USER MOD reduce.3.24.130724 H: found=0, std=0, add=1077, rem=0, adj=31 USER MOD reduce.3.24.130724 removed 1078 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 56 LYS NZ :NH3+ -125:sc= -0.51! (180deg=-3.96!) USER MOD Set 1.2: A 126 ASN : amide:sc= 0.418 K(o=-0.092,f=-9.3!) USER MOD Set 2.1: A 46 SER OG : rot 180:sc= 0 USER MOD Set 2.2: A 50 ASN : amide:sc= -0.0565 X(o=-0.056,f=-0.37) USER MOD Single : A 5 LYS NZ :NH3+ 177:sc= 0 (180deg=-0.0057) USER MOD Single : A 11 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 13 LYS NZ :NH3+ -176:sc= 0.133 (180deg=0.0379) USER MOD Single : A 17 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 18 THR OG1 : rot 71:sc= 0.328 USER MOD Single : A 21 SER OG : rot 78:sc= 0.444 USER MOD Single : A 24 TYR OH : rot -69:sc= 1.13 USER MOD Single : A 26 GLN : amide:sc= -1.48 K(o=-1.5,f=-2.6!) USER MOD Single : A 35 TYR OH : rot 180:sc= 0 USER MOD Single : A 38 GLN : amide:sc= -0.686 K(o=-0.69,f=-1.8!) USER MOD Single : A 39 ASN : amide:sc= -0.0755 K(o=-0.075,f=-0.6) USER MOD Single : A 42 SER OG : rot 180:sc= 0 USER MOD Single : A 47 LYS NZ :NH3+ -171:sc=-0.00895 (180deg=-0.111) USER MOD Single : A 54 THR OG1 : rot -110:sc= -0.293 USER MOD Single : A 64 TYR OH : rot 180:sc=-0.00362 USER MOD Single : A 65 SER OG : rot -170:sc= 0 USER MOD Single : A 66 ASN : amide:sc= -0.013 X(o=-0.013,f=-0.013) USER MOD Single : A 68 TYR OH : rot 49:sc= 0 USER MOD Single : A 70 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 73 TYR OH : rot 180:sc= 0 USER MOD Single : A 74 THR OG1 : rot 67:sc= 0.624 USER MOD Single : A 76 TYR OH : rot 180:sc= 0 USER MOD Single : A 78 ASN : amide:sc= -0.136 K(o=-0.14,f=-2.5!) USER MOD Single : A 79 THR OG1 : rot 180:sc= 0 USER MOD Single : A 80 LYS NZ :NH3+ -172:sc= 0.776 (180deg=0.727) USER MOD Single : A 86 THR OG1 : rot 65:sc= 0.52 USER MOD Single : A 87 LYS NZ :NH3+ -148:sc= -0.413 (180deg=-1.76!) USER MOD Single : A 88 HIS : no HE2:sc= -0.172 K(o=-0.17,f=-2.6) USER MOD Single : A 97 GLN : amide:sc= -0.0284 X(o=-0.028,f=-0.23) USER MOD Single : A 102 LYS NZ :NH3+ -174:sc= -0.0008 (180deg=-0.0574) USER MOD Single : A 103 TYR OH : rot 180:sc= 0 USER MOD Single : A 104 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 105 GLN :FLIP amide:sc= -0.0369 F(o=-1.6!,f=-0.037) USER MOD Single : A 109 THR OG1 : rot -76:sc= 0.88 USER MOD Single : A 110 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 117 ASN : amide:sc= 0.28 X(o=0.28,f=-0.013) USER MOD Single : A 121 ASN :FLIP amide:sc= -0.105 F(o=-2.5!,f=-0.11) USER MOD Single : A 122 SER OG : rot 180:sc= 0 USER MOD Single : A 123 GLN : amide:sc= 0.041 X(o=0.041,f=-0.34) USER MOD Single : A 125 TYR OH : rot -104:sc= 0.0195 USER MOD Single : A 133 THR OG1 : rot 110:sc= -0.485 USER MOD Single : A 136 TYR OH : rot 16:sc= 0.604 USER MOD ----------------------------------------------------------------- ATOM 42 N VAL A 3 12.954 5.303 -7.200 1.00 11.42 N ATOM 43 CA VAL A 3 11.712 5.360 -7.992 1.00 65.20 C ATOM 44 C VAL A 3 11.841 4.404 -9.213 1.00 54.53 C ATOM 45 O VAL A 3 12.553 4.681 -10.185 1.00 11.12 O ATOM 46 CB VAL A 3 11.414 6.864 -8.397 1.00 24.25 C ATOM 47 CG1 VAL A 3 12.599 7.523 -9.146 1.00 5.50 C ATOM 48 CG2 VAL A 3 10.091 7.006 -9.181 1.00 75.42 C ATOM 0 HA VAL A 3 10.857 5.018 -7.409 1.00 65.20 H new ATOM 0 HB VAL A 3 11.292 7.411 -7.462 1.00 24.25 H new ATOM 0 HG11 VAL A 3 12.342 8.551 -9.400 1.00 5.50 H new ATOM 0 HG12 VAL A 3 13.482 7.517 -8.507 1.00 5.50 H new ATOM 0 HG13 VAL A 3 12.808 6.965 -10.059 1.00 5.50 H new ATOM 0 HG21 VAL A 3 9.930 8.053 -9.436 1.00 75.42 H new ATOM 0 HG22 VAL A 3 10.144 6.414 -10.095 1.00 75.42 H new ATOM 0 HG23 VAL A 3 9.264 6.651 -8.566 1.00 75.42 H new ATOM 58 N PHE A 4 11.178 3.232 -9.124 1.00 10.33 N ATOM 59 CA PHE A 4 11.381 2.101 -10.070 1.00 55.44 C ATOM 60 C PHE A 4 10.174 1.921 -11.029 1.00 34.43 C ATOM 61 O PHE A 4 9.115 1.433 -10.615 1.00 4.13 O ATOM 62 CB PHE A 4 11.613 0.789 -9.270 1.00 60.41 C ATOM 63 CG PHE A 4 12.811 0.820 -8.310 1.00 73.31 C ATOM 64 CD1 PHE A 4 12.710 1.435 -7.058 1.00 1.21 C ATOM 65 CD2 PHE A 4 14.032 0.244 -8.661 1.00 3.43 C ATOM 66 CE1 PHE A 4 13.789 1.468 -6.194 1.00 3.44 C ATOM 67 CE2 PHE A 4 15.109 0.278 -7.791 1.00 4.12 C ATOM 68 CZ PHE A 4 14.989 0.894 -6.561 1.00 52.43 C ATOM 0 H PHE A 4 10.488 3.038 -8.399 1.00 10.33 H new ATOM 0 HA PHE A 4 12.256 2.330 -10.679 1.00 55.44 H new ATOM 0 HB2 PHE A 4 10.713 0.566 -8.697 1.00 60.41 H new ATOM 0 HB3 PHE A 4 11.753 -0.030 -9.976 1.00 60.41 H new ATOM 0 HD1 PHE A 4 11.776 1.890 -6.762 1.00 1.21 H new ATOM 0 HD2 PHE A 4 14.139 -0.234 -9.623 1.00 3.43 H new ATOM 0 HE1 PHE A 4 13.692 1.944 -5.229 1.00 3.44 H new ATOM 0 HE2 PHE A 4 16.045 -0.179 -8.075 1.00 4.12 H new ATOM 0 HZ PHE A 4 15.833 0.926 -5.888 1.00 52.43 H new ATOM 78 N LYS A 5 10.339 2.324 -12.307 1.00 71.13 N ATOM 79 CA LYS A 5 9.307 2.126 -13.363 1.00 51.52 C ATOM 80 C LYS A 5 9.565 0.829 -14.170 1.00 52.42 C ATOM 81 O LYS A 5 10.578 0.712 -14.873 1.00 35.43 O ATOM 82 CB LYS A 5 9.224 3.349 -14.331 1.00 3.01 C ATOM 83 CG LYS A 5 10.569 3.783 -14.979 1.00 23.04 C ATOM 84 CD LYS A 5 10.387 4.658 -16.249 1.00 54.02 C ATOM 85 CE LYS A 5 9.445 5.856 -16.038 1.00 52.32 C ATOM 86 NZ LYS A 5 9.889 6.748 -14.930 1.00 71.25 N ATOM 0 H LYS A 5 11.182 2.792 -12.640 1.00 71.13 H new ATOM 0 HA LYS A 5 8.350 2.033 -12.850 1.00 51.52 H new ATOM 0 HB2 LYS A 5 8.517 3.113 -15.126 1.00 3.01 H new ATOM 0 HB3 LYS A 5 8.815 4.197 -13.782 1.00 3.01 H new ATOM 0 HG2 LYS A 5 11.155 4.337 -14.246 1.00 23.04 H new ATOM 0 HG3 LYS A 5 11.143 2.893 -15.239 1.00 23.04 H new ATOM 0 HD2 LYS A 5 11.362 5.024 -16.571 1.00 54.02 H new ATOM 0 HD3 LYS A 5 9.997 4.037 -17.056 1.00 54.02 H new ATOM 0 HE2 LYS A 5 9.385 6.432 -16.961 1.00 52.32 H new ATOM 0 HE3 LYS A 5 8.441 5.490 -15.824 1.00 52.32 H new ATOM 0 HZ1 LYS A 5 9.248 7.565 -14.864 1.00 71.25 H new ATOM 0 HZ2 LYS A 5 9.873 6.222 -14.033 1.00 71.25 H new ATOM 0 HZ3 LYS A 5 10.856 7.081 -15.119 1.00 71.25 H new ATOM 100 N ARG A 6 8.685 -0.176 -14.003 1.00 42.01 N ATOM 101 CA ARG A 6 8.698 -1.364 -14.893 1.00 53.23 C ATOM 102 C ARG A 6 8.404 -0.961 -16.355 1.00 24.43 C ATOM 103 O ARG A 6 7.475 -0.196 -16.634 1.00 42.23 O ATOM 104 CB ARG A 6 7.711 -2.479 -14.450 1.00 74.14 C ATOM 105 CG ARG A 6 6.209 -2.125 -14.550 1.00 3.30 C ATOM 106 CD ARG A 6 5.305 -3.369 -14.577 1.00 22.14 C ATOM 107 NE ARG A 6 5.534 -4.207 -15.774 1.00 44.21 N ATOM 108 CZ ARG A 6 4.889 -4.095 -16.923 1.00 25.51 C ATOM 109 NH1 ARG A 6 3.976 -3.190 -17.108 1.00 74.42 N ATOM 110 NH2 ARG A 6 5.175 -4.895 -17.891 1.00 2.53 N ATOM 0 H ARG A 6 7.968 -0.196 -13.278 1.00 42.01 H new ATOM 0 HA ARG A 6 9.704 -1.778 -14.819 1.00 53.23 H new ATOM 0 HB2 ARG A 6 7.897 -3.365 -15.056 1.00 74.14 H new ATOM 0 HB3 ARG A 6 7.934 -2.747 -13.417 1.00 74.14 H new ATOM 0 HG2 ARG A 6 5.931 -1.498 -13.703 1.00 3.30 H new ATOM 0 HG3 ARG A 6 6.038 -1.537 -15.452 1.00 3.30 H new ATOM 0 HD2 ARG A 6 5.483 -3.964 -13.681 1.00 22.14 H new ATOM 0 HD3 ARG A 6 4.261 -3.057 -14.550 1.00 22.14 H new ATOM 0 HE ARG A 6 6.249 -4.932 -15.708 1.00 44.21 H new ATOM 0 HH11 ARG A 6 3.740 -2.542 -16.356 1.00 74.42 H new ATOM 0 HH12 ARG A 6 3.495 -3.127 -18.005 1.00 74.42 H new ATOM 0 HH21 ARG A 6 5.894 -5.608 -17.768 1.00 2.53 H new ATOM 0 HH22 ARG A 6 4.682 -4.816 -18.781 1.00 2.53 H new ATOM 124 N VAL A 7 9.236 -1.442 -17.275 1.00 73.42 N ATOM 125 CA VAL A 7 9.005 -1.276 -18.715 1.00 24.11 C ATOM 126 C VAL A 7 8.373 -2.570 -19.280 1.00 20.30 C ATOM 127 O VAL A 7 8.821 -3.675 -18.956 1.00 52.25 O ATOM 128 CB VAL A 7 10.339 -0.924 -19.472 1.00 20.01 C ATOM 129 CG1 VAL A 7 10.100 -0.670 -20.982 1.00 72.23 C ATOM 130 CG2 VAL A 7 11.057 0.287 -18.806 1.00 62.51 C ATOM 0 H VAL A 7 10.087 -1.956 -17.049 1.00 73.42 H new ATOM 0 HA VAL A 7 8.320 -0.442 -18.870 1.00 24.11 H new ATOM 0 HB VAL A 7 10.993 -1.792 -19.393 1.00 20.01 H new ATOM 0 HG11 VAL A 7 11.047 -0.431 -21.465 1.00 72.23 H new ATOM 0 HG12 VAL A 7 9.676 -1.564 -21.439 1.00 72.23 H new ATOM 0 HG13 VAL A 7 9.409 0.164 -21.106 1.00 72.23 H new ATOM 0 HG21 VAL A 7 11.976 0.509 -19.349 1.00 62.51 H new ATOM 0 HG22 VAL A 7 10.401 1.157 -18.831 1.00 62.51 H new ATOM 0 HG23 VAL A 7 11.297 0.043 -17.771 1.00 62.51 H new ATOM 140 N ALA A 8 7.287 -2.406 -20.058 1.00 41.35 N ATOM 141 CA ALA A 8 6.630 -3.504 -20.819 1.00 72.15 C ATOM 142 C ALA A 8 7.637 -4.447 -21.560 1.00 42.15 C ATOM 143 O ALA A 8 7.426 -5.664 -21.635 1.00 4.14 O ATOM 144 CB ALA A 8 5.627 -2.901 -21.811 1.00 33.14 C ATOM 0 H ALA A 8 6.831 -1.502 -20.182 1.00 41.35 H new ATOM 0 HA ALA A 8 6.116 -4.134 -20.093 1.00 72.15 H new ATOM 0 HB1 ALA A 8 5.143 -3.701 -22.371 1.00 33.14 H new ATOM 0 HB2 ALA A 8 4.873 -2.332 -21.266 1.00 33.14 H new ATOM 0 HB3 ALA A 8 6.151 -2.240 -22.502 1.00 33.14 H new ATOM 150 N GLY A 9 8.733 -3.861 -22.076 1.00 64.01 N ATOM 151 CA GLY A 9 9.804 -4.616 -22.750 1.00 63.14 C ATOM 152 C GLY A 9 10.683 -5.492 -21.831 1.00 22.21 C ATOM 153 O GLY A 9 11.290 -6.461 -22.311 1.00 50.44 O ATOM 0 H GLY A 9 8.900 -2.856 -22.038 1.00 64.01 H new ATOM 0 HA2 GLY A 9 9.351 -5.256 -23.508 1.00 63.14 H new ATOM 0 HA3 GLY A 9 10.448 -3.909 -23.273 1.00 63.14 H new ATOM 157 N ILE A 10 10.778 -5.153 -20.525 1.00 34.23 N ATOM 158 CA ILE A 10 11.590 -5.935 -19.546 1.00 1.23 C ATOM 159 C ILE A 10 10.919 -7.299 -19.243 1.00 13.40 C ATOM 160 O ILE A 10 10.058 -7.402 -18.362 1.00 30.43 O ATOM 161 CB ILE A 10 11.825 -5.133 -18.200 1.00 64.12 C ATOM 162 CG1 ILE A 10 12.560 -3.782 -18.476 1.00 55.31 C ATOM 163 CG2 ILE A 10 12.599 -5.976 -17.141 1.00 52.01 C ATOM 164 CD1 ILE A 10 12.767 -2.894 -17.250 1.00 41.40 C ATOM 0 H ILE A 10 10.306 -4.345 -20.119 1.00 34.23 H new ATOM 0 HA ILE A 10 12.563 -6.111 -20.004 1.00 1.23 H new ATOM 0 HB ILE A 10 10.842 -4.914 -17.783 1.00 64.12 H new ATOM 0 HG12 ILE A 10 13.533 -3.999 -18.916 1.00 55.31 H new ATOM 0 HG13 ILE A 10 11.992 -3.222 -19.219 1.00 55.31 H new ATOM 0 HG21 ILE A 10 12.737 -5.385 -16.235 1.00 52.01 H new ATOM 0 HG22 ILE A 10 12.030 -6.875 -16.905 1.00 52.01 H new ATOM 0 HG23 ILE A 10 13.573 -6.258 -17.542 1.00 52.01 H new ATOM 0 HD11 ILE A 10 13.285 -1.981 -17.545 1.00 41.40 H new ATOM 0 HD12 ILE A 10 11.799 -2.639 -16.818 1.00 41.40 H new ATOM 0 HD13 ILE A 10 13.365 -3.428 -16.511 1.00 41.40 H new ATOM 176 N LYS A 11 11.254 -8.325 -20.041 1.00 52.53 N ATOM 177 CA LYS A 11 10.816 -9.729 -19.812 1.00 32.32 C ATOM 178 C LYS A 11 11.426 -10.404 -18.537 1.00 24.21 C ATOM 179 O LYS A 11 11.220 -11.605 -18.319 1.00 73.14 O ATOM 180 CB LYS A 11 11.166 -10.580 -21.078 1.00 12.23 C ATOM 181 CG LYS A 11 10.830 -9.918 -22.448 1.00 1.24 C ATOM 182 CD LYS A 11 9.338 -9.543 -22.631 1.00 52.53 C ATOM 183 CE LYS A 11 8.420 -10.769 -22.686 1.00 53.30 C ATOM 184 NZ LYS A 11 7.009 -10.384 -22.910 1.00 31.51 N ATOM 0 H LYS A 11 11.839 -8.213 -20.869 1.00 52.53 H new ATOM 0 HA LYS A 11 9.741 -9.692 -19.636 1.00 32.32 H new ATOM 0 HB2 LYS A 11 12.232 -10.809 -21.057 1.00 12.23 H new ATOM 0 HB3 LYS A 11 10.635 -11.530 -21.014 1.00 12.23 H new ATOM 0 HG2 LYS A 11 11.434 -9.018 -22.560 1.00 1.24 H new ATOM 0 HG3 LYS A 11 11.121 -10.599 -23.248 1.00 1.24 H new ATOM 0 HD2 LYS A 11 9.027 -8.898 -21.809 1.00 52.53 H new ATOM 0 HD3 LYS A 11 9.223 -8.967 -23.549 1.00 52.53 H new ATOM 0 HE2 LYS A 11 8.748 -11.434 -23.485 1.00 53.30 H new ATOM 0 HE3 LYS A 11 8.502 -11.327 -21.753 1.00 53.30 H new ATOM 0 HZ1 LYS A 11 6.417 -11.238 -22.942 1.00 31.51 H new ATOM 0 HZ2 LYS A 11 6.689 -9.770 -22.134 1.00 31.51 H new ATOM 0 HZ3 LYS A 11 6.928 -9.873 -23.812 1.00 31.51 H new ATOM 198 N ASP A 12 12.164 -9.646 -17.696 1.00 45.44 N ATOM 199 CA ASP A 12 12.821 -10.194 -16.493 1.00 61.51 C ATOM 200 C ASP A 12 11.841 -10.249 -15.298 1.00 62.33 C ATOM 201 O ASP A 12 11.630 -9.243 -14.617 1.00 44.32 O ATOM 202 CB ASP A 12 14.066 -9.354 -16.107 1.00 43.13 C ATOM 203 CG ASP A 12 15.145 -9.340 -17.194 1.00 44.14 C ATOM 204 OD1 ASP A 12 15.080 -8.484 -18.104 1.00 4.43 O ATOM 205 OD2 ASP A 12 16.059 -10.194 -17.154 1.00 25.02 O ATOM 0 H ASP A 12 12.319 -8.647 -17.832 1.00 45.44 H new ATOM 0 HA ASP A 12 13.140 -11.208 -16.732 1.00 61.51 H new ATOM 0 HB2 ASP A 12 13.755 -8.330 -15.899 1.00 43.13 H new ATOM 0 HB3 ASP A 12 14.493 -9.751 -15.186 1.00 43.13 H new ATOM 210 N LYS A 13 11.256 -11.442 -15.057 1.00 1.54 N ATOM 211 CA LYS A 13 10.466 -11.745 -13.831 1.00 73.22 C ATOM 212 C LYS A 13 11.332 -11.560 -12.550 1.00 75.33 C ATOM 213 O LYS A 13 10.812 -11.274 -11.468 1.00 4.13 O ATOM 214 CB LYS A 13 9.896 -13.195 -13.914 1.00 43.34 C ATOM 215 CG LYS A 13 9.042 -13.665 -12.706 1.00 62.11 C ATOM 216 CD LYS A 13 7.784 -12.796 -12.472 1.00 44.33 C ATOM 217 CE LYS A 13 6.894 -13.346 -11.342 1.00 20.43 C ATOM 218 NZ LYS A 13 7.596 -13.400 -10.029 1.00 54.53 N ATOM 0 H LYS A 13 11.315 -12.228 -15.705 1.00 1.54 H new ATOM 0 HA LYS A 13 9.634 -11.044 -13.769 1.00 73.22 H new ATOM 0 HB2 LYS A 13 9.287 -13.273 -14.815 1.00 43.34 H new ATOM 0 HB3 LYS A 13 10.731 -13.885 -14.033 1.00 43.34 H new ATOM 0 HG2 LYS A 13 8.736 -14.699 -12.866 1.00 62.11 H new ATOM 0 HG3 LYS A 13 9.658 -13.650 -11.807 1.00 62.11 H new ATOM 0 HD2 LYS A 13 8.089 -11.778 -12.228 1.00 44.33 H new ATOM 0 HD3 LYS A 13 7.205 -12.743 -13.394 1.00 44.33 H new ATOM 0 HE2 LYS A 13 6.006 -12.721 -11.249 1.00 20.43 H new ATOM 0 HE3 LYS A 13 6.553 -14.347 -11.608 1.00 20.43 H new ATOM 0 HZ1 LYS A 13 6.974 -13.840 -9.321 1.00 54.53 H new ATOM 0 HZ2 LYS A 13 8.466 -13.962 -10.123 1.00 54.53 H new ATOM 0 HZ3 LYS A 13 7.839 -12.435 -9.725 1.00 54.53 H new ATOM 232 N ALA A 14 12.659 -11.690 -12.718 1.00 45.33 N ATOM 233 CA ALA A 14 13.650 -11.455 -11.650 1.00 44.41 C ATOM 234 C ALA A 14 13.688 -9.960 -11.244 1.00 53.40 C ATOM 235 O ALA A 14 13.632 -9.621 -10.056 1.00 64.55 O ATOM 236 CB ALA A 14 15.035 -11.923 -12.111 1.00 71.24 C ATOM 0 H ALA A 14 13.079 -11.964 -13.606 1.00 45.33 H new ATOM 0 HA ALA A 14 13.355 -12.031 -10.773 1.00 44.41 H new ATOM 0 HB1 ALA A 14 15.761 -11.746 -11.318 1.00 71.24 H new ATOM 0 HB2 ALA A 14 15.001 -12.988 -12.342 1.00 71.24 H new ATOM 0 HB3 ALA A 14 15.329 -11.368 -13.002 1.00 71.24 H new ATOM 242 N ALA A 15 13.771 -9.077 -12.260 1.00 3.21 N ATOM 243 CA ALA A 15 13.739 -7.607 -12.067 1.00 64.50 C ATOM 244 C ALA A 15 12.342 -7.099 -11.621 1.00 10.41 C ATOM 245 O ALA A 15 12.245 -6.078 -10.934 1.00 4.24 O ATOM 246 CB ALA A 15 14.176 -6.887 -13.348 1.00 63.43 C ATOM 0 H ALA A 15 13.862 -9.359 -13.236 1.00 3.21 H new ATOM 0 HA ALA A 15 14.441 -7.377 -11.265 1.00 64.50 H new ATOM 0 HB1 ALA A 15 14.146 -5.809 -13.188 1.00 63.43 H new ATOM 0 HB2 ALA A 15 15.191 -7.188 -13.606 1.00 63.43 H new ATOM 0 HB3 ALA A 15 13.501 -7.151 -14.162 1.00 63.43 H new ATOM 252 N ILE A 16 11.268 -7.802 -12.050 1.00 73.53 N ATOM 253 CA ILE A 16 9.895 -7.539 -11.566 1.00 22.23 C ATOM 254 C ILE A 16 9.822 -7.768 -10.032 1.00 70.04 C ATOM 255 O ILE A 16 9.358 -6.897 -9.307 1.00 62.22 O ATOM 256 CB ILE A 16 8.828 -8.423 -12.330 1.00 2.21 C ATOM 257 CG1 ILE A 16 8.751 -8.038 -13.843 1.00 62.44 C ATOM 258 CG2 ILE A 16 7.421 -8.344 -11.689 1.00 64.24 C ATOM 259 CD1 ILE A 16 8.292 -6.611 -14.128 1.00 24.44 C ATOM 0 H ILE A 16 11.328 -8.558 -12.732 1.00 73.53 H new ATOM 0 HA ILE A 16 9.651 -6.497 -11.776 1.00 22.23 H new ATOM 0 HB ILE A 16 9.170 -9.454 -12.244 1.00 2.21 H new ATOM 0 HG12 ILE A 16 9.735 -8.182 -14.288 1.00 62.44 H new ATOM 0 HG13 ILE A 16 8.071 -8.728 -14.343 1.00 62.44 H new ATOM 0 HG21 ILE A 16 6.729 -8.969 -12.253 1.00 64.24 H new ATOM 0 HG22 ILE A 16 7.470 -8.696 -10.658 1.00 64.24 H new ATOM 0 HG23 ILE A 16 7.072 -7.312 -11.704 1.00 64.24 H new ATOM 0 HD11 ILE A 16 8.272 -6.443 -15.205 1.00 24.44 H new ATOM 0 HD12 ILE A 16 7.293 -6.462 -13.719 1.00 24.44 H new ATOM 0 HD13 ILE A 16 8.983 -5.907 -13.664 1.00 24.44 H new ATOM 271 N LYS A 17 10.346 -8.923 -9.556 1.00 32.33 N ATOM 272 CA LYS A 17 10.419 -9.234 -8.103 1.00 34.03 C ATOM 273 C LYS A 17 11.287 -8.217 -7.327 1.00 60.25 C ATOM 274 O LYS A 17 10.988 -7.910 -6.182 1.00 74.45 O ATOM 275 CB LYS A 17 10.979 -10.656 -7.862 1.00 11.32 C ATOM 276 CG LYS A 17 10.068 -11.791 -8.354 1.00 54.23 C ATOM 277 CD LYS A 17 10.647 -13.191 -8.052 1.00 64.21 C ATOM 278 CE LYS A 17 12.003 -13.428 -8.741 1.00 44.51 C ATOM 279 NZ LYS A 17 12.578 -14.752 -8.409 1.00 32.00 N ATOM 0 H LYS A 17 10.725 -9.656 -10.155 1.00 32.33 H new ATOM 0 HA LYS A 17 9.397 -9.173 -7.730 1.00 34.03 H new ATOM 0 HB2 LYS A 17 11.945 -10.741 -8.359 1.00 11.32 H new ATOM 0 HB3 LYS A 17 11.157 -10.787 -6.795 1.00 11.32 H new ATOM 0 HG2 LYS A 17 9.090 -11.697 -7.882 1.00 54.23 H new ATOM 0 HG3 LYS A 17 9.915 -11.689 -9.428 1.00 54.23 H new ATOM 0 HD2 LYS A 17 10.765 -13.307 -6.975 1.00 64.21 H new ATOM 0 HD3 LYS A 17 9.939 -13.952 -8.379 1.00 64.21 H new ATOM 0 HE2 LYS A 17 11.878 -13.349 -9.821 1.00 44.51 H new ATOM 0 HE3 LYS A 17 12.701 -12.646 -8.443 1.00 44.51 H new ATOM 0 HZ1 LYS A 17 13.490 -14.866 -8.895 1.00 32.00 H new ATOM 0 HZ2 LYS A 17 12.723 -14.820 -7.381 1.00 32.00 H new ATOM 0 HZ3 LYS A 17 11.925 -15.501 -8.717 1.00 32.00 H new ATOM 293 N THR A 18 12.370 -7.728 -7.960 1.00 14.33 N ATOM 294 CA THR A 18 13.269 -6.711 -7.353 1.00 71.43 C ATOM 295 C THR A 18 12.533 -5.359 -7.151 1.00 23.03 C ATOM 296 O THR A 18 12.688 -4.704 -6.120 1.00 75.43 O ATOM 297 CB THR A 18 14.556 -6.496 -8.222 1.00 42.32 C ATOM 298 OG1 THR A 18 15.289 -7.727 -8.309 1.00 61.42 O ATOM 299 CG2 THR A 18 15.492 -5.397 -7.669 1.00 32.42 C ATOM 0 H THR A 18 12.650 -8.019 -8.897 1.00 14.33 H new ATOM 0 HA THR A 18 13.571 -7.091 -6.377 1.00 71.43 H new ATOM 0 HB THR A 18 14.215 -6.169 -9.204 1.00 42.32 H new ATOM 0 HG1 THR A 18 14.799 -8.360 -8.874 1.00 61.42 H new ATOM 0 HG21 THR A 18 16.363 -5.300 -8.318 1.00 32.42 H new ATOM 0 HG22 THR A 18 14.958 -4.448 -7.634 1.00 32.42 H new ATOM 0 HG23 THR A 18 15.817 -5.667 -6.664 1.00 32.42 H new ATOM 307 N LEU A 19 11.729 -4.979 -8.158 1.00 21.32 N ATOM 308 CA LEU A 19 10.865 -3.773 -8.131 1.00 62.21 C ATOM 309 C LEU A 19 9.782 -3.884 -7.019 1.00 3.01 C ATOM 310 O LEU A 19 9.543 -2.939 -6.255 1.00 22.41 O ATOM 311 CB LEU A 19 10.234 -3.600 -9.547 1.00 41.43 C ATOM 312 CG LEU A 19 9.228 -2.406 -9.769 1.00 2.23 C ATOM 313 CD1 LEU A 19 9.365 -1.834 -11.192 1.00 15.34 C ATOM 314 CD2 LEU A 19 7.748 -2.811 -9.495 1.00 51.31 C ATOM 0 H LEU A 19 11.655 -5.504 -9.029 1.00 21.32 H new ATOM 0 HA LEU A 19 11.457 -2.890 -7.890 1.00 62.21 H new ATOM 0 HB2 LEU A 19 11.048 -3.489 -10.264 1.00 41.43 H new ATOM 0 HB3 LEU A 19 9.714 -4.525 -9.796 1.00 41.43 H new ATOM 0 HG LEU A 19 9.493 -1.636 -9.044 1.00 2.23 H new ATOM 0 HD11 LEU A 19 8.662 -1.012 -11.323 1.00 15.34 H new ATOM 0 HD12 LEU A 19 10.381 -1.470 -11.341 1.00 15.34 H new ATOM 0 HD13 LEU A 19 9.149 -2.615 -11.921 1.00 15.34 H new ATOM 0 HD21 LEU A 19 7.099 -1.952 -9.663 1.00 51.31 H new ATOM 0 HD22 LEU A 19 7.461 -3.619 -10.168 1.00 51.31 H new ATOM 0 HD23 LEU A 19 7.648 -3.145 -8.462 1.00 51.31 H new ATOM 326 N ILE A 20 9.143 -5.060 -6.969 1.00 14.32 N ATOM 327 CA ILE A 20 8.120 -5.426 -5.964 1.00 41.23 C ATOM 328 C ILE A 20 8.703 -5.417 -4.526 1.00 61.25 C ATOM 329 O ILE A 20 8.082 -4.893 -3.589 1.00 31.02 O ATOM 330 CB ILE A 20 7.540 -6.848 -6.325 1.00 35.31 C ATOM 331 CG1 ILE A 20 6.761 -6.781 -7.678 1.00 32.53 C ATOM 332 CG2 ILE A 20 6.666 -7.453 -5.203 1.00 54.42 C ATOM 333 CD1 ILE A 20 6.282 -8.121 -8.215 1.00 41.53 C ATOM 0 H ILE A 20 9.323 -5.806 -7.640 1.00 14.32 H new ATOM 0 HA ILE A 20 7.321 -4.685 -5.986 1.00 41.23 H new ATOM 0 HB ILE A 20 8.389 -7.522 -6.434 1.00 35.31 H new ATOM 0 HG12 ILE A 20 5.897 -6.129 -7.550 1.00 32.53 H new ATOM 0 HG13 ILE A 20 7.403 -6.316 -8.426 1.00 32.53 H new ATOM 0 HG21 ILE A 20 6.299 -8.431 -5.515 1.00 54.42 H new ATOM 0 HG22 ILE A 20 7.261 -7.562 -4.296 1.00 54.42 H new ATOM 0 HG23 ILE A 20 5.821 -6.794 -5.005 1.00 54.42 H new ATOM 0 HD11 ILE A 20 5.753 -7.968 -9.156 1.00 41.53 H new ATOM 0 HD12 ILE A 20 7.139 -8.773 -8.382 1.00 41.53 H new ATOM 0 HD13 ILE A 20 5.610 -8.583 -7.492 1.00 41.53 H new ATOM 345 N SER A 21 9.918 -5.978 -4.387 1.00 41.11 N ATOM 346 CA SER A 21 10.659 -6.000 -3.111 1.00 40.54 C ATOM 347 C SER A 21 11.006 -4.566 -2.670 1.00 71.32 C ATOM 348 O SER A 21 10.783 -4.203 -1.519 1.00 31.05 O ATOM 349 CB SER A 21 11.944 -6.862 -3.215 1.00 63.41 C ATOM 350 OG SER A 21 11.640 -8.247 -3.333 1.00 15.54 O ATOM 0 H SER A 21 10.414 -6.429 -5.156 1.00 41.11 H new ATOM 0 HA SER A 21 10.015 -6.455 -2.358 1.00 40.54 H new ATOM 0 HB2 SER A 21 12.528 -6.543 -4.078 1.00 63.41 H new ATOM 0 HB3 SER A 21 12.564 -6.699 -2.333 1.00 63.41 H new ATOM 0 HG SER A 21 11.367 -8.445 -4.253 1.00 15.54 H new ATOM 356 N ALA A 22 11.494 -3.754 -3.630 1.00 31.23 N ATOM 357 CA ALA A 22 11.867 -2.335 -3.401 1.00 4.32 C ATOM 358 C ALA A 22 10.699 -1.502 -2.814 1.00 51.25 C ATOM 359 O ALA A 22 10.916 -0.655 -1.939 1.00 74.34 O ATOM 360 CB ALA A 22 12.367 -1.702 -4.708 1.00 13.43 C ATOM 0 H ALA A 22 11.643 -4.061 -4.591 1.00 31.23 H new ATOM 0 HA ALA A 22 12.668 -2.328 -2.662 1.00 4.32 H new ATOM 0 HB1 ALA A 22 12.638 -0.662 -4.528 1.00 13.43 H new ATOM 0 HB2 ALA A 22 13.240 -2.247 -5.066 1.00 13.43 H new ATOM 0 HB3 ALA A 22 11.578 -1.747 -5.459 1.00 13.43 H new ATOM 366 N ALA A 23 9.465 -1.758 -3.303 1.00 20.01 N ATOM 367 CA ALA A 23 8.233 -1.147 -2.759 1.00 5.31 C ATOM 368 C ALA A 23 8.050 -1.425 -1.244 1.00 61.30 C ATOM 369 O ALA A 23 7.729 -0.520 -0.486 1.00 10.42 O ATOM 370 CB ALA A 23 7.017 -1.655 -3.548 1.00 3.20 C ATOM 0 H ALA A 23 9.296 -2.392 -4.084 1.00 20.01 H new ATOM 0 HA ALA A 23 8.323 -0.066 -2.870 1.00 5.31 H new ATOM 0 HB1 ALA A 23 6.109 -1.205 -3.147 1.00 3.20 H new ATOM 0 HB2 ALA A 23 7.124 -1.382 -4.598 1.00 3.20 H new ATOM 0 HB3 ALA A 23 6.953 -2.740 -3.460 1.00 3.20 H new ATOM 376 N TYR A 24 8.300 -2.677 -0.822 1.00 34.33 N ATOM 377 CA TYR A 24 8.135 -3.117 0.595 1.00 52.31 C ATOM 378 C TYR A 24 9.046 -2.342 1.583 1.00 40.51 C ATOM 379 O TYR A 24 8.711 -2.185 2.760 1.00 64.32 O ATOM 380 CB TYR A 24 8.424 -4.629 0.717 1.00 30.45 C ATOM 381 CG TYR A 24 7.544 -5.522 -0.165 1.00 72.03 C ATOM 382 CD1 TYR A 24 6.191 -5.244 -0.341 1.00 71.40 C ATOM 383 CD2 TYR A 24 8.054 -6.662 -0.782 1.00 41.40 C ATOM 384 CE1 TYR A 24 5.386 -6.058 -1.099 1.00 62.24 C ATOM 385 CE2 TYR A 24 7.249 -7.478 -1.548 1.00 65.22 C ATOM 386 CZ TYR A 24 5.913 -7.173 -1.700 1.00 34.10 C ATOM 387 OH TYR A 24 5.099 -7.976 -2.468 1.00 24.21 O ATOM 0 H TYR A 24 8.622 -3.419 -1.444 1.00 34.33 H new ATOM 0 HA TYR A 24 7.102 -2.901 0.867 1.00 52.31 H new ATOM 0 HB2 TYR A 24 9.469 -4.807 0.463 1.00 30.45 H new ATOM 0 HB3 TYR A 24 8.294 -4.927 1.757 1.00 30.45 H new ATOM 0 HD1 TYR A 24 5.766 -4.369 0.129 1.00 71.40 H new ATOM 0 HD2 TYR A 24 9.098 -6.911 -0.658 1.00 41.40 H new ATOM 0 HE1 TYR A 24 4.340 -5.821 -1.222 1.00 62.24 H new ATOM 0 HE2 TYR A 24 7.663 -8.353 -2.027 1.00 65.22 H new ATOM 0 HH TYR A 24 4.457 -8.439 -1.890 1.00 24.21 H new ATOM 397 N ARG A 25 10.195 -1.878 1.069 1.00 13.24 N ATOM 398 CA ARG A 25 11.182 -1.078 1.846 1.00 24.12 C ATOM 399 C ARG A 25 10.611 0.307 2.262 1.00 31.22 C ATOM 400 O ARG A 25 11.213 0.994 3.097 1.00 