 N SER A 104 -1.271 0.535 2.736 1.00 13.34 N ATOM 1503 CA SER A 104 -1.591 -0.789 3.235 1.00 1.32 C ATOM 1504 C SER A 104 -1.602 -1.810 2.097 1.00 13.05 C ATOM 1505 O SER A 104 -1.517 -1.442 0.922 1.00 64.23 O ATOM 1506 CB SER A 104 -2.932 -0.767 3.941 1.00 3.25 C ATOM 1507 OG SER A 104 -2.959 0.234 4.944 1.00 72.52 O ATOM 0 H SER A 104 -2.067 1.028 2.332 1.00 13.34 H new ATOM 0 HA SER A 104 -0.822 -1.086 3.948 1.00 1.32 H new ATOM 0 HB2 SER A 104 -3.726 -0.583 3.217 1.00 3.25 H new ATOM 0 HB3 SER A 104 -3.128 -1.741 4.389 1.00 3.25 H new ATOM 0 HG SER A 104 -3.834 0.231 5.385 1.00 72.52 H new ATOM 1513 N LEU A 105 -1.747 -3.079 2.445 1.00 51.31 N ATOM 1514 CA LEU A 105 -1.685 -4.148 1.468 1.00 22.12 C ATOM 1515 C LEU A 105 -2.617 -5.279 1.854 1.00 3.31 C ATOM 1516 O LEU A 105 -2.452 -5.902 2.905 1.00 70.34 O ATOM 1517 CB LEU A 105 -0.260 -4.687 1.343 1.00 62.32 C ATOM 1518 CG LEU A 105 -0.059 -5.839 0.345 1.00 21.32 C ATOM 1519 CD1 LEU A 105 -0.429 -5.408 -1.071 1.00 2.13 C ATOM 1520 CD2 LEU A 105 1.376 -6.341 0.393 1.00 61.11 C ATOM 0 H LEU A 105 -1.909 -3.392 3.402 1.00 51.31 H new ATOM 0 HA LEU A 105 -1.996 -3.738 0.507 1.00 22.12 H new ATOM 0 HB2 LEU A 105 0.394 -3.864 1.054 1.00 62.32 H new ATOM 0 HB3 LEU A 105 0.067 -5.024 2.327 1.00 62.32 H new ATOM 0 HG LEU A 105 -0.722 -6.655 0.633 1.00 21.32 H new ATOM 0 HD11 LEU A 105 -0.277 -6.242 -1.756 1.00 2.13 H new ATOM 0 HD12 LEU A 105 -1.475 -5.103 -1.097 1.00 2.13 H new ATOM 0 HD13 LEU A 105 0.201 -4.571 -1.373 1.00 2.13 H new ATOM 0 HD21 LEU A 105 1.500 -7.156 -0.320 1.00 61.11 H new ATOM 0 HD22 LEU A 105 2.055 -5.528 0.136 1.00 61.11 H new ATOM 0 HD23 LEU A 105 1.603 -6.699 1.397 1.00 61.11 H new ATOM 1532 N LYS A 106 -3.604 -5.524 1.030 1.00 64.13 N ATOM 1533 CA LYS A 106 -4.499 -6.636 1.235 1.00 10.42 C ATOM 1534 C LYS A 106 -4.304 -7.626 0.102 1.00 73.42 C ATOM 1535 O LYS A 106 -4.304 -7.245 -1.063 1.00 31.10 O ATOM 1536 CB LYS A 106 -5.957 -6.159 1.306 1.00 2.20 C ATOM 1537 CG LYS A 106 -6.987 -7.285 1.402 1.00 61.31 C ATOM 1538 CD LYS A 106 -6.762 -8.147 2.637 1.00 61.12 C ATOM 1539 CE LYS A 106 -7.741 -9.312 2.697 1.00 22.04 C ATOM 1540 NZ LYS A 106 -9.147 -8.857 2.852 1.00 13.15 N ATOM 0 H LYS A 106 -3.810 -4.963 0.203 1.00 64.13 H new ATOM 0 HA LYS A 106 -4.273 -7.120 2.185 1.00 10.42 H new ATOM 0 HB2 LYS A 106 -6.071 -5.505 2.170 1.00 2.20 H new ATOM 0 HB3 LYS A 106 -6.174 -5.560 0.422 1.00 2.20 H new ATOM 0 HG2 LYS A 106 -7.990 -6.860 1.432 1.00 61.31 H new ATOM 0 HG3 LYS A 106 -6.931 -7.907 0.509 1.00 61.31 H new ATOM 0 HD2 LYS A 106 -5.741 -8.529 2.633 1.00 61.12 H new ATOM 0 HD3 LYS A 106 -6.869 -7.535 3.532 1.00 61.12 H new ATOM 0 HE2 LYS A 106 -7.652 -9.907 1.788 1.00 22.04 H new ATOM 0 HE3 LYS A 106 -7.478 -9.963 3.531 1.00 22.04 H new ATOM 0 HZ1 LYS A 106 -9.761 -9.679 3.024 1.00 13.15 H new ATOM 0 HZ2 LYS A 106 -9.213 -8.201 3.656 1.00 13.15 H new ATOM 0 HZ3 LYS A 106 -9.453 -8.372 1.984 1.00 13.15 H new ATOM 1554 N LEU A 107 -4.135 -8.879 0.438 1.00 52.34 N ATOM 1555 CA LEU A 107 -3.873 -9.894 -0.555 1.00 70.30 C ATOM 1556 C LEU A 107 -4.806 -11.070 -0.360 1.00 33.12 C ATOM 1557 O LEU A 107 -4.860 -11.661 0.721 1.00 41.05 O ATOM 1558 CB LEU A 107 -2.412 -10.351 -0.463 1.00 42.22 C ATOM 1559 CG LEU A 107 -1.970 -11.417 -1.470 1.00 53.10 C ATOM 1560 CD1 LEU A 107 -2.068 -10.893 -2.895 1.00 41.51 C ATOM 1561 CD2 LEU A 107 -0.553 -11.873 -1.164 1.00 14.03 C ATOM 0 H LEU A 107 -4.174 -9.224 1.397 1.00 52.34 H new ATOM 0 HA LEU A 107 -4.048 -9.474 -1.545 1.00 70.30 H new ATOM 0 HB2 LEU A 107 -1.772 -9.477 -0.586 1.00 42.22 H new ATOM 0 HB3 LEU A 107 -2.236 -10.736 0.542 1.00 42.22 H new ATOM 0 HG LEU A 107 -2.640 -12.272 -1.380 1.00 53.10 H new ATOM 0 HD11 LEU A 107 -1.749 -11.669 -3.591 1.00 41.51 H new ATOM 0 HD12 LEU A 107 -3.100 -10.615 -3.110 1.00 41.51 H new ATOM 0 HD13 LEU A 107 -1.426 -10.019 -3.006 1.00 41.51 H new ATOM 0 HD21 LEU A 107 -0.251 -12.631 -1.887 1.00 14.03 H new ATOM 0 HD22 LEU A 107 0.125 -11.021 -1.226 1.00 14.03 H new ATOM 0 HD23 LEU A 107 -0.515 -12.294 -0.159 1.00 14.03 H new ATOM 1573 N ASP A 108 -5.546 -11.402 -1.396 1.00 73.24 N ATOM 1574 CA ASP A 108 -6.482 -12.507 -1.356 1.00 45.34 C ATOM 1575 C ASP A 108 -6.313 -13.342 -2.610 1.00 42.11 C ATOM 1576 O ASP A 108 -6.446 -12.826 -3.711 1.00 4.23 O ATOM 1577 CB ASP A 108 -7.919 -11.966 -1.263 1.00 4.45 C ATOM 1578 CG ASP A 108 -8.976 -13.051 -1.336 1.00 1.23 C ATOM 1579 OD1 ASP A 108 -9.199 -13.741 -0.321 1.00 74.54 O ATOM 1580 OD2 ASP A 108 -9.606 -13.202 -2.402 1.00 44.44 O ATOM 0 H ASP A 108 -5.516 -10.914 -2.291 1.00 73.24 H new ATOM 0 HA ASP A 108 -6.288 -13.128 -0.481 1.00 45.34 H new ATOM 0 HB2 ASP A 108 -8.034 -11.419 -0.327 1.00 4.45 H new ATOM 0 HB3 ASP A 108 -8.084 -11.253 -2.071 1.00 4.45 H new ATOM 1585 N ASP A 109 -6.036 -14.634 -2.422 1.00 13.32 N ATOM 1586 CA ASP A 109 -5.751 -15.585 -3.522 1.00 73.44 C ATOM 1587 C ASP A 109 -4.728 -15.074 -4.547 1.00 61.33 C ATOM 1588 O ASP A 109 -3.551 -15.418 -4.473 1.00 72.50 O ATOM 1589 CB ASP A 109 -7.030 -16.055 -4.217 1.00 23.32 C ATOM 1590 CG ASP A 109 -7.735 -17.147 -3.440 1.00 60.02 C ATOM 1591 OD1 ASP A 109 -7.152 -18.243 -3.281 1.00 1.20 O ATOM 1592 OD2 ASP A 109 -8.878 -16.921 -2.987 1.00 14.44 O ATOM 0 H ASP A 109 -6.001 -15.063 -1.497 1.00 13.32 H new ATOM 0 HA ASP A 109 -5.286 -16.442 -3.035 1.00 73.44 H new ATOM 0 HB2 ASP A 109 -7.705 -15.208 -4.344 1.00 23.32 H new ATOM 0 HB3 ASP A 109 -6.786 -16.421 -5.214 1.00 23.32 H new ATOM 1597 N ASN A 110 -5.172 -14.259 -5.489 1.00 14.42 N ATOM 1598 CA ASN A 110 -4.294 -13.753 -6.538 1.00 11.51 C ATOM 1599 C ASN A 110 -4.638 -12.306 -6.885 1.00 64.11 C ATOM 1600 O ASN A 110 -4.340 -11.825 -7.983 1.00 1.23 O ATOM 1601 CB ASN A 110 -4.397 -14.640 -7.798 1.00 20.23 C ATOM 1602 CG ASN A 110 -5.790 -14.644 -8.419 1.00 3.52 C ATOM 1603 OD1 ASN A 110 -6.113 -13.801 -9.250 1.00 23.41 O ATOM 1604 ND2 ASN A 110 -6.610 -15.606 -8.035 1.00 60.10 N ATOM 0 H ASN A 110 -6.136 -13.932 -5.551 1.00 14.42 H new ATOM 0 HA ASN A 110 -3.270 -13.783 -6.167 1.00 11.51 H new ATOM 0 HB2 ASN A 110 -3.677 -14.292 -8.539 1.00 20.23 H new ATOM 0 HB3 ASN A 110 -4.119 -15.662 -7.539 1.00 20.23 H new ATOM 0 HD21 ASN A 110 -7.548 -15.666 -8.432 1.00 60.10 H new ATOM 0 HD22 ASN A 110 -6.305 -16.289 -7.341 1.00 60.10 H new ATOM 1611 N GLN A 111 -5.211 -11.600 -5.924 1.00 55.20 N ATOM 1612 CA GLN A 111 -5.602 -10.215 -6.124 1.00 53.11 C ATOM 1613 C GLN A 111 -5.140 -9.372 -4.948 1.00 13.24 C ATOM 1614 O GLN A 111 -5.147 -9.837 -3.799 1.00 1.15 O ATOM 1615 CB GLN A 111 -7.121 -10.081 -6.296 1.00 14.03 C ATOM 1616 CG GLN A 111 -7.921 -10.405 -5.045 1.00 72.21 C ATOM 1617 CD GLN A 111 -9.382 -10.053 -5.180 1.00 64.33 C ATOM 1618 OE1 GLN A 111 -10.194 -10.870 -5.611 1.00 43.20 O ATOM 1619 NE2 GLN A 111 -9.731 -8.837 -4.809 1.00 22.20 N ATOM 0 H GLN A 111 -5.416 -11.966 -4.994 1.00 55.20 H new ATOM 0 HA GLN A 111 -5.126 -9.860 -7.038 1.00 53.11 H new ATOM 0 HB2 GLN A 111 -7.352 -9.062 -6.607 1.00 14.03 H new ATOM 0 HB3 GLN A 111 -7.444 -10.741 -7.101 1.00 14.03 H new ATOM 0 HG2 GLN A 111 -7.827 -11.468 -4.824 1.00 72.21 H new ATOM 0 HG3 GLN A 111 -7.498 -9.864 -4.198 1.00 72.21 H new ATOM 0 HE21 GLN A 111 -9.026 -8.189 -4.457 1.00 22.20 H new ATOM 0 HE22 GLN A 111 -10.706 -8.544 -4.874 1.00 22.20 H new ATOM 1628 N ALA A 112 -4.720 -8.156 -5.225 1.00 31.54 N ATOM 1629 CA ALA A 112 -4.259 -7.266 -4.184 1.00 54.33 C ATOM 1630 C ALA A 112 -5.117 -6.017 -4.103 1.00 74.43 C ATOM 1631 O ALA A 112 -5.364 -5.359 -5.107 1.00 44.44 O ATOM 1632 CB ALA A 112 -2.806 -6.889 -4.416 1.00 21.11 C ATOM 0 H ALA A 112 -4.689 -7.762 -6.165 1.00 31.54 H new ATOM 0 HA ALA A 112 -4.343 -7.794 -3.234 1.00 54.33 H new ATOM 0 HB1 ALA A 112 -2.473 -6.218 -3.624 1.00 21.11 H new ATOM 0 HB2 ALA A 112 -2.191 -7.789 -4.411 1.00 21.11 H new ATOM 0 HB3 ALA A 112 -2.709 -6.389 -5.379 1.00 21.11 H new ATOM 1638 N GLN A 113 -5.575 -5.710 -2.912 1.00 2.13 N ATOM 1639 CA GLN A 113 -6.355 -4.515 -2.670 1.00 34.24 C ATOM 1640 C GLN A 113 -5.496 -3.477 -1.969 1.00 2.32 C ATOM 1641 O GLN A 113 -4.964 -3.724 -0.878 1.00 13.30 O ATOM 1642 CB GLN A 113 -7.603 -4.838 -1.831 1.00 65.44 C ATOM 1643 CG GLN A 113 -8.269 -3.613 -1.209 1.00 32.43 C ATOM 1644 CD GLN A 113 -9.473 -3.965 -0.357 1.00 20.13 C ATOM 1645 OE1 GLN A 113 -9.550 -5.052 0.214 1.00 12.42 O ATOM 1646 NE2 GLN A 113 -10.405 -3.041 -0.243 1.00 43.32 N ATOM 0 H GLN A 113 -5.418 -6.281 -2.082 1.00 2.13 H new ATOM 0 HA GLN A 113 -6.689 -4.114 -3.627 1.00 34.24 H new ATOM 0 HB2 GLN A 113 -8.329 -5.352 -2.461 1.00 65.44 H new ATOM 0 HB3 GLN A 113 -7.324 -5.530 -1.036 1.00 65.44 H new ATOM 0 HG2 GLN A 113 -7.540 -3.081 -0.597 1.00 32.43 H new ATOM 0 HG3 GLN A 113 -8.578 -2.932 -2.002 1.00 32.43 H new ATOM 0 HE21 GLN A 113 -10.304 -2.152 -0.733 1.00 43.32 H new ATOM 0 HE22 GLN A 113 -11.227 -3.215 0.335 1.00 43.32 H new ATOM 1655 N LEU A 114 -5.347 -2.332 -2.593 1.00 64.12 N ATOM 1656 CA LEU A 114 -4.543 -1.269 -2.031 1.00 42.24 C ATOM 1657 C LEU A 114 -5.400 -0.291 -1.249 1.00 22.12 C ATOM 1658 O LEU A 114 -6.218 0.434 -1.824 1.00 54.42 O ATOM 1659 CB LEU A 114 -3.775 -0.529 -3.129 1.00 61.12 C ATOM 1660 CG LEU A 114 -2.758 -1.363 -3.914 1.00 31.05 C ATOM 1661 CD1 LEU A 114 -2.110 -0.521 -5.000 1.00 30.54 C ATOM 1662 CD2 LEU A 114 -1.699 -1.940 -2.983 1.00 64.04 C ATOM 0 H LEU A 114 -5.773 -2.111 -3.493 1.00 64.12 H new ATOM 0 HA LEU A 114 -3.826 -1.724 -1.347 1.00 42.24 H new ATOM 0 HB2 LEU A 114 -4.496 -0.114 -3.833 1.00 61.12 H new ATOM 0 HB3 LEU A 114 -3.252 0.313 -2.675 1.00 61.12 H new ATOM 0 HG LEU A 114 -3.285 -2.193 -4.385 1.00 31.05 H new ATOM 0 HD11 LEU A 114 -1.390 -1.127 -5.549 1.00 30.54 H new ATOM 0 HD12 LEU A 114 -2.876 -0.158 -5.685 1.00 30.54 H new ATOM 0 HD13 LEU A 114 -1.598 0.328 -4.546 1.00 30.54 H new ATOM 0 HD21 LEU A 114 -0.987 -2.529 -3.562 1.00 64.04 H new ATOM 0 HD22 LEU A 114 -1.174 -1.127 -2.481 1.00 64.04 H new ATOM 0 HD23 LEU A 114 -2.177 -2.578 -2.239 1.00 64.04 H new ATOM 1674 N GLN A 115 -5.233 -0.299 0.060 1.00 50.55 N ATOM 1675 CA GLN A 115 -5.930 0.637 0.923 1.00 11.14 C ATOM 1676 C GLN A 115 -5.019 1.829 1.169 1.00 51.15 C ATOM 1677 O GLN A 115 -3.858 1.659 1.558 1.00 53.11 O ATOM 1678 CB GLN A 115 -6.306 -0.016 2.258 1.00 61.42 C ATOM 1679 CG GLN A 115 -6.989 -1.371 2.128 1.00 30.34 C ATOM 1680 CD GLN A 115 -7.302 -2.002 3.478 1.00 43.11 C ATOM 1681 OE1 GLN A 115 -6.499 -1.690 4.483 1.00 2.44 O flip ATOM 1682 NE2 GLN A 115 -8.260 -2.762 3.616 1.00 41.34 N flip ATOM 0 H GLN A 115 -4.617 -0.947 0.551 1.00 50.55 H new ATOM 0 HA GLN A 115 -6.853 0.954 0.438 1.00 11.14 H new ATOM 0 HB2 GLN A 115 -5.403 -0.134 2.857 1.00 61.42 H new ATOM 0 HB3 GLN A 115 -6.965 0.658 2.805 1.00 61.42 H new ATOM 0 HG2 GLN A 115 -7.914 -1.255 1.563 1.00 30.34 H new ATOM 0 HG3 GLN A 115 -6.348 -2.043 1.557 1.00 30.34 H new ATOM 0 HE21 GLN A 115 -8.857 -2.980 2.818 1.00 41.34 H new ATOM 0 HE22 GLN A 115 -8.457 -3.174 4.528 1.00 41.34 H new ATOM 1691 N MET A 116 -5.533 3.018 0.953 1.00 53.23 N ATOM 1692 CA MET A 116 -4.735 4.226 1.079 1.00 72.40 C ATOM 1693 C MET A 116 -5.518 5.311 1.787 1.00 64.24 C ATOM 1694 O MET A 116 -6.733 5.416 1.623 1.00 44.42 O ATOM 1695 CB MET A 116 -4.268 4.710 -0.296 1.00 21.25 C ATOM 1696 CG MET A 116 -3.199 3.823 -0.926 1.00 34.42 C ATOM 1697 SD MET A 116 -2.851 4.251 -2.640 1.00 23.32 S ATOM 1698 CE MET A 116 -4.387 3.766 -3.426 1.00 52.31 C ATOM 0 H MET A 116 -6.505 3.180 0.688 1.00 53.23 H new ATOM 0 HA MET A 116 -3.854 3.993 1.677 1.00 72.40 H new ATOM 0 HB2 MET A 116 -5.127 4.760 -0.965 1.00 21.25 H new ATOM 0 HB3 MET A 116 -3.878 5.723 -0.202 1.00 21.25 H new ATOM 0 HG2 MET A 116 -2.281 3.901 -0.344 1.00 34.42 H new ATOM 0 HG3 MET A 116 -3.521 2.783 -0.875 1.00 34.42 H new ATOM 0 HE1 MET A 116 -4.184 3.424 -4.441 1.00 52.31 H new ATOM 0 HE2 MET A 116 -4.848 2.959 -2.857 1.00 52.31 H new ATOM 0 HE3 MET A 116 -5.064 4.620 -3.459 1.00 52.31 H new ATOM 1708 N VAL A 117 -4.825 6.107 2.579 1.00 11.13 N ATOM 1709 CA VAL A 117 -5.461 7.174 3.328 1.00 13.43 C ATOM 1710 C VAL A 117 -4.898 8.534 2.931 1.00 42.40 C ATOM 1711 O VAL A 117 -3.710 8.806 3.120 1.00 63.34 O ATOM 1712 CB VAL A 117 -5.286 6.976 4.852 1.00 34.43 C ATOM 1713 CG1 VAL A 117 -5.952 8.101 5.619 1.00 42.45 C ATOM 1714 CG2 VAL A 117 -5.847 5.632 5.285 1.00 54.42 C ATOM 0 H VAL A 117 -3.817 6.034 2.721 1.00 11.13 H new ATOM 0 HA VAL A 117 -6.524 7.141 3.087 1.00 13.43 H new ATOM 0 HB VAL A 117 -4.220 6.993 5.077 1.00 34.43 H new ATOM 0 HG11 VAL A 117 -5.817 7.942 6.689 1.00 42.45 H new ATOM 0 HG12 VAL A 117 -5.502 9.052 5.334 1.00 42.45 H new ATOM 0 HG13 VAL A 117 -7.017 8.119 5.387 1.00 42.45 H new ATOM 0 HG21 VAL A 117 -5.714 5.512 6.360 1.00 54.42 H new ATOM 0 HG22 VAL A 117 -6.909 5.586 5.043 1.00 54.42 H new ATOM 0 HG23 VAL A 117 -5.321 4.833 4.763 1.00 54.42 H new ATOM 1724 N SER A 118 -5.751 9.370 2.368 1.00 14.30 N ATOM 1725 CA SER A 118 -5.384 10.715 1.966 1.00 31.13 C ATOM 1726 C SER A 118 -6.653 11.555 1.810 1.00 53.22 C ATOM 1727 O SER A 118 -7.687 11.035 1.399 1.00 0.42 O ATOM 1728 CB SER A 118 -4.602 10.670 0.646 1.00 2.12 C ATOM 1729 OG SER A 118 -5.281 9.879 -0.320 1.00 52.52 O ATOM 0 H SER A 118 -6.724 9.133 2.176 1.00 14.30 H new ATOM 0 HA SER A 118 -4.748 