21.34 O ATOM 401 CB ARG A 25 12.534 -0.922 1.083 1.00 50.44 C ATOM 402 CG ARG A 25 13.480 -2.156 1.146 1.00 43.41 C ATOM 403 CD ARG A 25 12.856 -3.420 0.535 1.00 70.52 C ATOM 404 NE ARG A 25 13.785 -4.561 0.458 1.00 75.13 N ATOM 405 CZ ARG A 25 13.440 -5.819 0.235 1.00 4.20 C ATOM 406 NH1 ARG A 25 12.194 -6.177 0.099 1.00 0.55 N ATOM 407 NH2 ARG A 25 14.356 -6.724 0.171 1.00 4.44 N ATOM 0 H ARG A 25 10.476 -2.042 0.102 1.00 13.24 H new ATOM 0 HA ARG A 25 11.383 -1.636 2.760 1.00 24.12 H new ATOM 0 HB2 ARG A 25 12.319 -0.703 0.037 1.00 50.44 H new ATOM 0 HB3 ARG A 25 13.063 -0.059 1.487 1.00 50.44 H new ATOM 0 HG2 ARG A 25 14.407 -1.924 0.621 1.00 43.41 H new ATOM 0 HG3 ARG A 25 13.743 -2.353 2.185 1.00 43.41 H new ATOM 0 HD2 ARG A 25 11.988 -3.709 1.128 1.00 70.52 H new ATOM 0 HD3 ARG A 25 12.495 -3.188 -0.467 1.00 70.52 H new ATOM 0 HE ARG A 25 14.778 -4.365 0.587 1.00 75.13 H new ATOM 0 HH11 ARG A 25 11.453 -5.479 0.164 1.00 0.55 H new ATOM 0 HH12 ARG A 25 11.960 -7.155 -0.072 1.00 0.55 H new ATOM 0 HH21 ARG A 25 15.336 -6.467 0.292 1.00 4.44 H new ATOM 0 HH22 ARG A 25 14.101 -7.697 -0.000 1.00 4.44 H new ATOM 421 N GLN A 26 9.475 0.730 1.656 1.00 21.01 N ATOM 422 CA GLN A 26 8.711 1.919 2.123 1.00 10.54 C ATOM 423 C GLN A 26 7.269 1.550 2.574 1.00 10.32 C ATOM 424 O GLN A 26 6.863 1.914 3.674 1.00 63.33 O ATOM 425 CB GLN A 26 8.651 3.030 1.041 1.00 54.11 C ATOM 426 CG GLN A 26 8.143 4.387 1.596 1.00 24.12 C ATOM 427 CD GLN A 26 8.053 5.513 0.569 1.00 2.54 C ATOM 428 OE1 GLN A 26 8.310 6.667 0.883 1.00 11.33 O ATOM 429 NE2 GLN A 26 7.645 5.206 -0.641 1.00 64.21 N ATOM 0 H GLN A 26 9.066 0.268 0.844 1.00 21.01 H new ATOM 0 HA GLN A 26 9.253 2.303 2.987 1.00 10.54 H new ATOM 0 HB2 GLN A 26 9.644 3.167 0.613 1.00 54.11 H new ATOM 0 HB3 GLN A 26 7.997 2.707 0.231 1.00 54.11 H new ATOM 0 HG2 GLN A 26 7.157 4.236 2.035 1.00 24.12 H new ATOM 0 HG3 GLN A 26 8.805 4.703 2.402 1.00 24.12 H new ATOM 0 HE21 GLN A 26 7.437 4.236 -0.878 1.00 64.21 H new ATOM 0 HE22 GLN A 26 7.536 5.938 -1.343 1.00 64.21 H new ATOM 438 N ILE A 27 6.504 0.839 1.714 1.00 75.42 N ATOM 439 CA ILE A 27 5.080 0.452 1.987 1.00 31.03 C ATOM 440 C ILE A 27 4.931 -0.339 3.317 1.00 32.12 C ATOM 441 O ILE A 27 3.967 -0.155 4.064 1.00 44.21 O ATOM 442 CB ILE A 27 4.453 -0.386 0.798 1.00 31.15 C ATOM 443 CG1 ILE A 27 4.634 0.350 -0.569 1.00 3.11 C ATOM 444 CG2 ILE A 27 2.949 -0.703 1.054 1.00 45.33 C ATOM 445 CD1 ILE A 27 4.003 1.726 -0.642 1.00 51.13 C ATOM 0 H ILE A 27 6.846 0.513 0.810 1.00 75.42 H new ATOM 0 HA ILE A 27 4.531 1.389 2.080 1.00 31.03 H new ATOM 0 HB ILE A 27 4.992 -1.332 0.750 1.00 31.15 H new ATOM 0 HG12 ILE A 27 5.700 0.444 -0.776 1.00 3.11 H new ATOM 0 HG13 ILE A 27 4.209 -0.271 -1.358 1.00 3.11 H new ATOM 0 HG21 ILE A 27 2.551 -1.279 0.218 1.00 45.33 H new ATOM 0 HG22 ILE A 27 2.850 -1.281 1.973 1.00 45.33 H new ATOM 0 HG23 ILE A 27 2.392 0.229 1.150 1.00 45.33 H new ATOM 0 HD11 ILE A 27 4.182 2.156 -1.627 1.00 51.13 H new ATOM 0 HD12 ILE A 27 2.930 1.644 -0.471 1.00 51.13 H new ATOM 0 HD13 ILE A 27 4.443 2.369 0.120 1.00 51.13 H new ATOM 457 N PHE A 28 5.904 -1.209 3.604 1.00 42.45 N ATOM 458 CA PHE A 28 5.969 -1.981 4.868 1.00 24.31 C ATOM 459 C PHE A 28 7.212 -1.563 5.708 1.00 33.13 C ATOM 460 O PHE A 28 7.418 -2.089 6.808 1.00 13.51 O ATOM 461 CB PHE A 28 6.025 -3.502 4.549 1.00 41.15 C ATOM 462 CG PHE A 28 4.806 -4.063 3.807 1.00 73.22 C ATOM 463 CD1 PHE A 28 4.642 -3.855 2.441 1.00 41.24 C ATOM 464 CD2 PHE A 28 3.834 -4.807 4.470 1.00 40.02 C ATOM 465 CE1 PHE A 28 3.549 -4.368 1.766 1.00 31.31 C ATOM 466 CE2 PHE A 28 2.743 -5.319 3.788 1.00 15.24 C ATOM 467 CZ PHE A 28 2.602 -5.099 2.440 1.00 52.01 C ATOM 0 H PHE A 28 6.677 -1.405 2.968 1.00 42.45 H new ATOM 0 HA PHE A 28 5.075 -1.767 5.454 1.00 24.31 H new ATOM 0 HB2 PHE A 28 6.915 -3.698 3.951 1.00 41.15 H new ATOM 0 HB3 PHE A 28 6.143 -4.048 5.485 1.00 41.15 H new ATOM 0 HD1 PHE A 28 5.381 -3.283 1.899 1.00 41.24 H new ATOM 0 HD2 PHE A 28 3.932 -4.987 5.530 1.00 40.02 H new ATOM 0 HE1 PHE A 28 3.440 -4.193 0.706 1.00 31.31 H new ATOM 0 HE2 PHE A 28 1.999 -5.894 4.319 1.00 15.24 H new ATOM 0 HZ PHE A 28 1.749 -5.499 1.912 1.00 52.01 H new ATOM 477 N GLU A 29 7.977 -0.555 5.203 1.00 22.21 N ATOM 478 CA GLU A 29 9.339 -0.151 5.696 1.00 24.30 C ATOM 479 C GLU A 29 10.255 -1.305 6.195 1.00 33.51 C ATOM 480 O GLU A 29 11.074 -1.109 7.099 1.00 25.15 O ATOM 481 CB GLU A 29 9.210 0.993 6.746 1.00 63.43 C ATOM 482 CG GLU A 29 8.735 2.334 6.136 1.00 22.00 C ATOM 483 CD GLU A 29 8.590 3.498 7.125 1.00 31.04 C ATOM 484 OE1 GLU A 29 8.484 3.260 8.350 1.00 34.42 O ATOM 485 OE2 GLU A 29 8.539 4.668 6.680 1.00 33.30 O ATOM 0 H GLU A 29 7.661 0.018 4.421 1.00 22.21 H new ATOM 0 HA GLU A 29 9.867 0.214 4.815 1.00 24.30 H new ATOM 0 HB2 GLU A 29 8.509 0.687 7.522 1.00 63.43 H new ATOM 0 HB3 GLU A 29 10.175 1.144 7.229 1.00 63.43 H new ATOM 0 HG2 GLU A 29 9.439 2.628 5.357 1.00 22.00 H new ATOM 0 HG3 GLU A 29 7.773 2.171 5.651 1.00 22.00 H new ATOM 492 N ARG A 30 10.167 -2.472 5.541 1.00 41.22 N ATOM 493 CA ARG A 30 11.000 -3.654 5.867 1.00 34.05 C ATOM 494 C ARG A 30 11.557 -4.323 4.598 1.00 1.11 C ATOM 495 O ARG A 30 10.981 -4.222 3.504 1.00 11.43 O ATOM 496 CB ARG A 30 10.200 -4.707 6.691 1.00 1.22 C ATOM 497 CG ARG A 30 8.834 -5.106 6.077 1.00 34.44 C ATOM 498 CD ARG A 30 8.296 -6.468 6.570 1.00 54.12 C ATOM 499 NE ARG A 30 8.552 -6.713 8.001 1.00 62.00 N ATOM 500 CZ ARG A 30 7.698 -6.554 8.983 1.00 2.32 C ATOM 501 NH1 ARG A 30 6.521 -6.039 8.789 1.00 73.44 N ATOM 502 NH2 ARG A 30 8.044 -6.895 10.181 1.00 33.23 N ATOM 0 H ARG A 30 9.518 -2.630 4.770 1.00 41.22 H new ATOM 0 HA ARG A 30 11.832 -3.289 6.469 1.00 34.05 H new ATOM 0 HB2 ARG A 30 10.810 -5.604 6.800 1.00 1.22 H new ATOM 0 HB3 ARG A 30 10.032 -4.313 7.693 1.00 1.22 H new ATOM 0 HG2 ARG A 30 8.103 -4.332 6.310 1.00 34.44 H new ATOM 0 HG3 ARG A 30 8.930 -5.137 4.992 1.00 34.44 H new ATOM 0 HD2 ARG A 30 7.222 -6.514 6.387 1.00 54.12 H new ATOM 0 HD3 ARG A 30 8.754 -7.265 5.984 1.00 54.12 H new ATOM 0 HE ARG A 30 9.486 -7.038 8.252 1.00 62.00 H new ATOM 0 HH11 ARG A 30 6.240 -5.746 7.853 1.00 73.44 H new ATOM 0 HH12 ARG A 30 5.878 -5.928 9.573 1.00 73.44 H new ATOM 0 HH21 ARG A 30 8.972 -7.282 10.353 1.00 33.23 H new ATOM 0 HH22 ARG A 30 7.389 -6.777 10.954 1.00 33.23 H new ATOM 516 N ASP A 31 12.678 -5.032 4.780 1.00 11.42 N ATOM 517 CA ASP A 31 13.271 -5.867 3.736 1.00 41.24 C ATOM 518 C ASP A 31 12.580 -7.252 3.726 1.00 23.41 C ATOM 519 O ASP A 31 12.875 -8.132 4.546 1.00 54.24 O ATOM 520 CB ASP A 31 14.819 -5.960 3.887 1.00 51.12 C ATOM 521 CG ASP A 31 15.298 -6.562 5.217 1.00 15.34 C ATOM 522 OD1 ASP A 31 15.157 -5.895 6.266 1.00 22.52 O ATOM 523 OD2 ASP A 31 15.818 -7.703 5.225 1.00 24.24 O ATOM 0 H ASP A 31 13.198 -5.041 5.658 1.00 11.42 H new ATOM 0 HA ASP A 31 13.100 -5.404 2.764 1.00 41.24 H new ATOM 0 HB2 ASP A 31 15.215 -6.561 3.068 1.00 51.12 H new ATOM 0 HB3 ASP A 31 15.242 -4.961 3.783 1.00 51.12 H new ATOM 528 N ILE A 32 11.582 -7.409 2.833 1.00 2.03 N ATOM 529 CA ILE A 32 10.911 -8.703 2.620 1.00 72.10 C ATOM 530 C ILE A 32 11.756 -9.554 1.654 1.00 34.14 C ATOM 531 O ILE A 32 12.235 -9.052 0.626 1.00 3.41 O ATOM 532 CB ILE A 32 9.437 -8.548 2.062 1.00 72.21 C ATOM 533 CG1 ILE A 32 8.547 -7.737 3.063 1.00 35.14 C ATOM 534 CG2 ILE A 32 8.792 -9.932 1.740 1.00 44.43 C ATOM 535 CD1 ILE A 32 7.073 -7.617 2.681 1.00 74.12 C ATOM 0 H ILE A 32 11.224 -6.654 2.248 1.00 2.03 H new ATOM 0 HA ILE A 32 10.826 -9.195 3.589 1.00 72.10 H new ATOM 0 HB ILE A 32 9.498 -7.992 1.127 1.00 72.21 H new ATOM 0 HG12 ILE A 32 8.613 -8.207 4.044 1.00 35.14 H new ATOM 0 HG13 ILE A 32 8.962 -6.734 3.161 1.00 35.14 