11.167 2.727 1.00 31.13 H new ATOM 0 HB2 SER A 118 -4.468 11.682 0.264 1.00 2.12 H new ATOM 0 HB3 SER A 118 -3.607 10.261 0.822 1.00 2.12 H new ATOM 0 HG SER A 118 -4.765 9.866 -1.153 1.00 52.52 H new ATOM 1735 N PRO A 119 -6.601 12.852 2.148 1.00 12.32 N ATOM 1736 CA PRO A 119 -7.770 13.743 2.055 1.00 53.22 C ATOM 1737 C PRO A 119 -8.202 13.985 0.606 1.00 71.34 C ATOM 1738 O PRO A 119 -7.522 13.565 -0.337 1.00 73.12 O ATOM 1739 CB PRO A 119 -7.270 15.048 2.685 1.00 50.44 C ATOM 1740 CG PRO A 119 -5.795 15.006 2.515 1.00 42.42 C ATOM 1741 CD PRO A 119 -5.408 13.562 2.638 1.00 2.22 C ATOM 0 HA PRO A 119 -8.645 13.321 2.548 1.00 53.22 H new ATOM 0 HB2 PRO A 119 -7.701 15.918 2.190 1.00 50.44 H new ATOM 0 HB3 PRO A 119 -7.546 15.111 3.738 1.00 50.44 H new ATOM 0 HG2 PRO A 119 -5.502 15.408 1.545 1.00 42.42 H new ATOM 0 HG3 PRO A 119 -5.297 15.610 3.274 1.00 42.42 H new ATOM 0 HD2 PRO A 119 -4.527 13.329 2.040 1.00 2.22 H new ATOM 0 HD3 PRO A 119 -5.175 13.294 3.668 1.00 2.22 H new ATOM 1749 N HIS A 120 -9.322 14.664 0.425 1.00 4.52 N ATOM 1750 CA HIS A 120 -9.802 14.953 -0.912 1.00 15.44 C ATOM 1751 C HIS A 120 -9.226 16.267 -1.403 1.00 51.15 C ATOM 1752 O HIS A 120 -9.291 17.284 -0.717 1.00 74.13 O ATOM 1753 CB HIS A 120 -11.355 14.938 -1.005 1.00 32.01 C ATOM 1754 CG HIS A 120 -12.084 15.878 -0.074 1.00 24.13 C ATOM 1755 ND1 HIS A 120 -12.873 15.439 0.967 1.00 4.52 N ATOM 1756 CD2 HIS A 120 -12.170 17.232 -0.053 1.00 33.22 C ATOM 1757 CE1 HIS A 120 -13.408 16.477 1.580 1.00 60.14 C ATOM 1758 NE2 HIS A 120 -12.996 17.572 0.982 1.00 1.21 N ATOM 0 H HIS A 120 -9.909 15.021 1.179 1.00 4.52 H new ATOM 0 HA HIS A 120 -9.453 14.154 -1.566 1.00 15.44 H new ATOM 0 HB2 HIS A 120 -11.640 15.179 -2.029 1.00 32.01 H new ATOM 0 HB3 HIS A 120 -11.701 13.923 -0.809 1.00 32.01 H new ATOM 0 HD2 HIS A 120 -11.677 17.915 -0.729 1.00 33.22 H new ATOM 0 HE1 HIS A 120 -14.073 16.434 2.430 1.00 60.14 H new ATOM 0 HE2 HIS A 120 -13.251 18.523 1.247 1.00 1.21 H new ATOM 1767 N SER A 121 -8.638 16.222 -2.572 1.00 72.12 N ATOM 1768 CA SER A 121 -8.000 17.367 -3.172 1.00 64.52 C ATOM 1769 C SER A 121 -7.563 16.982 -4.576 1.00 32.01 C ATOM 1770 O SER A 121 -7.843 15.864 -5.027 1.00 60.20 O ATOM 1771 CB SER A 121 -6.786 17.803 -2.325 1.00 13.24 C ATOM 1772 OG SER A 121 -6.218 19.008 -2.810 1.00 31.41 O ATOM 0 H SER A 121 -8.588 15.377 -3.142 1.00 72.12 H new ATOM 0 HA SER A 121 -8.693 18.207 -3.217 1.00 64.52 H new ATOM 0 HB2 SER A 121 -7.094 17.937 -1.288 1.00 13.24 H new ATOM 0 HB3 SER A 121 -6.033 17.015 -2.335 1.00 13.24 H new ATOM 0 HG SER A 121 -5.453 19.257 -2.251 1.00 31.41 H new ATOM 1778 N HIS A 122 -6.865 17.870 -5.257 1.00 53.13 N ATOM 1779 CA HIS A 122 -6.426 17.596 -6.610 1.00 55.30 C ATOM 1780 C HIS A 122 -5.370 16.494 -6.623 1.00 44.13 C ATOM 1781 O HIS A 122 -5.151 15.850 -7.650 1.00 4.34 O ATOM 1782 CB HIS A 122 -5.902 18.861 -7.294 1.00 53.23 C ATOM 1783 CG HIS A 122 -5.789 18.726 -8.782 1.00 31.14 C ATOM 1784 ND1 HIS A 122 -4.632 18.976 -9.479 1.00 21.02 N ATOM 1785 CD2 HIS A 122 -6.709 18.363 -9.708 1.00 62.13 C ATOM 1786 CE1 HIS A 122 -4.842 18.771 -10.763 1.00 40.32 C ATOM 1787 NE2 HIS A 122 -6.093 18.399 -10.928 1.00 22.14 N ATOM 0 H HIS A 122 -6.591 18.784 -4.897 1.00 53.13 H new ATOM 0 HA HIS A 122 -7.290 17.249 -7.176 1.00 55.30 H new ATOM 0 HB2 HIS A 122 -6.566 19.693 -7.061 1.00 53.23 H new ATOM 0 HB3 HIS A 122 -4.923 19.109 -6.883 1.00 53.23 H new ATOM 0 HD2 HIS A 122 -7.738 18.095 -9.518 1.00 62.13 H new ATOM 0 HE1 HIS A 122 -4.110 18.889 -11.548 1.00 40.32 H new ATOM 0 HE2 HIS A 122 -6.532 18.174 -11.821 1.00 22.14 H new ATOM 1796 N VAL A 123 -4.716 16.268 -5.478 1.00 2.44 N ATOM 1797 CA VAL A 123 -3.735 15.199 -5.360 1.00 2.33 C ATOM 1798 C VAL A 123 -4.426 13.847 -5.493 1.00 44.33 C ATOM 1799 O VAL A 123 -3.912 12.940 -6.139 1.00 2.52 O ATOM 1800 CB VAL A 123 -2.995 15.252 -3.995 1.00 14.01 C ATOM 1801 CG1 VAL A 123 -1.938 14.158 -3.905 1.00 60.54 C ATOM 1802 CG2 VAL A 123 -2.364 16.617 -3.771 1.00 63.31 C ATOM 0 H VAL A 123 -4.852 16.812 -4.626 1.00 2.44 H new ATOM 0 HA VAL A 123 -3.004 15.332 -6.158 1.00 2.33 H new ATOM 0 HB VAL A 123 -3.733 15.082 -3.211 1.00 14.01 H new ATOM 0 HG11 VAL A 123 -1.435 14.217 -2.940 1.00 60.54 H new ATOM 0 HG12 VAL A 123 -2.414 13.183 -4.007 1.00 60.54 H new ATOM 0 HG13 VAL A 123 -1.208 14.291 -4.704 1.00 60.54 H new ATOM 0 HG21 VAL A 123 -1.852 16.628 -2.809 1.00 63.31 H new ATOM 0 HG22 VAL A 123 -1.647 16.821 -4.566 1.00 63.31 H new ATOM 0 HG23 VAL A 123 -3.140 17.382 -3.778 1.00 63.31 H new ATOM 1812 N ARG A 124 -5.618 13.735 -4.902 1.00 72.34 N ATOM 1813 CA ARG A 124 -6.380 12.493 -4.955 1.00 62.33 C ATOM 1814 C ARG A 124 -6.819 12.207 -6.387 1.00 44.52 C ATOM 1815 O ARG A 124 -6.891 11.054 -6.806 1.00 62.24 O ATOM 1816 CB ARG A 124 -7.598 12.542 -4.019 1.00 14.32 C ATOM 1817 CG ARG A 124 -8.428 11.262 -4.040 1.00 71.52 C ATOM 1818 CD ARG A 124 -9.697 11.386 -3.211 1.00 60.02 C ATOM 1819 NE ARG A 124 -9.452 11.307 -1.766 1.00 22.13 N ATOM 1820 CZ ARG A 124 -10.429 11.249 -0.849 1.00 21.14 C ATOM 1821 NH1 ARG A 124 -11.701 11.316 -1.226 1.00 70.44 N ATOM 1822 NH2 ARG A 124 -10.132 11.130 0.435 1.00 70.10 N ATOM 0 H ARG A 124 -6.072 14.488 -4.384 1.00 72.34 H new ATOM 0 HA ARG A 124 -5.733 11.685 -4.614 1.00 62.33 H new ATOM 0 HB2 ARG A 124 -7.257 12.729 -3.001 1.00 14.32 H new ATOM 0 HB3 ARG A 124 -8.232 13.382 -4.303 1.00 14.32 H new ATOM 0 HG2 ARG A 124 -8.691 11.018 -5.069 1.00 71.52 H new ATOM 0 HG3 ARG A 124 -7.827 10.435 -3.660 1.00 71.52 H new ATOM 0 HD2 ARG A 124 -10.182 12.335 -3.440 1.00 60.02 H new ATOM 0 HD3 ARG A 124 -10.391 10.596 -3.499 1.00 60.02 H new ATOM 0 HE ARG A 124 -8.485 11.296 -1.441 1.00 22.13 H new ATOM 0 HH11 ARG A 124 -11.936 11.412 -2.214 1.00 70.44 H new ATOM 0 HH12 ARG A 124 -12.443 11.272 -0.527 1.00 70.44 H new ATOM 0 HH21 ARG A 124 -9.157 11.082 0.731 1.00 70.10 H new ATOM 0 HH22 ARG A 124 -10.878 11.086 1.129 1.00 70.10 H new ATOM 1836 N ALA A 125 -7.101 13.270 -7.137 1.00 51.40 N ATOM 1837 CA ALA A 125 -7.470 13.146 -8.542 1.00 55.30 C ATOM 1838 C ALA A 125 -6.339 12.483 -9.314 1.00 32.22 C ATOM 1839 O ALA A 125 -6.557 11.559 -10.101 1.00 71.43 O ATOM 1840 CB ALA A 125 -7.766 14.519 -9.127 1.00 10.43 C ATOM 0 H ALA A 125 -7.080 14.230 -6.792 1.00 51.40 H new ATOM 0 HA ALA A 125 -8.366 12.530 -8.622 1.00 55.30 H new ATOM 0 HB1 ALA A 125 -8.041 14.416 -10.177 1.00 10.43 H new ATOM 0 HB2 ALA A 125 -8.590 14.978 -8.580 1.00 10.43 H new ATOM 0 HB3 ALA A 125 -6.880 15.149 -9.044 1.00 10.43 H new ATOM 1846 N ALA A 126 -5.129 12.962 -9.080 1.00 25.22 N ATOM 1847 CA ALA A 126 -3.951 12.408 -9.717 1.00 72.15 C ATOM 1848 C ALA A 126 -3.647 11.012 -9.179 1.00 75.43 C ATOM 1849 O ALA A 126 -3.160 10.148 -9.910 1.00 52.33 O ATOM 1850 CB ALA A 126 -2.765 13.330 -9.514 1.00 13.31 C ATOM 0 H ALA A 126 -4.938 13.740 -8.448 1.00 25.22 H new ATOM 0 HA ALA A 126 -4.146 12.320 -10.786 1.00 72.15 H new ATOM 0 HB1 ALA A 126 -1.886 12.904 -9.997 1.00 13.31 H new ATOM 0 HB2 ALA A 126 -2.983 14.304 -9.952 1.00 13.31 H new ATOM 0 HB3 ALA A 126 -2.573 13.446 -8.447 1.00 13.31 H new ATOM 1856 N LEU A 127 -3.941 10.803 -7.897 1.00 51.11 N ATOM 1857 CA LEU A 127 -3.752 9.507 -7.255 1.00 20.23 C ATOM 1858 C LEU A 127 -4.637 8.474 -7.946 1.00 31.44 C ATOM 1859 O LEU A 127 -4.178 7.398 -8.328 1.00 10.41 O ATOM 1860 CB LEU A 127 -4.101 9.614 -5.747 1.00 64.00 C ATOM 1861 CG LEU A 127 -3.639 8.462 -4.815 1.00 41.14 C ATOM 1862 CD1 LEU A 127 -4.391 7.170 -5.087 1.00 64.10 C ATOM 1863 CD2 LEU A 127 -2.139 8.242 -4.928 1.00 14.13 C ATOM 0 H LEU A 127 -4.314 11.523 -7.279 1.00 51.11 H new ATOM 0 HA LEU A 127 -2.711 9.195 -7.343 1.00 20.23 H new ATOM 0 HB2 LEU A 127 -3.673 10.543 -5.369 1.00 64.00 H new ATOM 0 HB3 LEU A 127 -5.184 9.703 -5.659 1.00 64.00 H new ATOM 0 HG LEU A 127 -3.871 8.764 -3.794 1.00 41.14 H new ATOM 0 HD11 LEU A 127 -4.034 6.392 -4.412 1.00 64.10 H new ATOM 0 HD12 LEU A 127 -5.457 7.329 -4.927 1.00 64.10 H new ATOM 0 HD13 LEU A 127 -4.221 6.861 -6.118 1.00 64.10 H new ATOM 0 HD21 LEU A 127 -1.839 7.430 -4.266 1.00 14.13 H new ATOM 0 HD22 LEU A 127 -1.886 7.984 -5.956 1.00 14.13 H new ATOM 0 HD23 LEU A 127 -1.615 9.154 -4.643 1.00 14.13 H new ATOM 1875 N GLU A 128 -5.905 8.826 -8.122 1.00 74.23 N ATOM 1876 CA GLU A 128 -6.862 7.960 -8.783 1.00 23.41 C ATOM 1877 C GLU A 128 -6.421 7.680 -10.216 1.00 43.04 C ATOM 1878 O GLU A 128 -6.488 6.546 -10.688 1.00 23.43 O ATOM 1879 CB GLU A 128 -8.251 8.601 -8.782 1.00 35.12 C ATOM 1880 CG GLU A 128 -9.320 7.741 -9.431 1.00 13.44 C ATOM 1881 CD GLU A 128 -10.635 8.458 -9.579 1.00 12.45 C ATOM 1882 OE1 GLU A 128 -10.834 9.138 -10.611 1.00 21.41 O ATOM 1883 OE2 GLU A 128 -11.485 8.338 -8.679 1.00 2.44 O ATOM 0 H GLU A 128 -6.293 9.716 -7.811 1.00 74.23 H new ATOM 0 HA GLU A 128 -6.909 7.018 -8.237 1.00 23.41 H new ATOM 0 HB2 GLU A 128 -8.543 8.813 -7.753 1.00 35.12 H new ATOM 0 HB3 GLU A 128 -8.201 9.557 -9.303 1.00 35.12 H new ATOM 0 HG2 GLU A 128 -8.974 7.419 -10.413 1.00 13.44 H new ATOM 0 HG3 GLU A 128 -9.467 6.841 -8.834 1.00 13.44 H new ATOM 1890 N ALA A 129 -5.979 8.722 -10.906 1.00 54.54 N ATOM 1891 CA ALA A 129 -5.507 8.600 -12.279 1.00 73.41 C ATOM 1892 C ALA A 129 -4.284 7.692 -12.393 1.00 34.53 C ATOM 1893 O ALA A 129 -4.024 7.128 -13.457 1.00 11.22 O ATOM 1894 CB ALA A 129 -5.202 9.973 -12.854 1.00 13.31 C ATOM 0 H ALA A 129 -5.937 9.670 -10.533 1.00 54.54 H new ATOM 0 HA ALA A 129 -6.307 8.136 -12.857 1.00 73.41 H new ATOM 0 HB1 ALA A 129 -4.850 9.868 -13.880 1.00 13.31 H new ATOM 0 HB2 ALA A 129 -6.106 10.582 -12.841 1.00 13.31 H new ATOM 0 HB3 ALA A 129 -4.431 10.456 -12.254 1.00 13.31 H new ATOM 1900 N ALA A 130 -3.535 7.548 -11.310 1.00 14.11 N ATOM 1901 CA ALA A 130 -2.348 6.709 -11.317 1.00 0.02 C ATOM 1902 C ALA A 130 -2.704 5.229 -11.209 1.00 2.40 C ATOM 1903 O ALA A 130 -1.908 4.365 -11.571 1.00 54.22 O ATOM 1904 CB ALA A 130 -1.411 7.104 -10.186 1.00 62.24 C ATOM 0 H ALA A 130 -3.728 8.001 -10.417 1.00 14.11 H new ATOM 0 HA ALA A 130 -1.843 6.864 -12.271 1.00 0.02 H new ATOM 0 HB1 ALA A 130 -0.528 6.466 -10.206 1.00 62.24 H new ATOM 0 HB2 ALA A 130 -1.110 8.144 -10.309 1.00 62.24 H new ATOM 0 HB3 ALA A 130 -1.923 6.985 -9.231 1.00 62.24 H new ATOM 1910 N LEU A 131 -3.914 4.947 -10.737 1.00 54.43 N ATOM 1911 CA LEU A 131 -4.352 3.569 -10.515 1.00 21.15 C ATOM 1912 C LEU A 131 -4.369 2.733 -11.813 1.00 1.21 C ATOM 1913 O LEU A 131 -3.764 1.660 -11.858 1.00 13.33 O ATOM 1914 CB LEU A 131 -5.722 3.524 -9.817 1.00 65.44 C ATOM 1915 CG LEU A 131 -5.788 4.170 -8.431 1.00 5.51 C ATOM 1916 CD1 LEU A 131 -7.203 4.107 -7.881 1.00 4.41 C ATOM 1917 CD2 LEU A 131 -4.815 3.496 -7.475 1.00 12.34 C ATOM 0 H LEU A 131 -4.611 5.653 -10.500 1.00 54.43 H new ATOM 0 HA LEU A 131 -3.614 3.114 -9.855 1.00 21.15 H new ATOM 0 HB2 LEU A 131 -6.452 4.015 -10.460 1.00 65.44 H new ATOM 0 HB3 LEU A 131 -6.027 2.482 -9.726 1.00 65.44 H new ATOM 0 HG LEU A 131 -5.501 5.217 -8.529 1.00 5.51 H new ATOM 0 HD11 LEU A 131 -7.231 4.571 -6.895 1.00 4.41 H new ATOM 0 HD12 LEU A 131 -7.878 4.639 -8.552 1.00 4.41 H new ATOM 0 HD13 LEU A 131 -7.516 3.066 -7.801 1.00 4.41 H new ATOM 0 HD21 LEU A 131 -4.879 3.971 -6.496 1.00 12.34 H new ATOM 0 HD22 LEU A 131 -5.068 2.440 -7.383 1.00 12.34 H new ATOM 0 HD23 LEU A 131 -3.800 3.594 -7.860 1.00 12.34 H new ATOM 1929 N PRO A 132 -5.055 3.202 -12.899 1.00 52.41 N ATOM 1930 CA PRO A 132 -5.106 2.466 -14.167 1.00 3.01 C ATOM 1931 C PRO A 132 -3.720 2.253 -14.774 1.00 1.34 C ATOM 1932 O PRO A 132 -3.497 1.293 -15.514 1.00 64.45 O ATOM 1933 CB PRO A 132 -5.961 3.358 -15.084 1.00 22.24 C ATOM 1934 CG PRO A 132 -5.950 4.697 -14.439 1.00 31.13 C ATOM 1935 CD PRO A 132 -5.843 4.444 -12.969 1.00 74.51 C ATOM 0 HA PRO A 132 -5.516 1.465 -14.030 1.00 3.01 H new ATOM 0 HB2 PRO A 132 -5.546 3.402 -16.091 1.00 22.24 H new ATOM 0 HB3 PRO A 132 -6.976 2.972 -15.175 1.00 22.24 H new ATOM 0 HG2 PRO A 132 -5.111 5.295 -14.794 1.00 31.13 H new ATOM 0 HG3 PRO A 132 -6.858 5.251 -14.675 1.00 31.13 H new ATOM 0 HD2 PRO A 132 -5.346 5.266 -12.454 1.00 74.51 H new ATOM 0 HD3 PRO A 132 -6.824 4.325 -12.508 1.00 74.51 H new ATOM 1943 N MET A 133 -2.784 3.136 -14.444 1.00 32.02 N ATOM 1944 CA MET A 133 -1.434 3.026 -14.966 1.00 75.23 C ATOM 1945 C MET A 133 -0.646 2.021 -14.138 1.00 23.35 C ATOM 1946 O MET A 133 0.231 1.328 -14.639 1.00 10.32 O ATOM 1947 CB MET A 133 -0.727 4.380 -14.964 1.00 64.15 C ATOM 1948 CG MET A 133 0.547 4.396 -15.796 1.00 51.14 C ATOM 1949 SD MET A 133 1.515 5.896 -15.572 1.00 23.44 S ATOM 1950 CE MET A 133 2.062 5.680 -13.883 1.00 13.21 C ATOM 0 H MET A 133 -2.937 3.929 -13.822 1.00 32.02 H new ATOM 0 HA MET A 133 -1.492 2.682 -15.999 1.00 75.23 H new ATOM 0 HB2 MET A 133 -1.410 5.139 -15.344 1.00 64.15 H new ATOM 0 HB3 MET A 133 -0.485 4.654 -13.937 1.00 64.15 H new ATOM 0 HG2 MET A 133 1.158 3.533 -15.531 1.00 51.14 H new ATOM 0 HG3 MET A 133 0.288 4.292 -16.850 1.00 51.14 H new ATOM 0 HE1 MET A 133 2.877 6.372 -13.673 1.00 13.21 H new ATOM 0 HE2 MET A 133 1.233 5.879 -13.204 1.00 13.21 H new ATOM 0 HE3 MET A 133 2.410 4.657 -13.741 1.00 13.21 H new ATOM 1960 N LEU A 134 -0.971 1.963 -12.859 1.00 34.42 N ATOM 1961 CA LEU A 134 -0.317 1.066 -11.926 1.00 13.15 C ATOM 1962 C LEU A 134 -0.807 -0.371 -12.100 1.00 43.44 C ATOM 1963 O LEU A 134 -0.011 -1.309 -12.091 1.00 11.13 O ATOM 1964 CB LEU A 134 -0.572 1.539 -10.494 1.00 65.43 C ATOM 1965 CG LEU A 134 -0.072 0.624 -9.379 1.00 74.12 C ATOM 1966 CD1 LEU A 134 1.445 0.487 -9.426 1.00 34.12 C ATOM 1967 CD2 LEU A 134 -0.523 1.151 -8.029 1.00 44.21 C ATOM 0 H LEU A 134 -1.699 2.540 -12.437 1.00 34.42 H new ATOM 0 HA LEU A 134 0.754 1.080 -12.130 1.00 13.15 H new ATOM 0 HB2 LEU A 134 -0.106 2.516 -10.369 1.00 65.43 H new ATOM 0 HB3 LEU A 134 -1.645 1.679 -10.366 1.00 65.43 H new ATOM 0 HG LEU A 134 -0.501 -0.367 -9.527 1.00 74.12 H new ATOM 0 HD11 LEU A 134 1.776 -0.170 -8.622 1.00 34.12 H new ATOM 0 HD12 LEU A 134 1.743 0.064 -10.385 1.00 34.12 H new ATOM 0 HD13 LEU A 134 1.903 1.469 -9.305 1.00 34.12 H new ATOM 0 HD21 LEU A 134 -0.161 0.491 -7.241 1.00 44.21 H new ATOM 0 HD22 LEU A 134 -0.121 2.153 -7.877 1.00 44.21 H new ATOM 0 HD23 LEU A 134 -1.612 1.189 -7.999 1.00 44.21 H new ATOM 1979 N ARG A 135 -2.119 -0.534 -12.253 1.00 11.45 N ATOM 1980 CA ARG A 135 -2.717 -1.866 -12.413 1.00 61.52 C ATOM 1981 C ARG A 135 -2.093 -2.639 -13.575 1.00 23.43 C ATOM 1982 O ARG A 135 -1.938 -3.851 -13.495 1.00 51.53 O ATOM 1983 CB ARG A 135 -4.246 -1.789 -12.568 1.00 2.13 C ATOM 1984 CG ARG A 135 -4.730 -1.217 -13.889 1.00 35.13 C ATOM 1985 CD ARG A 135 -6.246 -1.271 -13.982 1.00 11.11 C ATOM 1986 NE ARG A 135 -6.739 -0.824 -15.284 1.00 11.31 N ATOM 1987 CZ ARG A 135 -7.936 -1.146 -15.790 1.00 65.44 C ATOM 1988 NH1 ARG A 135 -8.778 -1.903 -15.091 1.00 24.11 N ATOM 1989 NH2 ARG A 135 -8.288 -0.707 -16.992 1.00 42.22 N ATOM 0 H ARG A 135 -2.790 0.234 -12.270 1.00 11.45 H new ATOM 0 HA ARG A 135 -2.500 -2.416 -11.497 1.00 61.52 H new ATOM 0 HB2 ARG A 135 -4.659 -2.791 -12.450 1.00 2.13 H new ATOM 0 HB3 ARG A 135 -4.648 -1.181 -11.757 1.00 2.13 H new ATOM 0 HG2 ARG A 135 -4.392 -0.185 -13.988 1.00 35.13 H new ATOM 0 HG3 ARG A 135 -4.291 -1.777 -14.715 1.00 35.13 H new ATOM 0 HD2 ARG A 135 -6.583 -2.291 -13.799 1.00 11.11 H new ATOM 0 HD3 ARG A 135 -6.678 -0.648 -13.199 1.00 11.11 H new ATOM 0 HE ARG A 135 -6.130 -0.227 -15.844 1.00 11.31 H new ATOM 0 HH11 ARG A 135 -8.513 -2.240 -14.166 1.00 24.11 H new ATOM 0 HH12 ARG A 135 -9.689 -2.146 -15.480 1.00 24.11 H new ATOM 0 HH21 ARG A 135 -7.647 -0.124 -17.530 1.00 42.22 H new ATOM 0 HH22 ARG A 135 -9.200 -0.952 -17.378 1.00 42.22 H new ATOM 2003 N THR A 136 -1.700 -1.937 -14.636 1.00 10.21 N ATOM 2004 CA THR A 136 -1.095 -2.607 -15.774 1.00 33.44 C ATOM 2005 C THR A 136 0.332 -3.056 -15.436 1.00 44.41 C ATOM 2006 O THR A 136 0.815 -4.054 -15.962 1.00 34.45 O ATOM 2007 CB THR A 136 -1.113 -1.731 -17.067 1.00 0.22 C ATOM 2008 OG1 THR A 136 -0.674 -2.501 -18.197 1.00 11.15 O ATOM 2009 CG2 THR A 136 -0.225 -0.509 -16.929 1.00 5.34 C ATOM 0 H THR A 136 -1.789 -0.925 -14.727 1.00 10.21 H new ATOM 0 HA THR A 136 -1.701 -3.487 -15.986 1.00 33.44 H new ATOM 0 HB THR A 136 -2.140 -1.399 -17.217 1.00 0.22 H new ATOM 0 HG1 THR A 136 -0.691 -1.941 -19.001 1.00 11.15 H new ATOM 0 HG21 THR A 136 -0.264 0.075 -17.849 1.00 5.34 H new ATOM 0 HG22 THR A 136 -0.573 0.102 -16.096 1.00 5.34 H new ATOM 0 HG23 THR A 136 0.802 -0.824 -16.743 1.00 5.34 H new ATOM 2017 N GLN A 137 0.993 -2.324 -14.532 1.00 71.45 N ATOM 2018 CA GLN A 137 2.337 -2.681 -14.093 1.00 55.41 C ATOM 2019 C GLN A 137 2.265 -3.925 -13.223 1.00 72.30 C ATOM 2020 O GLN A 137 3.045 -4.867 -13.388 1.00 72.35 O ATOM 2021 CB GLN A 137 2.971 -1.538 -13.281 1.00 61.25 C ATOM 2022 CG GLN A 137 2.871 -0.164 -13.928 1.00 11.23 C ATOM 2023 CD GLN A 137 3.577 -0.074 -15.265 1.00 41.15 C ATOM 2024 OE1 GLN A 137 4.571 -0.759 -15.509 1.00 0.21 O ATOM 2025 NE2 GLN A 137 3.071 0.774 -16.137 1.00 14.31 N ATOM 0 H GLN A 137 0.616 -1.484 -14.094 1.00 71.45 H new ATOM 0 HA GLN A 137 2.951 -2.867 -14.974 1.00 55.41 H new ATOM 0 HB2 GLN A 137 2.494 -1.499 -12.302 1.00 61.25 H new ATOM 0 HB3 GLN A 137 4.023 -1.770 -13.114 1.00 61.25 H new ATOM 0 HG2 GLN A 137 1.820 0.090 -14.063 1.00 11.23 H new ATOM 0 HG3 GLN A 137 3.294 0.579 -13.252 1.00 11.23 H new ATOM 0 HE21 GLN A 137 2.246 1.323 -15.895 1.00 14.31 H new ATOM 0 HE22 GLN A 137 3.504 0.882 -17.054 1.00 14.31 H new ATOM 2034 N LEU A 138 1.307 -3.921 -12.301 1.00 50.20 N ATOM 2035 CA LEU A 138 1.097 -5.038 -11.387 1.00 22.03 C ATOM 2036 C LEU A 138 0.640 -6.274 -12.150 1.00 51.53 C ATOM 2037 O LEU A 138 1.008 -7.400 -11.812 1.00 3.14 O ATOM 2038 CB LEU A 138 0.058 -4.669 -10.322 1.00 20.15 C ATOM 2039 CG LEU A 138 0.396 -3.455 -9.450 1.00 43.14 C ATOM 2040 CD1 LEU A 138 -0.737 -3.167 -8.478 1.00 22.34 C ATOM 2041 CD2 LEU A 138 1.701 -3.679 -8.697 1.00 72.21 C ATOM 0 H LEU A 138 0.657 -3.146 -12.167 1.00 50.20 H new ATOM 0 HA LEU A 138 2.044 -5.259 -10.895 1.00 22.03 H new ATOM 0 HB2 LEU A 138 -0.893 -4.481 -10.820 1.00 20.15 H new ATOM 0 HB3 LEU A 138 -0.088 -5.531 -9.671 1.00 20.15 H new ATOM 0 HG LEU A 138 0.522 -2.590 -10.101 1.00 43.14 H new ATOM 0 HD11 LEU A 138 -0.481 -2.302 -7.866 1.00 22.34 H new ATOM 0 HD12 LEU A 138 -1.651 -2.960 -9.035 1.00 22.34 H new ATOM 0 HD13 LEU A 138 -0.893 -4.033 -7.835 1.00 22.34 H new ATOM 0 HD21 LEU A 138 1.922 -2.805 -8.084 1.00 72.21 H new ATOM 0 HD22 LEU A 138 1.606 -4.556 -8.057 1.00 72.21 H new ATOM 0 HD23 LEU A 138 2.510 -3.836 -9.410 1.00 72.21 H new ATOM 2053 N ALA A 139 -0.149 -6.053 -13.190 1.00 52.32 N ATOM 2054 CA ALA A 139 -0.654 -7.133 -14.022 1.00 73.30 C ATOM 2055 C ALA A 139 0.491 -7.903 -14.677 1.00 21.33 C ATOM 2056 O ALA A 139 0.423 -9.118 -14.837 1.00 70.21 O ATOM 2057 CB ALA A 139 -1.602 -6.580 -15.072 1.00 34.20 C ATOM 0 H ALA A 139 -0.456 -5.124 -13.480 1.00 52.32 H new ATOM 0 HA ALA A 139 -1.201 -7.831 -13.388 1.00 73.30 H new ATOM 0 HB1 ALA A 139 -1.976 -7.396 -15.691 1.00 34.20 H new ATOM 0 HB2 ALA A 139 -2.439 -6.084 -14.581 1.00 34.20 H new ATOM 0 HB3 ALA A 139 -1.072 -5.863 -15.699 1.00 34.20 H new ATOM 2063 N GLU A 140 1.554 -7.186 -15.023 1.00 33.34 N ATOM 2064 CA GLU A 140 2.727 -7.797 -15.653 1.00 71.54 C ATOM 2065 C GLU A 140 3.584 -8.514 -14.623 1.00 12.03 C ATOM 2066 O GLU A 140 4.500 -9.255 -14.970 1.00 12.14 O ATOM 2067 CB GLU A 140 3.575 -6.753 -16.354 1.00 11.13 C ATOM 2068 CG GLU A 140 2.869 -6.001 -17.452 1.00 42.54 C ATOM 2069 CD GLU A 140 3.795 -5.041 -18.144 1.00 20.25 C ATOM 2070 OE1 GLU A 140 4.374 -4.171 -17.459 1.00 1.43 O ATOM 2071 OE2 GLU A 140 3.959 -5.149 -19.375 1.00 53.11 O ATOM 0 H GLU A 140 1.631 -6.179 -14.879 1.00 33.34 H new ATOM 0 HA GLU A 140 2.361 -8.516 -16.386 1.00 71.54 H new ATOM 0 HB2 GLU A 140 3.931 -6.037 -15.613 1.00 11.13 H new ATOM 0 HB3 GLU A 140 4.454 -7.241 -16.774 1.00 11.13 H new ATOM 0 HG2 GLU A 140 2.466 -6.707 -18.178 1.00 42.54 H new ATOM 0 HG3 GLU A 140 2.023 -5.455 -17.035 1.00 42.54 H new ATOM 2078 N SER A 141 3.290 -8.276 -13.363 1.00 14.14 N ATOM 2079 CA SER A 141 4.026 -8.885 -12.277 1.00 64.23 C ATOM 2080 C SER A 141 3.275 -10.112 -11.776 1.00 32.44 C ATOM 2081 O SER A 141 3.794 -10.899 -10.988 1.00 33.32 O ATOM 2082 CB SER A 141 4.204 -7.862 -11.147 1.00 2.10 C ATOM 2083 OG SER A 141 5.051 -8.350 -10.122 1.00 43.51 O ATOM 0 H SER A 141 2.537 -7.657 -13.063 1.00 14.14 H new ATOM 0 HA SER A 141 5.010 -9.198 -12.626 1.00 64.23 H new ATOM 0 HB2 SER A 141 4.620 -6.940 -11.554 1.00 2.10 H new ATOM 0 HB3 SER A 141 3.230 -7.613 -10.726 1.00 2.10 H new ATOM 0 HG SER A 141 5.003 -9.329 -10.096 1.00 43.51 H new ATOM 2089 N GLY A 142 2.046 -10.257 -12.237 1.00 30.32 N ATOM 2090 CA GLY A 142 1.237 -11.381 -11.841 1.00 75.10 C ATOM 2091 C GLY A 142 0.364 -11.045 -10.656 1.00 34.53 C ATOM 2092 O GLY A 142 0.126 -11.885 -9.790 1.00 55.53 O ATOM 0 H GLY A 142 1.593 -9.610 -12.883 1.00 30.32 H new ATOM 0 HA2 GLY A 142 0.612 -11.693 -12.678 1.00 75.10 H new ATOM 0 HA3 GLY A 142 1.881 -12.224 -11.592 1.00 75.10 H new ATOM 2096 N ILE A 143 -0.117 -9.817 -10.622 1.00 32.13 N ATOM 2097 CA ILE A 143 -0.961 -9.342 -9.543 1.00 72.35 C ATOM 2098 C ILE A 143 -2.188 -8.657 -10.127 1.00 52.11 C ATOM 2099 O ILE A 143 -2.070 -7.771 -10.977 1.00 2.32 O ATOM 2100 CB ILE A 143 -0.213 -8.342 -8.585 1.00 51.20 C ATOM 2101 CG1 ILE A 143 0.815 -9.066 -7.690 1.00 10.15 C ATOM 2102 CG2 ILE A 143 -1.201 -7.567 -7.719 1.00 64.52 C ATOM 2103 CD1 ILE A 143 2.134 -9.370 -8.365 1.00 34.55 C ATOM 0 H ILE A 143 0.067 -9.120 -11.343 1.00 32.13 H new ATOM 0 HA ILE A 143 -1.248 -10.209 -8.949 1.00 72.35 H new ATOM 0 HB ILE A 143 0.326 -7.639 -9.220 1.00 51.20 H new ATOM 0 HG12 ILE A 143 1.005 -8.453 -6.809 1.00 10.15 H new ATOM 0 HG13 ILE A 143 0.377 -10.001 -7.339 1.00 10.15 H new ATOM 0 HG21 ILE A 143 -0.656 -6.884 -7.067 1.00 64.52 H new ATOM 0 HG22 ILE A 143 -1.876 -6.998 -8.358 1.00 64.52 H new ATOM 0 HG23 ILE A 143 -1.778 -8.265 -7.112 1.00 64.52 H new ATOM 0 HD11 ILE A 143 2.794 -9.879 -7.662 1.00 34.55 H new ATOM 0 HD12 ILE A 143 1.961 -10.011 -9.229 1.00 34.55 H new ATOM 0 HD13 ILE A 143 2.599 -8.440 -8.691 1.00 34.55 H new ATOM 2115 N GLN A 144 -3.355 -9.071 -9.683 1.00 54.43 N ATOM 2116 CA GLN A 144 -4.584 -8.488 -10.166 1.00 64.51 C ATOM 2117 C GLN A 144 -5.141 -7.527 -9.134 1.00 61.22 C ATOM 2118 O GLN A 144 -5.671 -7.946 -8.111 1.00 44.35 O ATOM 2119 CB GLN A 144 -5.612 -9.567 -10.513 1.00 13.35 C ATOM 2120 CG GLN A 144 -5.122 -10.577 -11.538 1.00 53.55 C ATOM 2121 CD GLN A 144 -6.251 -11.364 -12.170 1.00 44.13 C ATOM 2122 OE1 GLN A 144 -6.796 -10.966 -13.202 1.00 45.11 O ATOM 2123 NE2 GLN A 144 -6.625 -12.467 -11.560 1.00 63.43 N ATOM 0 H GLN A 144 -3.477 -9.808 -8.989 1.00 54.43 H new ATOM 0 HA GLN A 144 -4.366 -7.937 -11.081 1.00 64.51 H new ATOM 0 HB2 GLN A 144 -5.892 -10.095 -9.602 1.00 13.35 H new ATOM 0 HB3 GLN A 144 -6.514 -9.087 -10.893 1.00 13.35 H new ATOM 0 HG2 GLN A 144 -4.567 -10.056 -12.318 1.00 53.55 H new ATOM 0 HG3 GLN A 144 -4.428 -11.267 -11.059 1.00 53.55 H new ATOM 0 HE21 GLN A 144 -6.150 -12.765 -10.708 1.00 63.43 H new ATOM 0 HE22 GLN A 144 -7.390 -13.025 -11.939 1.00 63.43 H new ATOM 2132 N LEU A 145 -4.970 -6.239 -9.385 1.00 42.43 N ATOM 2133 CA LEU A 145 -5.461 -5.206 -8.481 1.00 60.13 C ATOM 2134 C LEU A 145 -6.994 -5.253 -8.390 1.00 2.44 C ATOM 2135 O LEU A 145 -7.552 -5.886 -7.491 1.00 74.02 O ATOM 2136 CB LEU A 145 -4.976 -3.820 -8.949 1.00 15.31 C ATOM 2137 CG LEU A 145 -5.346 -2.630 -8.058 1.00 43.41 C ATOM 2138 CD1 LEU A 145 -4.690 -2.751 -6.694 1.00 33.13 C ATOM 2139 CD2 LEU A 145 -4.949 -1.321 -8.725 1.00 2.15 C ATOM 0 H LEU A 145 -4.492 -5.880 -10.212 1.00 42.43 H new ATOM 0 HA LEU A 145 -5.062 -5.391 -7.484 1.00 60.13 H new ATOM 0 HB2 LEU A 145 -3.890 -3.852 -9.042 1.00 15.31 H new ATOM 0 HB3 LEU A 145 -5.376 -3.637 -9.946 1.00 15.31 H new ATOM 0 HG LEU A 145 -6.427 -2.634 -7.917 1.00 43.41 H new ATOM 0 HD11 LEU A 145 -4.968 -1.895 -6.079 1.00 33.13 H new ATOM 0 HD12 LEU A 145 -5.024 -3.669 -6.210 1.00 33.13 H new ATOM 0 HD13 LEU A 145 -3.607 -2.777 -6.812 1.00 33.13 H new ATOM 0 HD21 LEU A 145 -5.219 -0.486 -8.078 1.00 2.15 H new ATOM 0 HD22 LEU A 145 -3.873 -1.312 -8.898 1.00 2.15 H new ATOM 0 HD23 LEU A 145 -5.470 -1.225 -9.678 1.00 2.15 H new ATOM 2151 N GLY A 146 -7.662 -4.609 -9.335 1.00 63.35 N ATOM 2152 CA GLY A 146 -9.114 -4.607 -9.362 1.00 14.10 C ATOM 2153 C GLY A 146 -9.725 -3.742 -8.276 1.00 61.44 C ATOM 2154 O GLY A 146 -10.334 -2.709 -8.561 1.00 53.10 O ATOM 0 H GLY A 146 -7.222 -4.083 -10.090 1.00 63.35 H new ATOM 0 HA2 GLY A 146 -9.453 -4.253 -10.335 1.00 14.10 H new ATOM 0 HA3 GLY A 146 -9.476 -5.629 -9.251 1.00 14.10 H new ATOM 2158 N GLN A 147 -9.552 -4.156 -7.038 1.00 12.42 N ATOM 2159 CA GLN A 147 -10.109 -3.447 -5.910 1.00 52.44 C ATOM 2160 C GLN A 147 -9.113 -2.429 -5.365 1.00 4.45 C ATOM 2161 O GLN A 147 -7.929 -2.723 -5.194 1.00 43.55 O ATOM 2162 CB GLN A 147 -10.527 -4.438 -4.813 1.00 32.43 C ATOM 2163 CG GLN A 147 -11.171 -3.799 -3.582 1.00 64.54 C ATOM 2164 CD GLN A 147 -12.485 -3.083 -3.882 1.00 65.45 C ATOM 2165 OE1 GLN A 147 -12.690 -2.543 -4.970 1.00 20.12 O ATOM 2166 NE2 GLN A 147 -13.378 -3.071 -2.914 1.00 61.21 N ATOM 0 H GLN A 147 -9.023 -4.991 -6.788 1.00 12.42 H new ATOM 0 HA GLN A 147 -10.994 -2.906 -6.245 1.00 52.44 H new ATOM 0 HB2 GLN A 147 -11.227 -5.157 -5.240 1.00 32.43 H new ATOM 0 HB3 GLN A 147 -9.648 -4.999 -4.496 1.00 32.43 H new ATOM 0 HG2 GLN A 147 -11.350 -4.571 -2.834 1.00 64.54 H new ATOM 0 HG3 GLN A 147 -10.471 -3.087 -3.144 1.00 64.54 H new ATOM 0 HE21 GLN A 147 -13.174 -3.529 -2.026 1.00 61.21 H new ATOM 0 HE22 GLN A 147 -14.274 -2.604 -3.053 1.00 61.21 H new ATOM 2175 N SER A 148 -9.595 -1.236 -5.115 1.00 43.10 N ATOM 2176 CA SER A 148 -8.778 -0.167 -4.587 1.00 72.53 C ATOM 2177 C SER A 148 -9.600 0.634 -3.591 1.00 32.22 C ATOM 2178 O SER A 148 -10.804 0.812 -3.784 1.00 4.23 O ATOM 2179 CB SER A 148 -8.297 0.732 -5.732 1.00 3.30 C ATOM 2180 OG SER A 148 -7.671 -0.040 -6.752 1.00 54.12 O ATOM 0 H SER A 148 -10.569 -0.977 -5.272 1.00 43.10 H new ATOM 0 HA SER A 148 -7.904 -0.579 -4.083 1.00 72.53 H new ATOM 0 HB2 SER A 148 -9.142 1.279 -6.150 1.00 3.30 H new ATOM 0 HB3 SER A 148 -7.596 1.473 -5.349 1.00 3.30 H new ATOM 0 HG SER A 148 -7.373 0.552 -7.474 1.00 54.12 H new ATOM 2186 N SER A 149 -8.973 1.103 -2.531 1.00 70.24 N ATOM 2187 CA SER A 149 -9.686 1.852 -1.517 1.00 15.23 C ATOM 2188 C SER A 149 -8.922 3.110 -1.137 1.00 1.04 C ATOM 2189 O SER