H new ATOM 0 HG21 ILE A 32 7.781 -9.783 1.360 1.00 44.43 H new ATOM 0 HG22 ILE A 32 9.390 -10.446 0.988 1.00 44.43 H new ATOM 0 HG23 ILE A 32 8.753 -10.535 2.647 1.00 44.43 H new ATOM 0 HD11 ILE A 32 6.547 -7.038 3.439 1.00 74.12 H new ATOM 0 HD12 ILE A 32 6.987 -7.116 1.717 1.00 74.12 H new ATOM 0 HD13 ILE A 32 6.632 -8.612 2.614 1.00 74.12 H new ATOM 547 N ALA A 33 11.936 -10.830 2.018 1.00 55.34 N ATOM 548 CA ALA A 33 12.635 -11.818 1.194 1.00 72.40 C ATOM 549 C ALA A 33 11.896 -12.010 -0.156 1.00 2.53 C ATOM 550 O ALA A 33 10.690 -12.267 -0.143 1.00 71.11 O ATOM 551 CB ALA A 33 12.716 -13.139 1.962 1.00 62.41 C ATOM 0 H ALA A 33 11.596 -11.207 2.903 1.00 55.34 H new ATOM 0 HA ALA A 33 13.644 -11.468 0.976 1.00 72.40 H new ATOM 0 HB1 ALA A 33 13.235 -13.881 1.356 1.00 62.41 H new ATOM 0 HB2 ALA A 33 13.261 -12.986 2.893 1.00 62.41 H new ATOM 0 HB3 ALA A 33 11.709 -13.493 2.185 1.00 62.41 H new ATOM 557 N PRO A 34 12.593 -11.878 -1.335 1.00 44.11 N ATOM 558 CA PRO A 34 11.938 -11.962 -2.679 1.00 3.23 C ATOM 559 C PRO A 34 11.291 -13.350 -2.950 1.00 0.23 C ATOM 560 O PRO A 34 10.347 -13.465 -3.736 1.00 1.42 O ATOM 561 CB PRO A 34 13.105 -11.666 -3.667 1.00 1.51 C ATOM 562 CG PRO A 34 14.346 -12.022 -2.899 1.00 2.52 C ATOM 563 CD PRO A 34 14.059 -11.641 -1.461 1.00 62.12 C ATOM 0 HA PRO A 34 11.106 -11.264 -2.775 1.00 3.23 H new ATOM 0 HB2 PRO A 34 13.016 -12.261 -4.576 1.00 1.51 H new ATOM 0 HB3 PRO A 34 13.112 -10.619 -3.971 1.00 1.51 H new ATOM 0 HG2 PRO A 34 14.569 -13.085 -2.986 1.00 2.52 H new ATOM 0 HG3 PRO A 34 15.212 -11.482 -3.282 1.00 2.52 H new ATOM 0 HD2 PRO A 34 14.628 -12.253 -0.761 1.00 62.12 H new ATOM 0 HD3 PRO A 34 14.318 -10.602 -1.260 1.00 62.12 H new ATOM 571 N TYR A 35 11.814 -14.391 -2.273 1.00 43.23 N ATOM 572 CA TYR A 35 11.283 -15.768 -2.364 1.00 33.35 C ATOM 573 C TYR A 35 10.012 -15.966 -1.493 1.00 1.44 C ATOM 574 O TYR A 35 9.194 -16.827 -1.794 1.00 15.21 O ATOM 575 CB TYR A 35 12.386 -16.809 -2.013 1.00 13.12 C ATOM 576 CG TYR A 35 13.063 -16.637 -0.635 1.00 11.54 C ATOM 577 CD1 TYR A 35 12.526 -17.219 0.518 1.00 42.41 C ATOM 578 CD2 TYR A 35 14.242 -15.897 -0.490 1.00 2.21 C ATOM 579 CE1 TYR A 35 13.135 -17.071 1.751 1.00 21.53 C ATOM 580 CE2 TYR A 35 14.853 -15.754 0.745 1.00 23.34 C ATOM 581 CZ TYR A 35 14.294 -16.340 1.860 1.00 52.14 C ATOM 582 OH TYR A 35 14.900 -16.189 3.096 1.00 11.05 O ATOM 0 H TYR A 35 12.615 -14.303 -1.648 1.00 43.23 H new ATOM 0 HA TYR A 35 10.979 -15.933 -3.398 1.00 33.35 H new ATOM 0 HB2 TYR A 35 11.946 -17.805 -2.058 1.00 13.12 H new ATOM 0 HB3 TYR A 35 13.157 -16.766 -2.783 1.00 13.12 H new ATOM 0 HD1 TYR A 35 11.616 -17.796 0.444 1.00 42.41 H new ATOM 0 HD2 TYR A 35 14.684 -15.429 -1.357 1.00 2.21 H new ATOM 0 HE1 TYR A 35 12.700 -17.529 2.627 1.00 21.53 H new ATOM 0 HE2 TYR A 35 15.766 -15.184 0.834 1.00 23.34 H new ATOM 0 HH TYR A 35 15.710 -15.646 2.999 1.00 11.05 H new ATOM 592 N ILE A 36 9.866 -15.173 -0.409 1.00 61.52 N ATOM 593 CA ILE A 36 8.620 -15.136 0.410 1.00 41.15 C ATOM 594 C ILE A 36 7.552 -14.250 -0.280 1.00 1.22 C ATOM 595 O ILE A 36 6.355 -14.581 -0.293 1.00 31.35 O ATOM 596 CB ILE A 36 8.909 -14.598 1.872 1.00 12.43 C ATOM 597 CG1 ILE A 36 9.863 -15.576 2.636 1.00 11.25 C ATOM 598 CG2 ILE A 36 7.603 -14.361 2.677 1.00 32.23 C ATOM 599 CD1 ILE A 36 10.273 -15.124 4.035 1.00 54.52 C ATOM 0 H ILE A 36 10.596 -14.544 -0.074 1.00 61.52 H new ATOM 0 HA ILE A 36 8.242 -16.155 0.492 1.00 41.15 H new ATOM 0 HB ILE A 36 9.402 -13.631 1.772 1.00 12.43 H new ATOM 0 HG12 ILE A 36 9.375 -16.547 2.714 1.00 11.25 H new ATOM 0 HG13 ILE A 36 10.764 -15.719 2.039 1.00 11.25 H new ATOM 0 HG21 ILE A 36 7.851 -13.993 3.672 1.00 32.23 H new ATOM 0 HG22 ILE A 36 6.986 -13.625 2.161 1.00 32.23 H new ATOM 0 HG23 ILE A 36 7.054 -15.298 2.763 1.00 32.23 H new ATOM 0 HD11 ILE A 36 10.933 -15.869 4.479 1.00 54.52 H new ATOM 0 HD12 ILE A 36 10.795 -14.169 3.971 1.00 54.52 H new ATOM 0 HD13 ILE A 36 9.384 -15.010 4.656 1.00 54.52 H new ATOM 611 N ALA A 37 8.022 -13.135 -0.868 1.00 43.15 N ATOM 612 CA ALA A 37 7.172 -12.152 -1.571 1.00 11.31 C ATOM 613 C ALA A 37 6.381 -12.804 -2.728 1.00 32.12 C ATOM 614 O ALA A 37 5.181 -12.554 -2.890 1.00 13.11 O ATOM 615 CB ALA A 37 8.040 -11.000 -2.101 1.00 54.02 C ATOM 0 H ALA A 37 9.011 -12.887 -0.870 1.00 43.15 H new ATOM 0 HA ALA A 37 6.446 -11.762 -0.858 1.00 11.31 H new ATOM 0 HB1 ALA A 37 7.409 -10.277 -2.619 1.00 54.02 H new ATOM 0 HB2 ALA A 37 8.543 -10.510 -1.267 1.00 54.02 H new ATOM 0 HB3 ALA A 37 8.784 -11.394 -2.793 1.00 54.02 H new ATOM 621 N GLN A 38 7.068 -13.679 -3.493 1.00 60.52 N ATOM 622 CA GLN A 38 6.476 -14.376 -4.650 1.00 45.51 C ATOM 623 C GLN A 38 5.479 -15.485 -4.233 1.00 72.13 C ATOM 624 O GLN A 38 4.657 -15.910 -5.040 1.00 52.32 O ATOM 625 CB GLN A 38 7.598 -14.965 -5.552 1.00 54.20 C ATOM 626 CG GLN A 38 8.367 -16.162 -4.955 1.00 61.22 C ATOM 627 CD GLN A 38 9.484 -16.715 -5.852 1.00 51.13 C ATOM 628 OE1 GLN A 38 10.485 -17.227 -5.363 1.00 23.33 O ATOM 629 NE2 GLN A 38 9.326 -16.637 -7.163 1.00 5.50 N ATOM 0 H GLN A 38 8.045 -13.920 -3.325 1.00 60.52 H new ATOM 0 HA GLN A 38 5.907 -13.636 -5.213 1.00 45.51 H new ATOM 0 HB2 GLN A 38 7.155 -15.275 -6.498 1.00 54.20 H new ATOM 0 HB3 GLN A 38 8.312 -14.173 -5.779 1.00 54.20 H new ATOM 0 HG2 GLN A 38 8.801 -15.860 -4.002 1.00 61.22 H new ATOM 0 HG3 GLN A 38 7.659 -16.963 -4.743 1.00 61.22 H new ATOM 0 HE21 GLN A 38 8.486 -16.207 -7.551 1.00 5.50 H new ATOM 0 HE22 GLN A 38 10.044 -17.007 -7.786 1.00 5.50 H new ATOM 638 N ASN A 39 5.576 -15.969 -2.978 1.00 44.30 N ATOM 639 CA ASN A 39 4.639 -16.985 -2.436 1.00 14.52 C ATOM 640 C ASN A 39 3.286 -16.343 -2.087 1.00 60.23 C ATOM 641 O ASN A 39 2.224 -16.915 -2.350 1.00 12.54 O ATOM 642 CB ASN A 39 5.236 -17.673 -1.181 1.00 33.31 C ATOM 643 CG ASN A 39 6.529 -18.432 -1.472 1.00 21.44 C ATOM 644 OD1 ASN A 39 6.766 -18.890 -2.588 1.00 52.32 O ATOM 645 ND2 ASN A 39 7.368 -18.591 -0.466 1.00 31.10 N ATOM 0 H ASN A 39 6.294 -15.674 -2.316 1.00 44.30 H new ATOM 0 HA ASN A 39 4.483 -17.740 -3.206 1.00 14.52 H new ATOM 0 HB2 ASN A 39 5.428 -16.919 -0.418 1.00 33.31 H new ATOM 0 HB3 ASN A 39 4.501 -18.364 -0.769 1.00 33.31 H new ATOM 0 HD21 ASN A 39 8.238 -19.105 -0.604 1.00 31.10 H new ATOM 0 HD22 ASN A 39 7.146 -18.200 0.450 1.00 31.10 H new ATOM 652 N GLU A 40 3.348 -15.147 -1.491 1.00 44.24 N ATOM 653 CA GLU A 40 2.156 -14.402 -1.053 1.00 33.03 C ATOM 654 C GLU A 40 1.427 -13.732 -2.239 1.00 24.42 C ATOM 655 O GLU A 40 0.190 -13.719 -2.297 1.00 52.15 O ATOM 656 CB GLU A 40 2.569 -13.335 -0.010 1.00 72.41 C ATOM 657 CG GLU A 40 3.169 -13.903 1.293 1.00 54.41 C ATOM 658 CD GLU A 40 2.183 -14.797 2.070 1.00 35.24 C ATOM 659 OE1 GLU A 40 1.218 -14.256 2.659 1.00 61.31 O ATOM 660 OE2 GLU A 40 2.351 -16.037 2.083 1.00 14.01 O ATOM 0 H GLU A 40 4.226 -14.665 -1.297 1.00 44.24 H new ATOM 0 HA GLU A 40 1.461 -15.111 -0.603 1.00 33.03 H new ATOM 0 HB2 GLU A 40 3.297 -12.664 -0.466 1.00 72.41 H new ATOM 0 HB3 GLU A 40 1.695 -12.734 0.241 1.00 72.41 H new ATOM 0 HG2 GLU A 40 4.063 -14.479 1.054 1.00 54.41 H new ATOM 0 HG3 GLU A 40 3.483 -13.078 1.932 1.00 54.41 H new ATOM 667 N PHE A 41 2.209 -13.184 -3.183 1.00 35.23 N ATOM 668 CA PHE A 41 1.686 -12.345 -4.291 1.00 45.51 C ATOM 669 C PHE A 41 1.919 -12.958 -5.703 1.00 51.12 C ATOM 670 O PHE A 41 1.915 -12.216 -6.669 1.00 15.30 O ATOM 671 CB PHE A 41 2.349 -10.934 -4.200 1.00 3.41 C ATOM 672 CG PHE A 41 2.018 -10.159 -2.916 1.00 32.12 C ATOM 673 CD1 PHE A 41 0.788 -9.514 -2.775 1.00 61.54 C ATOM 674 CD2 PHE A 41 2.924 -10.088 -1.851 1.00 55.11 C ATOM 675 CE1 PHE A 41 0.477 -8.821 -1.618 1.00 15.44 C ATOM 676 CE2 PHE A 41 2.608 -9.394 -0.696 1.00 22.11 C ATOM 677 CZ PHE A 41 1.386 -8.762 -0.580 1.00 30.21 C ATOM 0 H PHE A 41 3.221 -13.306 -3.206 1.00 35.23 H new ATOM 0 HA PHE A 41 0.605 -12.281 -4.171 1.00 45.51 H new ATOM 0 HB2 PHE A 41 3.431 -11.049 -4.272 1.00 3.41 H new ATOM 0 HB3 PHE A 41 2.034 -10.342 -5.059 1.00 3.41 H new ATOM 0 HD1 PHE A 41 0.069 -9.556 -3.580 1.00 61.54 H new ATOM 0 HD2 PHE A 41 3.882 -10.581 -1.932 1.00 55.11 H new ATOM 0 HE1 PHE A 41 -0.478 -8.325 -1.527 1.00 15.44 H new ATOM 0 HE2 PHE A 41 3.319 -9.347 0.116 1.00 22.11 H new ATOM 0 HZ PHE A 41 1.141 -8.222 0.322 1.00 30.21 H new ATOM 687 N SER A 42 2.027 -14.307 -5.825 1.00 62.52 N ATOM 688 CA SER A 42 2.372 -15.009 -7.122 1.00 32.50 C ATOM 689 C SER A 42 1.528 -14.551 -8.349 1.00 34.54 C ATOM 690 O SER A 42 2.080 -14.214 -9.412 1.00 43.02 O ATOM 691 CB SER A 42 2.215 -16.542 -6.953 1.00 3.53 C ATOM 692 OG SER A 42 2.510 -17.245 -8.154 1.00 51.55 O ATOM 0 H SER A 42 1.882 -14.947 -5.044 1.00 62.52 H new ATOM 0 HA SER A 42 3.405 -14.734 -7.333 1.00 32.50 H new ATOM 0 HB2 SER A 42 2.876 -16.888 -6.159 1.00 3.53 H new ATOM 0 HB3 SER A 42 1.196 -16.770 -6.641 1.00 3.53 H new ATOM 0 HG SER A 42 2.401 -18.207 -8.005 1.00 51.55 H new ATOM 698 N GLY A 43 0.193 -14.526 -8.181 1.00 43.34 N ATOM 699 CA GLY A 43 -0.722 -14.080 -9.245 1.00 3.13 C ATOM 700 C GLY A 43 -0.724 -12.559 -9.426 1.00 44.44 C ATOM 701 O GLY A 43 -0.854 -12.061 -10.543 1.00 54.02 O ATOM 0 H GLY A 43 -0.274 -14.809 -7.320 1.00 43.34 H new ATOM 0 HA2 GLY A 43 -0.437 -14.553 -10.185 1.00 3.13 H new ATOM 0 HA3 GLY A 43 -1.733 -14.415 -9.013 1.00 3.13 H new ATOM 705 N TRP A 44 -0.560 -11.842 -8.300 1.00 41.22 N ATOM 706 CA TRP A 44 -0.493 -10.360 -8.257 1.00 65.13 C ATOM 707 C TRP A 44 0.746 -9.825 -9.040 1.00 32.41 C ATOM 708 O TRP A 44 0.696 -8.748 -9.648 1.00 55.20 O ATOM 709 CB TRP A 44 -0.491 -9.901 -6.766 1.00 33.43 C ATOM 710 CG TRP A 44 -0.809 -8.439 -6.506 1.00 53.24 C ATOM 711 CD1 TRP A 44 -0.119 -7.582 -5.684 1.00 41.42 C ATOM 712 CD2 TRP A 44 -1.918 -7.674 -7.027 1.00 24.10 C ATOM 713 NE1 TRP A 44 -0.712 -6.350 -5.678 1.00 2.23 N ATOM 714 CE2 TRP A 44 -1.818 -6.381 -6.487 1.00 33.31 C ATOM 715 CE3 TRP A 44 -2.982 -7.953 -7.901 1.00 3.51 C ATOM 716 CZ2 TRP A 44 -2.734 -5.380 -6.785 1.00 55.11 C ATOM 717 CZ3 TRP A 44 -3.887 -6.952 -8.196 1.00 15.53 C ATOM 718 CH2 TRP A 44 -3.758 -5.680 -7.636 1.00 10.31 C ATOM 0 H TRP A 44 -0.469 -12.275 -7.381 1.00 41.22 H new ATOM 0 HA TRP A 44 -1.368 -9.939 -8.752 1.00 65.13 H new ATOM 0 HB2 TRP A 44 -1.213 -10.509 -6.221 1.00 33.43 H new ATOM 0 HB3 TRP A 44 0.491 -10.117 -6.344 1.00 33.43 H new ATOM 0 HD1 TRP A 44 0.766 -7.844 -5.123 1.00 41.42 H new ATOM 0 HE1 TRP A 44 -0.384 -5.538 -5.155 1.00 2.23 H new ATOM 0 HE3 TRP A 44 -3.091 -8.936 -8.336 1.00 3.51 H new ATOM 0 HZ2 TRP A 44 -2.639 -4.393 -6.356 1.00 55.11 H new ATOM 0 HZ3 TRP A 44 -4.706 -7.156 -8.870 1.00 15.53 H new ATOM 0 HH2 TRP A 44 -4.483 -4.918 -7.881 1.00 10.31 H new ATOM 729 N GLU A 45 1.838 -10.625 -9.040 1.00 71.03 N ATOM 730 CA GLU A 45 3.057 -10.372 -9.849 1.00 30.21 C ATOM 731 C GLU A 45 2.773 -10.601 -11.348 1.00 61.13 C ATOM 732 O GLU A 45 3.261 -9.859 -12.201 1.00 71.32 O ATOM 733 CB GLU A 45 4.214 -11.320 -9.441 1.00 44.25 C ATOM 734 CG GLU A 45 4.631 -11.289 -7.964 1.00 11.40 C ATOM 735 CD GLU A 45 5.771 -12.273 -7.678 1.00 54.53 C ATOM 736 OE1 GLU A 45 5.547 -13.498 -7.823 1.00 12.51 O ATOM 737 OE2 GLU A 45 6.907 -11.840 -7.393 1.00 11.14 O ATOM 0 H GLU A 45 1.900 -11.472 -8.474 1.00 71.03 H new ATOM 0 HA GLU A 45 3.345 -9.337 -9.667 1.00 30.21 H new ATOM 0 HB2 GLU A 45 3.925 -12.340 -9.693 1.00 44.25 H new ATOM 0 HB3 GLU A 45 5.086 -11.076 -10.048 1.00 44.25 H new ATOM 0 HG2 GLU A 45 4.944 -10.280 -7.695 1.00 11.40 H new ATOM 0 HG3 GLU A 45 3.773 -11.534 -7.338 1.00 11.40 H new ATOM 744 N SER A 46 2.020 -11.680 -11.646 1.00 53.23 N ATOM 745 CA SER A 46 1.617 -12.038 -13.030 1.00 2.52 C ATOM 746 C SER A 46 0.747 -10.928 -13.658 1.00 15.40 C ATOM 747 O SER A 46 0.913 -10.593 -14.832 1.00 23.40 O ATOM 748 CB SER A 46 0.866 -13.393 -13.044 1.00 30.44 C ATOM 749 OG SER A 46 0.435 -13.754 -14.355 1.00 20.34 O ATOM 0 H SER A 46 1.673 -12.329 -10.939 1.00 53.23 H new ATOM 0 HA SER A 46 2.521 -12.137 -13.631 1.00 2.52 H new ATOM 0 HB2 SER A 46 1.518 -14.172 -12.650 1.00 30.44 H new ATOM 0 HB3 SER A 46 0.002 -13.335 -12.382 1.00 30.44 H new ATOM 0 HG SER A 46 -0.032 -14.615 -14.320 1.00 20.34 H new ATOM 755 N LYS A 47 -0.152 -10.332 -12.850 1.00 71.44 N ATOM 756 CA LYS A 47 -0.974 -9.175 -13.280 1.00 74.54 C ATOM 757 C LYS A 47 -0.068 -7.973 -13.678 1.00 41.13 C ATOM 758 O LYS A 47 -0.355 -7.255 -14.636 1.00 31.32 O ATOM 759 CB LYS A 47 -1.944 -8.735 -12.147 1.00 50.05 C ATOM 760 CG LYS A 47 -2.879 -9.832 -11.590 1.00 11.15 C ATOM 761 CD LYS A 47 -3.857 -10.423 -12.631 1.00 72.35 C ATOM 762 CE LYS A 47 -4.911 -9.413 -13.114 1.00 31.31 C ATOM 763 NZ LYS A 47 -5.767 -8.896 -12.009 1.00 53.21 N ATOM 0 H LYS A 47 -0.330 -10.632 -11.891 1.00 71.44 H new ATOM 0 HA LYS A 47 -1.556 -9.487 -14.147 1.00 74.54 H new ATOM 0 HB2 LYS A 47 -1.351 -8.338 -11.323 1.00 50.05 H new ATOM 0 HB3 LYS A 47 -2.559 -7.917 -12.520 1.00 50.05 H new ATOM 0 HG2 LYS A 47 -2.270 -10.639 -11.182 1.00 11.15 H new ATOM 0 HG3 LYS A 47 -3.455 -9.417 -10.763 1.00 11.15 H new ATOM 0 HD2 LYS A 47 -3.290 -10.784 -13.489 1.00 72.35 H new ATOM 0 HD3 LYS A 47 -4.362 -11.286 -12.197 1.00 72.35 H new ATOM 0 HE2 LYS A 47 -4.409 -8.576 -13.600 1.00 31.31 H new ATOM 0 HE3 LYS A 47 -5.543 -9.886 -13.866 1.00 31.31 H new ATOM 0 HZ1 LYS A 47 -6.551 -8.342 -12.408 1.00 53.21 H new ATOM 0 HZ2 LYS A 47 -6.150 -9.695 -11.464 1.00 53.21 H new ATOM 0 HZ3 LYS A 47 -5.198 -8.290 -11.383 1.00 53.21 H new ATOM 777 N LEU A 48 1.030 -7.787 -12.924 1.00 61.13 N ATOM 778 CA LEU A 48 1.990 -6.681 -13.137 1.00 53.25 C ATOM 779 C LEU A 48 2.869 -6.908 -14.407 1.00 15.41 C ATOM 780 O LEU A 48 2.988 -6.019 -15.252 1.00 64.12 O ATOM 781 CB LEU A 48 2.882 -6.517 -11.872 1.00 14.45 C ATOM 782 CG LEU A 48 3.732 -5.213 -11.807 1.00 74.43 C ATOM 783 CD1 LEU A 48 2.823 -3.964 -11.734 1.00 12.25 C ATOM 784 CD2 LEU A 48 4.747 -5.251 -10.642 1.00 75.31 C ATOM 0 H LEU A 48 1.280 -8.399 -12.147 1.00 61.13 H new ATOM 0 HA LEU A 48 1.423 -5.765 -13.303 1.00 53.25 H new ATOM 0 HB2 LEU A 48 2.241 -6.555 -10.991 1.00 14.45 H new ATOM 0 HB3 LEU A 48 3.556 -7.371 -11.813 1.00 14.45 H new ATOM 0 HG LEU A 48 4.311 -5.148 -12.728 1.00 74.43 H new ATOM 0 HD11 LEU A 48 3.440 -3.067 -11.689 1.00 12.25 H new ATOM 0 HD12 LEU A 48 2.188 -3.924 -12.619 1.00 12.25 H new ATOM 0 HD13 LEU A 48 2.199 -4.020 -10.842 1.00 12.25 H new ATOM 0 HD21 LEU A 48 5.321 -4.325 -10.629 1.00 75.31 H new ATOM 0 HD22 LEU A 48 4.213 -5.360 -9.698 1.00 75.31 H new ATOM 0 HD23 LEU A 48 5.423 -6.095 -10.776 1.00 75.31 H new ATOM 796 N GLY A 49 3.454 -8.118 -14.530 1.00 54.11 N ATOM 797 CA GLY A 49 4.382 -8.466 -15.634 1.00 33.41 C ATOM 798 C GLY A 49 3.699 -8.624 -17.008 1.00 11.13 C ATOM 799 O GLY A 49 4.337 -8.452 -18.052 1.00 54.13 O ATOM 0 H GLY A 49 3.299 -8.881 -13.871 1.00 54.11 H new ATOM 0 HA2 GLY A 49 5.147 -7.693 -15.708 1.00 33.41 H new ATOM 0 HA3 GLY A 49 4.892 -9.397 -15.385 1.00 33.41 H new ATOM 803 N ASN A 50 2.400 -8.978 -16.994 1.00 60.41 N ATOM 804 CA ASN A 50 1.553 -9.053 -18.224 1.00 70.24 C ATOM 805 C ASN A 50 0.959 -7.656 -18.546 1.00 14.11 C ATOM 806 O ASN A 50 0.522 -7.389 -19.669 1.00 31.35 O ATOM 807 CB ASN A 50 0.424 -10.110 -18.043 1.00 23.24 C ATOM 808 CG ASN A 50 0.961 -11.539 -17.860 1.00 1.24 C ATOM 809 OD1 ASN A 50 1.970 -11.922 -18.443 1.00 41.21 O ATOM 810 ND2 ASN A 50 0.299 -12.335 -17.043 1.00 75.52 N ATOM 0 H ASN A 50 1.899 -9.221 -16.139 1.00 60.41 