A 149 -7.719 3.065 -0.885 1.00 72.03 O ATOM 2190 CB SER A 149 -9.907 0.971 -0.286 1.00 14.42 C ATOM 2191 OG SER A 149 -10.515 -0.262 -0.650 1.00 53.23 O ATOM 0 H SER A 149 -7.977 0.980 -2.350 1.00 70.24 H new ATOM 0 HA SER A 149 -10.653 2.154 -1.920 1.00 15.23 H new ATOM 0 HB2 SER A 149 -8.953 0.780 0.206 1.00 14.42 H new ATOM 0 HB3 SER A 149 -10.537 1.494 0.433 1.00 14.42 H new ATOM 0 HG SER A 149 -11.065 -0.588 0.093 1.00 53.23 H new ATOM 2197 N ILE A 150 -9.623 4.227 -1.110 1.00 40.11 N ATOM 2198 CA ILE A 150 -9.024 5.502 -0.773 1.00 13.02 C ATOM 2199 C ILE A 150 -9.868 6.207 0.277 1.00 70.21 C ATOM 2200 O ILE A 150 -10.938 6.737 -0.029 1.00 21.05 O ATOM 2201 CB ILE A 150 -8.891 6.427 -2.013 1.00 63.15 C ATOM 2202 CG1 ILE A 150 -8.117 5.724 -3.137 1.00 60.24 C ATOM 2203 CG2 ILE A 150 -8.201 7.736 -1.630 1.00 73.23 C ATOM 2204 CD1 ILE A 150 -8.062 6.514 -4.428 1.00 34.00 C ATOM 0 H ILE A 150 -10.620 4.276 -1.320 1.00 40.11 H new ATOM 0 HA ILE A 150 -8.025 5.299 -0.387 1.00 13.02 H new ATOM 0 HB ILE A 150 -9.893 6.654 -2.378 1.00 63.15 H new ATOM 0 HG12 ILE A 150 -7.100 5.529 -2.798 1.00 60.24 H new ATOM 0 HG13 ILE A 150 -8.579 4.756 -3.333 1.00 60.24 H new ATOM 0 HG21 ILE A 150 -8.115 8.373 -2.510 1.00 73.23 H new ATOM 0 HG22 ILE A 150 -8.788 8.247 -0.867 1.00 73.23 H new ATOM 0 HG23 ILE A 150 -7.206 7.522 -1.239 1.00 73.23 H new ATOM 0 HD11 ILE A 150 -7.499 5.953 -5.174 1.00 34.00 H new ATOM 0 HD12 ILE A 150 -9.075 6.687 -4.792 1.00 34.00 H new ATOM 0 HD13 ILE A 150 -7.573 7.471 -4.248 1.00 34.00 H new ATOM 2216 N SER A 151 -9.403 6.190 1.502 1.00 1.01 N ATOM 2217 CA SER A 151 -10.103 6.836 2.586 1.00 14.20 C ATOM 2218 C SER A 151 -9.469 8.193 2.853 1.00 41.31 C ATOM 2219 O SER A 151 -8.320 8.428 2.478 1.00 14.11 O ATOM 2220 CB SER A 151 -10.052 5.959 3.845 1.00 5.52 C ATOM 2221 OG SER A 151 -10.839 6.508 4.894 1.00 61.43 O ATOM 0 H SER A 151 -8.534 5.731 1.775 1.00 1.01 H new ATOM 0 HA SER A 151 -11.149 6.978 2.313 1.00 14.20 H new ATOM 0 HB2 SER A 151 -10.409 4.957 3.607 1.00 5.52 H new ATOM 0 HB3 SER A 151 -9.019 5.858 4.178 1.00 5.52 H new ATOM 0 HG SER A 151 -10.787 5.926 5.681 1.00 61.43 H new ATOM 2227 N SER A 152 -10.206 9.081 3.490 1.00 5.11 N ATOM 2228 CA SER A 152 -9.697 10.405 3.787 1.00 34.22 C ATOM 2229 C SER A 152 -8.876 10.389 5.074 1.00 24.25 C ATOM 2230 O SER A 152 -7.859 11.083 5.187 1.00 42.31 O ATOM 2231 CB SER A 152 -10.851 11.401 3.896 1.00 61.34 C ATOM 2232 OG SER A 152 -11.666 11.360 2.729 1.00 31.52 O ATOM 0 H SER A 152 -11.159 8.910 3.812 1.00 5.11 H new ATOM 0 HA SER A 152 -9.044 10.718 2.972 1.00 34.22 H new ATOM 0 HB2 SER A 152 -11.454 11.171 4.774 1.00 61.34 H new ATOM 0 HB3 SER A 152 -10.457 12.408 4.035 1.00 61.34 H new ATOM 0 HG SER A 152 -11.698 12.250 2.321 1.00 31.52 H new ATOM 2238 N GLU A 153 -9.314 9.584 6.037 1.00 13.42 N ATOM 2239 CA GLU A 153 -8.620 9.459 7.309 1.00 22.55 C ATOM 2240 C GLU A 153 -9.038 8.193 8.051 1.00 4.22 C ATOM 2241 O GLU A 153 -8.194 7.462 8.574 1.00 21.32 O ATOM 2242 CB GLU A 153 -8.838 10.707 8.181 1.00 12.12 C ATOM 2243 CG GLU A 153 -10.286 11.150 8.290 1.00 71.34 C ATOM 2244 CD GLU A 153 -10.439 12.411 9.100 1.00 30.11 C ATOM 2245 OE1 GLU A 153 -9.980 13.479 8.636 1.00 20.23 O ATOM 2246 OE2 GLU A 153 -11.027 12.352 10.198 1.00 64.32 O ATOM 0 H GLU A 153 -10.151 9.007 5.957 1.00 13.42 H new ATOM 0 HA GLU A 153 -7.554 9.378 7.096 1.00 22.55 H new ATOM 0 HB2 GLU A 153 -8.455 10.507 9.182 1.00 12.12 H new ATOM 0 HB3 GLU A 153 -8.249 11.528 7.773 1.00 12.12 H new ATOM 0 HG2 GLU A 153 -10.690 11.311 7.291 1.00 71.34 H new ATOM 0 HG3 GLU A 153 -10.874 10.354 8.747 1.00 71.34 H new ATOM 2284 N ALA A 156 -15.311 4.148 8.747 1.00 20.51 N ATOM 2285 CA ALA A 156 -16.079 3.415 9.734 1.00 33.21 C ATOM 2286 C ALA A 156 -17.032 2.433 9.065 1.00 10.21 C ATOM 2287 O ALA A 156 -17.558 2.700 7.982 1.00 73.50 O ATOM 2288 CB ALA A 156 -16.847 4.374 10.629 1.00 33.43 C ATOM 0 HA ALA A 156 -15.383 2.845 10.349 1.00 33.21 H new ATOM 0 HB1 ALA A 156 -17.418 3.807 11.364 1.00 33.43 H new ATOM 0 HB2 ALA A 156 -16.146 5.032 11.143 1.00 33.43 H new ATOM 0 HB3 ALA A 156 -17.528 4.971 10.023 1.00 33.43 H new ATOM 2294 N GLY A 157 -17.242 1.301 9.706 1.00 10.21 N ATOM 2295 CA GLY A 157 -18.143 0.304 9.179 1.00 60.54 C ATOM 2296 C GLY A 157 -18.894 -0.392 10.285 1.00 11.45 C ATOM 2297 O GLY A 157 -18.419 -0.439 11.424 1.00 53.04 O ATOM 0 H GLY A 157 -16.800 1.052 10.591 1.00 10.21 H new ATOM 0 HA2 GLY A 157 -18.850 0.774 8.496 1.00 60.54 H new ATOM 0 HA3 GLY A 157 -17.580 -0.429 8.601 1.00 60.54 H new ATOM 2301 N GLN A 158 -20.058 -0.928 9.975 1.00 61.23 N ATOM 2302 CA GLN A 158 -20.862 -1.606 10.976 1.00 13.42 C ATOM 2303 C GLN A 158 -21.863 -2.549 10.331 1.00 13.33 C ATOM 2304 O GLN A 158 -22.484 -2.222 9.316 1.00 5.43 O ATOM 2305 CB GLN A 158 -21.585 -0.591 11.874 1.00 23.41 C ATOM 2306 CG GLN A 158 -22.513 0.357 11.131 1.00 60.14 C ATOM 2307 CD GLN A 158 -23.186 1.347 12.056 1.00 2.22 C ATOM 2308 OE1 GLN A 158 -24.263 1.084 12.585 1.00 73.14 O ATOM 2309 NE2 GLN A 158 -22.563 2.488 12.252 1.00 55.30 N ATOM 0 H GLN A 158 -20.468 -0.908 9.041 1.00 61.23 H new ATOM 0 HA GLN A 158 -20.189 -2.199 11.595 1.00 13.42 H new ATOM 0 HB2 GLN A 158 -22.163 -1.133 12.622 1.00 23.41 H new ATOM 0 HB3 GLN A 158 -20.840 -0.004 12.411 1.00 23.41 H new ATOM 0 HG2 GLN A 158 -21.945 0.899 10.375 1.00 60.14 H new ATOM 0 HG3 GLN A 158 -23.274 -0.221 10.606 1.00 60.14 H new ATOM 0 HE21 GLN A 158 -21.670 2.667 11.793 1.00 55.30 H new ATOM 0 HE22 GLN A 158 -22.973 3.195 12.863 1.00 55.30 H new ATOM 2318 N GLN A 159 -22.007 -3.713 10.923 1.00 74.01 N ATOM 2319 CA GLN A 159 -22.923 -4.728 10.445 1.00 4.32 C ATOM 2320 C GLN A 159 -23.217 -5.720 11.566 1.00 33.31 C ATOM 2321 O GLN A 159 -22.320 -6.397 12.067 1.00 42.33 O ATOM 2322 CB GLN A 159 -22.354 -5.437 9.203 1.00 54.11 C ATOM 2323 CG GLN A 159 -20.967 -6.035 9.395 1.00 32.44 C ATOM 2324 CD GLN A 159 -20.410 -6.631 8.122 1.00 72.44 C ATOM 2325 OE1 GLN A 159 -20.701 -6.165 7.017 1.00 11.33 O ATOM 2326 NE2 GLN A 159 -19.624 -7.676 8.261 1.00 22.24 N ATOM 0 H GLN A 159 -21.488 -3.986 11.757 1.00 74.01 H new ATOM 0 HA GLN A 159 -23.858 -4.254 10.147 1.00 4.32 H new ATOM 0 HB2 GLN A 159 -23.040 -6.231 8.908 1.00 54.11 H new ATOM 0 HB3 GLN A 159 -22.317 -4.725 8.379 1.00 54.11 H new ATOM 0 HG2 GLN A 159 -20.289 -5.262 9.757 1.00 32.44 H new ATOM 0 HG3 GLN A 159 -21.011 -6.806 10.164 1.00 32.44 H new ATOM 0 HE21 GLN A 159 -19.407 -8.031 9.192 1.00 22.24 H new ATOM 0 HE22 GLN A 159 -19.231 -8.132 7.437 1.00 22.24 H new ATOM 2335 N GLN A 160 -24.465 -5.777 11.975 1.00 54.44 N ATOM 2336 CA GLN A 160 -24.863 -6.623 13.086 1.00 61.15 C ATOM 2337 C GLN A 160 -25.233 -8.033 12.639 1.00 40.41 C ATOM 2338 O GLN A 160 -25.508 -8.284 11.458 1.00 52.24 O ATOM 2339 CB GLN A 160 -26.022 -5.987 13.856 1.00 41.32 C ATOM 2340 CG GLN A 160 -27.235 -5.657 13.001 1.00 53.34 C ATOM 2341 CD GLN A 160 -28.367 -5.059 13.809 1.00 10.53 C ATOM 2342 OE1 GLN A 160 -28.440 -3.844 13.994 1.00 3.43 O ATOM 2343 NE2 GLN A 160 -29.257 -5.902 14.291 1.00 14.11 N ATOM 0 H GLN A 160 -25.228 -5.246 11.555 1.00 54.44 H new ATOM 0 HA GLN A 160 -24.000 -6.710 13.746 1.00 61.15 H new ATOM 0 HB2 GLN A 160 -26.328 -6.664 14.654 1.00 41.32 H new ATOM 0 HB3 GLN A 160 -25.668 -5.073 14.332 1.00 41.32 H new ATOM 0 HG2 GLN A 160 -26.944 -4.958 12.217 1.00 53.34 H new ATOM 0 HG3 GLN A 160 -27.585 -6.563 12.507 1.00 53.34 H new ATOM 0 HE21 GLN A 160 -29.160 -6.902 14.115 1.00 14.11 H new ATOM 0 HE22 GLN A 160 -30.043 -5.555 14.840 1.00 14.11 H new ATOM 2352 N SER A 161 -25.237 -8.942 13.594 1.00 24.21 N ATOM 2353 CA SER A 161 -25.584 -10.324 13.366 1.00 72.53 C ATOM 2354 C SER A 161 -26.309 -10.856 14.598 1.00 65.44 C ATOM 2355 O SER A 161 -26.172 -10.296 15.687 1.00 2.42 O ATOM 2356 CB SER A 161 -24.316 -11.148 13.090 1.00 1.24 C ATOM 2357 OG SER A 161 -24.631 -12.482 12.709 1.00 74.31 O ATOM 0 H SER A 161 -24.995 -8.735 14.563 1.00 24.21 H new ATOM 0 HA SER A 161 -26.236 -10.405 12.497 1.00 72.53 H new ATOM 0 HB2 SER A 161 -23.736 -10.671 12.300 1.00 1.24 H new ATOM 0 HB3 SER A 161 -23.689 -11.162 13.982 1.00 1.24 H new ATOM 0 HG SER A 161 -23.803 -12.978 12.539 1.00 74.31 H new ATOM 2363 N SER A 162 -27.067 -11.923 14.435 1.00 22.11 N ATOM 2364 CA SER A 162 -27.815 -12.500 15.539 1.00 53.31 C ATOM 2365 C SER A 162 -28.305 -13.888 15.173 1.00 61.04 C ATOM 2366 O SER A 162 -28.585 -14.174 14.004 1.00 60.10 O ATOM 2367 CB SER A 162 -29.010 -11.602 15.902 1.00 50.42 C ATOM 2368 OG SER A 162 -29.693 -12.079 17.055 1.00 4.32 O ATOM 0 H SER A 162 -27.182 -12.410 13.546 1.00 22.11 H new ATOM 0 HA SER A 162 -27.154 -12.574 16.403 1.00 53.31 H new ATOM 0 HB2 SER A 162 -28.661 -10.585 16.080 1.00 50.42 H new ATOM 0 HB3 SER A 162 -29.702 -11.558 15.061 1.00 50.42 H new ATOM 0 HG SER A 162 -30.445 -11.485 17.259 1.00 4.32 H new ATOM 2374 N SER A 163 -28.396 -14.744 16.166 1.00 32.31 N ATOM 2375 CA SER A 163 -28.842 -16.103 15.970 1.00 12.02 C ATOM 2376 C SER A 163 -30.048 -16.397 16.862 1.00 25.23 C ATOM 2377 O SER A 163 -30.568 -15.497 17.531 1.00 51.01 O ATOM 2378 CB SER A 163 -27.700 -17.067 16.284 1.00 1.14 C ATOM 2379 OG SER A 163 -26.531 -16.722 15.552 1.00 44.03 O ATOM 0 H SER A 163 -28.162 -14.516 17.132 1.00 32.31 H new ATOM 0 HA SER A 163 -29.143 -16.235 14.931 1.00 12.02 H new ATOM 0 HB2 SER A 163 -27.485 -17.047 17.352 1.00 1.14 H new ATOM 0 HB3 SER A 163 -28.000 -18.086 16.039 1.00 1.14 H new ATOM 0 HG SER A 163 -25.812 -17.351 15.769 1.00 44.03 H new ATOM 2385 N GLN A 164 -30.474 -17.645 16.883 1.00 53.23 N ATOM 2386 CA GLN A 164 -31.620 -18.056 17.677 1.00 21.53 C ATOM 2387 C GLN A 164 -31.487 -19.526 18.058 1.00 54.45 C ATOM 2388 O GLN A 164 -31.031 -20.344 17.258 1.00 33.11 O ATOM 2389 CB GLN A 164 -32.911 -17.822 16.882 1.00 60.44 C ATOM 2390 CG GLN A 164 -34.174 -18.306 17.574 1.00 12.22 C ATOM 2391 CD GLN A 164 -35.430 -18.030 16.768 1.00 10.02 C ATOM 2392 OE1 GLN A 164 -35.433 -16.937 16.026 1.00 34.11 O flip ATOM 2393 NE2 GLN A 164 -36.395 -18.792 16.818 1.00 55.21 N flip ATOM 0 H GLN A 164 -30.039 -18.401 16.354 1.00 53.23 H new ATOM 0 HA GLN A 164 -31.658 -17.463 18.591 1.00 21.53 H new ATOM 0 HB2 GLN A 164 -33.009 -16.756 16.679 1.00 60.44 H new ATOM 0 HB3 GLN A 164 -32.825 -18.324 15.918 1.00 60.44 H new ATOM 0 HG2 GLN A 164 -34.094 -19.377 17.758 1.00 12.22 H new ATOM 0 HG3 GLN A 164 -34.258 -17.821 18.547 1.00 12.22 H new ATOM 0 HE21 GLN A 164 -36.356 -19.627 17.403 1.00 55.21 H new ATOM 0 HE22 GLN A 164 -37.234 -18.589 16.275 1.00 55.21 H new ATOM 2402 N GLN A 165 -31.858 -19.848 19.285 1.00 15.21 N ATOM 2403 CA GLN A 165 -31.763 -21.212 19.791 1.00 32.33 C ATOM 2404 C GLN A 165 -32.911 -22.076 19.299 1.00 23.22 C ATOM 2405 O GLN A 165 -33.924 -21.574 18.806 1.00 5.55 O ATOM 2406 CB GLN A 165 -31.765 -21.224 21.315 1.00 64.54 C ATOM 2407 CG GLN A 165 -30.613 -20.485 21.956 1.00 62.54 C ATOM 2408 CD GLN A 165 -30.641 -20.590 23.466 1.00 35.14 C ATOM 2409 OE1 GLN A 165 -31.113 -21.585 24.023 1.00 65.43 O ATOM 2410 NE2 GLN A 165 -30.137 -19.575 24.139 1.00 11.01 N ATOM 0 H GLN A 165 -32.232 -19.178 19.957 1.00 15.21 H new ATOM 0 HA GLN A 165 -30.825 -21.621 19.416 1.00 32.33 H new ATOM 0 HB2 GLN A 165 -32.699 -20.787 21.667 1.00 64.54 H new ATOM 0 HB3 GLN A 165 -31.749 -22.259 21.656 1.00 64.54 H new ATOM 0 HG2 GLN A 165 -29.671 -20.887 21.582 1.00 62.54 H new ATOM 0 HG3 GLN A 165 -30.649 -19.435 21.665 1.00 62.54 H new ATOM 0 HE21 GLN A 165 -29.756 -18.771 23.640 1.00 11.01 H new ATOM 0 HE22 GLN A 165 -30.128 -19.594 25.159 1.00 11.01 H new ATOM 2419 N GLN A 166 -32.743 -23.375 19.449 1.00 31.01 N ATOM 2420 CA GLN A 166 -33.774 -24.336 19.111 1.00 15.11 C ATOM 2421 C GLN A 166 -34.769 -24.451 20.265 1.00 1.03 C ATOM 2422 O GLN A 166 -34.678 -23.703 21.246 1.00 32.43 O ATOM 2423 CB GLN A 166 -33.141 -25.699 18.818 1.00 24.21 C ATOM 2424 CG GLN A 166 -32.244 -26.214 19.934 1.00 70.44 C ATOM 2425 CD GLN A 166 -31.573 -27.521 19.579 1.00 23.34 C ATOM 2426 OE1 GLN A 166 -32.097 -28.595 19.854 1.00 24.10 O ATOM 2427 NE2 GLN A 166 -30.413 -27.440 18.961 1.00 43.43 N ATOM 0 H GLN A 166 -31.886 -23.795 19.809 1.00 31.01 H new ATOM 0 HA GLN A 166 -34.303 -23.998 18.220 1.00 15.11 H new ATOM 0 HB2 GLN A 166 -33.933 -26.425 18.637 1.00 24.21 H new ATOM 0 HB3 GLN A 166 -32.558 -25.628 17.900 1.00 24.21 H new ATOM 0 HG2 GLN A 166 -31.482 -25.467 20.158 1.00 70.44 H new ATOM 0 HG3 GLN A 166 -32.836 -26.347 20.840 1.00 70.44 H new ATOM 0 HE21 GLN A 166 -30.010 -26.527 18.750 1.00 43.43 H new ATOM 0 HE22 GLN A 166 -29.917 -28.290 18.693 1.00 43.43 H new ATOM 2436 N SER A 167 -35.693 -25.390 20.163 1.00 64.01 N ATOM 2437 CA SER A 167 -36.697 -25.572 21.191 1.00 14.23 C ATOM 2438 C SER A 167 -37.394 -26.923 21.012 1.00 71.15 C ATOM 2439 O SER A 167 -36.929 -27.777 20.244 1.00 31.15 O ATOM 2440 CB SER A 167 -37.722 -24.419 21.139 1.00 55.55 C ATOM 2441 OG SER A 167 -38.594 -24.448 22.261 1.00 32.32 O ATOM 0 H SER A 167 -35.767 -26.037 19.378 1.00 64.01 H new ATOM 0 HA SER A 167 -36.213 -25.561 22.168 1.00 14.23 H new ATOM 0 HB2 SER A 167 -37.197 -23.464 21.109 1.00 55.55 H new ATOM 0 HB3 SER A 167 -38.306 -24.490 20.221 1.00 55.55 H new ATOM 0 HG SER A 167 -39.230 -23.705 22.200 1.00 32.32 H new