H new ATOM 0 HA ASN A 50 2.174 -9.365 -19.063 1.00 70.24 H new ATOM 0 HB2 ASN A 50 -0.181 -9.842 -17.177 1.00 23.24 H new ATOM 0 HB3 ASN A 50 -0.233 -10.084 -18.912 1.00 23.24 H new ATOM 0 HD21 ASN A 50 0.624 -13.289 -16.886 1.00 75.52 H new ATOM 0 HD22 ASN A 50 -0.538 -11.997 -16.568 1.00 75.52 H new ATOM 817 N GLY A 51 0.959 -6.796 -17.517 1.00 64.33 N ATOM 818 CA GLY A 51 0.542 -5.394 -17.638 1.00 40.41 C ATOM 819 C GLY A 51 -0.971 -5.216 -17.524 1.00 34.44 C ATOM 820 O GLY A 51 -1.539 -4.263 -18.061 1.00 4.15 O ATOM 0 H GLY A 51 1.250 -7.056 -16.574 1.00 64.33 H new ATOM 0 HA2 GLY A 51 1.032 -4.805 -16.863 1.00 40.41 H new ATOM 0 HA3 GLY A 51 0.879 -5.001 -18.597 1.00 40.41 H new ATOM 824 N GLU A 52 -1.622 -6.176 -16.849 1.00 10.51 N ATOM 825 CA GLU A 52 -3.060 -6.123 -16.519 1.00 1.44 C ATOM 826 C GLU A 52 -3.340 -4.972 -15.520 1.00 2.40 C ATOM 827 O GLU A 52 -4.340 -4.259 -15.620 1.00 42.10 O ATOM 828 CB GLU A 52 -3.491 -7.479 -15.904 1.00 53.50 C ATOM 829 CG GLU A 52 -3.171 -8.726 -16.764 1.00 24.51 C ATOM 830 CD GLU A 52 -3.992 -8.809 -18.062 1.00 63.12 C ATOM 831 OE1 GLU A 52 -5.172 -9.222 -18.001 1.00 41.25 O ATOM 832 OE2 GLU A 52 -3.475 -8.452 -19.142 1.00 55.41 O ATOM 0 H GLU A 52 -1.162 -7.022 -16.512 1.00 10.51 H new ATOM 0 HA GLU A 52 -3.632 -5.936 -17.428 1.00 1.44 H new ATOM 0 HB2 GLU A 52 -3.004 -7.591 -14.935 1.00 53.50 H new ATOM 0 HB3 GLU A 52 -4.565 -7.451 -15.720 1.00 53.50 H new ATOM 0 HG2 GLU A 52 -2.110 -8.721 -17.015 1.00 24.51 H new ATOM 0 HG3 GLU A 52 -3.354 -9.622 -16.171 1.00 24.51 H new ATOM 839 N ILE A 53 -2.420 -4.814 -14.550 1.00 22.21 N ATOM 840 CA ILE A 53 -2.459 -3.732 -13.546 1.00 35.03 C ATOM 841 C ILE A 53 -1.227 -2.803 -13.714 1.00 33.35 C ATOM 842 O ILE A 53 -0.143 -3.261 -14.104 1.00 71.50 O ATOM 843 CB ILE A 53 -2.491 -4.306 -12.064 1.00 65.41 C ATOM 844 CG1 ILE A 53 -1.136 -4.985 -11.684 1.00 43.12 C ATOM 845 CG2 ILE A 53 -3.674 -5.292 -11.878 1.00 20.21 C ATOM 846 CD1 ILE A 53 -1.062 -5.554 -10.280 1.00 21.14 C ATOM 0 H ILE A 53 -1.621 -5.439 -14.439 1.00 22.21 H new ATOM 0 HA ILE A 53 -3.375 -3.165 -13.711 1.00 35.03 H new ATOM 0 HB ILE A 53 -2.639 -3.464 -11.388 1.00 65.41 H new ATOM 0 HG12 ILE A 53 -0.941 -5.789 -12.394 1.00 43.12 H new ATOM 0 HG13 ILE A 53 -0.337 -4.253 -11.803 1.00 43.12 H new ATOM 0 HG21 ILE A 53 -3.674 -5.671 -10.856 1.00 20.21 H new ATOM 0 HG22 ILE A 53 -4.613 -4.774 -12.073 1.00 20.21 H new ATOM 0 HG23 ILE A 53 -3.567 -6.124 -12.574 1.00 20.21 H new ATOM 0 HD11 ILE A 53 -0.081 -6.001 -10.120 1.00 21.14 H new ATOM 0 HD12 ILE A 53 -1.219 -4.755 -9.555 1.00 21.14 H new ATOM 0 HD13 ILE A 53 -1.832 -6.315 -10.155 1.00 21.14 H new ATOM 858 N THR A 54 -1.413 -1.489 -13.492 1.00 3.24 N ATOM 859 CA THR A 54 -0.282 -0.551 -13.267 1.00 54.21 C ATOM 860 C THR A 54 0.367 -0.777 -11.878 1.00 12.24 C ATOM 861 O THR A 54 -0.242 -1.399 -10.992 1.00 15.45 O ATOM 862 CB THR A 54 -0.724 0.950 -13.407 1.00 24.34 C ATOM 863 OG1 THR A 54 0.406 1.828 -13.241 1.00 22.42 O ATOM 864 CG2 THR A 54 -1.815 1.329 -12.390 1.00 73.42 C ATOM 0 H THR A 54 -2.332 -1.047 -13.462 1.00 3.24 H new ATOM 0 HA THR A 54 0.455 -0.762 -14.042 1.00 54.21 H new ATOM 0 HB THR A 54 -1.137 1.065 -14.409 1.00 24.34 H new ATOM 0 HG1 THR A 54 0.321 2.313 -12.394 1.00 22.42 H new ATOM 0 HG21 THR A 54 -2.089 2.375 -12.524 1.00 73.42 H new ATOM 0 HG22 THR A 54 -2.692 0.701 -12.546 1.00 73.42 H new ATOM 0 HG23 THR A 54 -1.437 1.179 -11.379 1.00 73.42 H new ATOM 872 N VAL A 55 1.598 -0.257 -11.691 1.00 71.41 N ATOM 873 CA VAL A 55 2.336 -0.411 -10.414 1.00 42.12 C ATOM 874 C VAL A 55 1.610 0.327 -9.261 1.00 73.22 C ATOM 875 O VAL A 55 1.617 -0.149 -8.136 1.00 73.03 O ATOM 876 CB VAL A 55 3.833 0.068 -10.503 1.00 4.33 C ATOM 877 CG1 VAL A 55 4.620 -0.282 -9.205 1.00 12.44 C ATOM 878 CG2 VAL A 55 4.532 -0.511 -11.753 1.00 14.14 C ATOM 0 H VAL A 55 2.102 0.271 -12.403 1.00 71.41 H new ATOM 0 HA VAL A 55 2.354 -1.480 -10.204 1.00 42.12 H new ATOM 0 HB VAL A 55 3.825 1.154 -10.600 1.00 4.33 H new ATOM 0 HG11 VAL A 55 5.650 0.063 -9.300 1.00 12.44 H new ATOM 0 HG12 VAL A 55 4.151 0.208 -8.352 1.00 12.44 H new ATOM 0 HG13 VAL A 55 4.611 -1.361 -9.054 1.00 12.44 H new ATOM 0 HG21 VAL A 55 5.564 -0.162 -11.787 1.00 14.14 H new ATOM 0 HG22 VAL A 55 4.518 -1.600 -11.706 1.00 14.14 H new ATOM 0 HG23 VAL A 55 4.008 -0.180 -12.649 1.00 14.14 H new ATOM 888 N LYS A 56 0.971 1.474 -9.563 1.00 2.34 N ATOM 889 CA LYS A 56 0.075 2.193 -8.618 1.00 74.04 C ATOM 890 C LYS A 56 -0.998 1.271 -7.976 1.00 33.35 C ATOM 891 O LYS A 56 -1.164 1.252 -6.750 1.00 31.12 O ATOM 892 CB LYS A 56 -0.644 3.327 -9.381 1.00 14.34 C ATOM 893 CG LYS A 56 -1.406 4.336 -8.497 1.00 34.14 C ATOM 894 CD LYS A 56 -2.400 5.214 -9.298 1.00 50.24 C ATOM 895 CE LYS A 56 -2.802 6.493 -8.553 1.00 32.32 C ATOM 896 NZ LYS A 56 -1.707 7.494 -8.573 1.00 65.22 N ATOM 0 H LYS A 56 1.058 1.934 -10.469 1.00 2.34 H new ATOM 0 HA LYS A 56 0.699 2.579 -7.812 1.00 74.04 H new ATOM 0 HB2 LYS A 56 0.094 3.871 -9.971 1.00 14.34 H new ATOM 0 HB3 LYS A 56 -1.348 2.881 -10.084 1.00 14.34 H new ATOM 0 HG2 LYS A 56 -1.950 3.794 -7.724 1.00 34.14 H new ATOM 0 HG3 LYS A 56 -0.688 4.980 -7.990 1.00 34.14 H new ATOM 0 HD2 LYS A 56 -1.951 5.483 -10.254 1.00 50.24 H new ATOM 0 HD3 LYS A 56 -3.295 4.632 -9.519 1.00 50.24 H new ATOM 0 HE2 LYS A 56 -3.695 6.918 -9.011 1.00 32.32 H new ATOM 0 HE3 LYS A 56 -3.058 6.251 -7.521 1.00 32.32 H new ATOM 0 HZ1 LYS A 56 -1.478 7.778 -7.599 1.00 65.22 H new ATOM 0 HZ2 LYS A 56 -0.865 7.078 -9.019 1.00 65.22 H new ATOM 0 HZ3 LYS A 56 -2.009 8.329 -9.115 1.00 65.22 H new ATOM 910 N GLU A 57 -1.721 0.523 -8.830 1.00 33.55 N ATOM 911 CA GLU A 57 -2.777 -0.420 -8.397 1.00 31.03 C ATOM 912 C GLU A 57 -2.163 -1.642 -7.665 1.00 32.53 C ATOM 913 O GLU A 57 -2.791 -2.221 -6.772 1.00 31.13 O ATOM 914 CB GLU A 57 -3.612 -0.860 -9.631 1.00 10.33 C ATOM 915 CG GLU A 57 -4.890 -1.665 -9.305 1.00 45.13 C ATOM 916 CD GLU A 57 -5.823 -1.841 -10.520 1.00 33.13 C ATOM 917 OE1 GLU A 57 -6.553 -0.884 -10.863 1.00 52.54 O ATOM 918 OE2 GLU A 57 -5.830 -2.918 -11.143 1.00 60.12 O ATOM 0 H GLU A 57 -1.592 0.553 -9.841 1.00 33.55 H new ATOM 0 HA GLU A 57 -3.436 0.081 -7.688 1.00 31.03 H new ATOM 0 HB2 GLU A 57 -3.895 0.029 -10.194 1.00 10.33 H new ATOM 0 HB3 GLU A 57 -2.979 -1.462 -10.283 1.00 10.33 H new ATOM 0 HG2 GLU A 57 -4.606 -2.647 -8.927 1.00 45.13 H new ATOM 0 HG3 GLU A 57 -5.435 -1.162 -8.506 1.00 45.13 H new ATOM 925 N PHE A 58 -0.929 -2.022 -8.069 1.00 72.12 N ATOM 926 CA PHE A 58 -0.112 -3.028 -7.347 1.00 3.15 C ATOM 927 C PHE A 58 0.129 -2.593 -5.869 1.00 12.23 C ATOM 928 O PHE A 58 -0.057 -3.393 -4.942 1.00 71.13 O ATOM 929 CB PHE A 58 1.242 -3.285 -8.077 1.00 21.13 C ATOM 930 CG PHE A 58 2.027 -4.496 -7.549 1.00 31.22 C ATOM 931 CD1 PHE A 58 2.867 -4.388 -6.439 1.00 70.13 C ATOM 932 CD2 PHE A 58 1.901 -5.745 -8.154 1.00 22.15 C ATOM 933 CE1 PHE A 58 3.542 -5.490 -5.955 1.00 63.35 C ATOM 934 CE2 PHE A 58 2.585 -6.841 -7.669 1.00 51.45 C ATOM 935 CZ PHE A 58 3.399 -6.714 -6.570 1.00 65.32 C ATOM 0 H PHE A 58 -0.473 -1.643 -8.899 1.00 72.12 H new ATOM 0 HA PHE A 58 -0.670 -3.964 -7.339 1.00 3.15 H new ATOM 0 HB2 PHE A 58 1.046 -3.429 -9.140 1.00 21.13 H new ATOM 0 HB3 PHE A 58 1.865 -2.395 -7.985 1.00 21.13 H new ATOM 0 HD1 PHE A 58 2.990 -3.431 -5.954 1.00 70.13 H new ATOM 0 HD2 PHE A 58 1.259 -5.857 -9.015 1.00 22.15 H new ATOM 0 HE1 PHE A 58 4.184 -5.392 -5.092 1.00 63.35 H new ATOM 0 HE2 PHE A 58 2.480 -7.800 -8.154 1.00 51.45 H new ATOM 0 HZ PHE A 58 3.927 -7.575 -6.188 1.00 65.32 H new ATOM 945 N ILE A 59 0.521 -1.311 -5.681 1.00 50.14 N ATOM 946 CA ILE A 59 0.766 -0.703 -4.347 1.00 71.32 C ATOM 947 C ILE A 59 -0.515 -0.725 -3.474 1.00 54.15 C ATOM 948 O ILE A 59 -0.457 -0.976 -2.261 1.00 41.21 O ATOM 949 CB ILE A 59 1.284 0.780 -4.485 1.00 23.55 C ATOM 950 CG1 ILE A 59 2.596 0.854 -5.329 1.00 43.24 C ATOM 951 CG2 ILE A 59 1.489 1.441 -3.106 1.00 13.11 C ATOM 952 CD1 ILE A 59 3.747 0.024 -4.791 1.00 21.43 C ATOM 0 H ILE A 59 0.678 -0.664 -6.454 1.00 50.14 H new ATOM 0 HA ILE A 59 1.534 -1.302 -3.858 1.00 71.32 H new ATOM 0 HB ILE A 59 0.511 1.337 -5.014 1.00 23.55 H new ATOM 0 HG12 ILE A 59 2.376 0.528 -6.346 1.00 43.24 H new ATOM 0 HG13 ILE A 59 2.914 1.895 -5.389 1.00 43.24 H new ATOM 0 HG21 ILE A 59 1.846 2.462 -3.241 1.00 13.11 H new ATOM 0 HG22 ILE A 59 0.543 1.456 -2.566 1.00 13.11 H new ATOM 0 HG23 ILE A 59 2.223 0.872 -2.535 1.00 13.11 H new ATOM 0 HD11 ILE A 59 4.614 0.138 -5.442 1.00 21.43 H new ATOM 0 HD12 ILE A 59 4.001 0.362 -3.786 1.00 21.43 H new ATOM 0 HD13 ILE A 59 3.454 -1.025 -4.758 1.00 21.43 H new ATOM 964 N GLU A 60 -1.656 -0.445 -4.115 1.00 53.31 N ATOM 965 CA GLU A 60 -2.985 -0.568 -3.492 1.00 64.13 C ATOM 966 C GLU A 60 -3.213 -1.986 -2.897 1.00 22.24 C ATOM 967 O GLU A 60 -3.579 -2.115 -1.729 1.00 25.41 O ATOM 968 CB GLU A 60 -4.073 -0.218 -4.529 1.00 64.14 C ATOM 969 CG GLU A 60 -5.517 -0.347 -4.012 1.00 35.12 C ATOM 970 CD GLU A 60 -6.559 0.143 -5.023 1.00 75.01 C ATOM 971 OE1 GLU A 60 -6.757 -0.533 -6.056 1.00 22.30 O ATOM 972 OE2 GLU A 60 -7.173 1.207 -4.799 1.00 4.25 O ATOM 0 H GLU A 60 -1.687 -0.126 -5.083 1.00 53.31 H new ATOM 0 HA GLU A 60 -3.044 0.135 -2.661 1.00 64.13 H new ATOM 0 HB2 GLU A 60 -3.914 0.804 -4.872 1.00 64.14 H new ATOM 0 HB3 GLU A 60 -3.952 -0.867 -5.396 1.00 64.14 H new ATOM 0 HG2 GLU A 60 -5.718 -1.390 -3.767 1.00 35.12 H new ATOM 0 HG3 GLU A 60 -5.619 0.222 -3.088 1.00 35.12 H new ATOM 979 N GLY A 61 -2.961 -3.035 -3.711 1.00 75.34 N ATOM 980 CA GLY A 61 -3.012 -4.439 -3.250 1.00 41.02 C ATOM 981 C GLY A 61 -2.091 -4.769 -2.060 1.00 13.32 C ATOM 982 O GLY A 61 -2.392 -5.671 -1.274 1.00 44.32 O ATOM 0 H GLY A 61 -2.719 -2.934 -4.697 1.00 75.34 H new ATOM 0 HA2 GLY A 61 -4.039 -4.677 -2.972 1.00 41.02 H new ATOM 0 HA3 GLY A 61 -2.749 -5.089 -4.084 1.00 41.02 H new ATOM 986 N LEU A 62 -0.967 -4.034 -1.937 1.00 32.23 N ATOM 987 CA LEU A 62 -0.039 -4.162 -0.786 1.00 54.25 C ATOM 988 C LEU A 62 -0.666 -3.565 0.503 1.00 70.32 C ATOM 989 O LEU A 62 -0.477 -4.098 1.603 1.00 21.41 O ATOM 990 CB LEU A 62 1.322 -3.479 -1.100 1.00 63.04 C ATOM 991 CG LEU A 62 2.020 -3.916 -2.427 1.00 51.13 C ATOM 992 CD1 LEU A 62 3.408 -3.250 -2.574 1.00 4.12 C ATOM 993 CD2 LEU A 62 2.097 -5.459 -2.547 1.00 35.21 C ATOM 0 H LEU A 62 -0.675 -3.339 -2.625 1.00 32.23 H new ATOM 0 HA LEU A 62 0.140 -5.223 -0.614 1.00 54.25 H new ATOM 0 HB2 LEU A 62 1.165 -2.401 -1.134 1.00 63.04 H new ATOM 0 HB3 LEU A 62 2.004 -3.676 -0.273 1.00 63.04 H new ATOM 0 HG LEU A 62 1.407 -3.566 -3.257 1.00 51.13 H new ATOM 0 HD11 LEU A 62 3.870 -3.573 -3.507 1.00 4.12 H new ATOM 0 HD12 LEU A 62 3.292 -2.166 -2.583 1.00 4.12 H new ATOM 0 HD13 LEU A 62 4.042 -3.541 -1.736 1.00 4.12 H new ATOM 0 HD21 LEU A 62 2.589 -5.727 -3.482 1.00 35.21 H new ATOM 0 HD22 LEU A 62 2.667 -5.861 -1.709 1.00 35.21 H new ATOM 0 HD23 LEU A 62 1.090 -5.876 -2.534 1.00 35.21 H new ATOM 1005 N GLY A 63 -1.403 -2.448 0.349 1.00 15.52 N ATOM 1006 CA GLY A 63 -2.234 -1.893 1.433 1.00 12.12 C ATOM 1007 C GLY A 63 -3.427 -2.795 1.816 1.00 0.11 C ATOM 1008 O GLY A 63 -3.920 -2.744 2.947 1.00 53.34 O ATOM 0 H GLY A 63 -1.439 -1.912 -0.518 1.00 15.52 H new ATOM 0 HA2 GLY A 63 -1.611 -1.735 2.313 1.00 12.12 H new ATOM 0 HA3 GLY A 63 -2.610 -0.916 1.128 1.00 12.12 H new ATOM 1012 N TYR A 64 -3.891 -3.616 0.852 1.00 72.50 N ATOM 1013 CA TYR A 64 -4.956 -4.635 1.070 1.00 33.04 C ATOM 1014 C TYR A 64 -4.389 -5.953 1.678 1.00 23.41 C ATOM 1015 O TYR A 64 -5.155 -6.880 1.971 1.00 0.32 O ATOM 1016 CB TYR A 64 -5.694 -4.944 -0.274 1.00 11.41 C ATOM 1017 CG TYR A 64 -6.670 -3.853 -0.787 1.00 43.13 C ATOM 1018 CD1 TYR A 64 -6.405 -2.492 -0.632 1.00 2.43 C ATOM 1019 CD2 TYR A 64 -7.862 -4.203 -1.434 1.00 62.10 C ATOM 1020 CE1 TYR A 64 -7.283 -1.529 -1.098 1.00 14.25 C ATOM 1021 CE2 TYR A 64 -8.739 -3.240 -1.904 1.00 14.11 C ATOM 1022 CZ TYR A 64 -8.443 -1.905 -1.733 1.00 42.41 C ATOM 1023 OH TYR A 64 -9.312 -0.940 -2.204 1.00 35.01 O ATOM 0 H TYR A 64 -3.541 -3.596 -0.106 1.00 72.50 H new ATOM 0 HA TYR A 64 -5.663 -4.216 1.787 1.00 33.04 H new ATOM 0 HB2 TYR A 64 -4.943 -5.121 -1.044 1.00 11.41 H new ATOM 0 HB3 TYR A 64 -6.252 -5.873 -0.153 1.00 11.41 H new ATOM 0 HD1 TYR A 64 -5.496 -2.183 -0.138 1.00 2.43 H new ATOM 0 HD2 TYR A 64 -8.102 -5.247 -1.569 1.00 62.10 H new ATOM 0 HE1 TYR A 64 -7.057 -0.482 -0.963 1.00 14.25 H new ATOM 0 HE2 TYR A 64 -9.651 -3.534 -2.402 1.00 14.11 H new ATOM 0 HH TYR A 64 -10.083 -1.372 -2.628 1.00 35.01 H new ATOM 1033 N SER A 65 -3.052 -6.032 1.861 1.00 45.42 N ATOM 1034 CA SER A 65 -2.381 -7.235 2.416 1.00 22.43 C ATOM 1035 C SER A 65 -2.452 -7.271 3.959 1.00 43.15 C ATOM 1036 O SER A 65 -2.068 -6.305 4.629 1.00 53.43 O ATOM 1037 CB SER A 65 -0.901 -7.287 1.977 1.00 70.14 C ATOM 1038 OG SER A 65 -0.222 -8.399 2.551 1.00 22.30 O ATOM 0 H SER A 65 -2.411 -5.273 1.631 1.00 45.42 H new ATOM 0 HA SER A 65 -2.911 -8.103 2.023 1.00 22.43 H new ATOM 0 HB2 SER A 65 -0.845 -7.348 0.890 1.00 70.14 H new ATOM 0 HB3 SER A 65 -0.401 -6.364 2.271 1.00 70.14 H new ATOM 0 HG SER A 65 0.740 -8.316 2.384 1.00 22.30 H new ATOM 1044 N ASN A 66 -2.886 -8.432 4.507 1.00 2.41 N ATOM 1045 CA ASN A 66 -2.995 -8.675 5.969 1.00 34.21 C ATOM 1046 C ASN A 66 -1.628 -8.521 6.699 1.00 61.00 C ATOM 1047 O ASN A 66 -1.594 -8.369 7.922 1.00 33.11 O ATOM 1048 CB ASN A 66 -3.591 -10.093 6.219 1.00 43.54 C ATOM 1049 CG ASN A 66 -3.883 -10.394 7.696 1.00 2.33 C ATOM 1050 OD1 ASN A 66 -4.957 -10.103 8.203 1.00 4.12 O ATOM 1051 ND2 ASN A 66 -2.930 -10.991 8.393 1.00 75.14 N ATOM 0 H ASN A 66 -3.173 -9.233 3.944 1.00 2.41 H new ATOM 0 HA ASN A 66 -3.660 -7.918 6.384 1.00 34.21 H new ATOM 0 HB2 ASN A 66 -4.514 -10.194 5.648 1.00 43.54 H new ATOM 0 HB3 ASN A 66 -2.896 -10.841 5.836 1.00 43.54 H new ATOM 0 HD21 ASN A 66 -3.083 -11.218 9.375 1.00 75.14 H new ATOM 0 HD22 ASN A 66 -2.042 -11.224 7.948 1.00 75.14 H new ATOM 1058 N LEU A 67 -0.507 -8.556 5.941 1.00 1.22 N ATOM 1059 CA LEU A 67 0.842 -8.344 6.499 1.00 14.21 C ATOM 1060 C LEU A 67 0.969 -6.934 7.143 1.00 73.33 C ATOM 1061 O LEU A 67 1.278 -6.836 8.329 1.00 2.43 O ATOM 1062 CB LEU A 67 1.922 -8.580 5.412 1.00 74.14 C ATOM 1063 CG LEU A 67 3.417 -8.412 5.860 1.00 30.40 C ATOM 1064 CD1 LEU A 67 3.753 -9.263 7.101 1.00 15.22 C ATOM 1065 CD2 LEU A 67 4.384 -8.740 4.704 1.00 2.32 C ATOM 0 H LEU A 67 -0.515 -8.730 4.936 1.00 1.22 H new ATOM 0 HA LEU A 67 1.005 -9.073 7.293 1.00 14.21 H new ATOM 0 HB2 LEU A 67 1.795 -9.589 5.019 1.00 74.14 H new ATOM 0 HB3 LEU A 67 1.733 -7.891 4.589 1.00 74.14 H new ATOM 0 HG LEU A 67 3.546 -7.365 6.136 1.00 30.40 H new ATOM 0 HD11 LEU A 67 4.798 -9.113 7.373 1.00 15.22 H new ATOM 0 HD12 LEU A 67 3.115 -8.962 7.932 1.00 15.22 H new ATOM 0 HD13 LEU A 67 3.584 -10.316 6.877 1.00 15.22 H new ATOM 0 HD21 LEU A 67 5.412 -8.615 5.043 1.00 2.32 H new ATOM 0 HD22 LEU A 67 4.231 -9.770 4.383 1.00 2.32 H new ATOM 0 HD23 LEU A 67 4.193 -8.067 3.868 1.00 2.32 H new ATOM 1077 N TYR A 68 0.712 -5.847 6.377 1.00 21.40 N ATOM 1078 CA TYR A 68 0.667 -4.463 6.933 1.00 74.01 C ATOM 1079 C TYR A 68 -0.392 -4.295 8.053 1.00 13.12 C ATOM 1080 O TYR A 68 -0.162 -3.567 9.023 1.00 15.24 O ATOM 1081 CB TYR A 68 0.388 -3.453 5.784 1.00 12.21 C ATOM 1082 CG TYR A 68 0.550 -1.969 6.170 1.00 51.52 C ATOM 1083 CD1 TYR A 68 1.819 -1.410 6.338 1.00 45.12 C ATOM 1084 CD2 TYR A 68 -0.560 -1.131 6.361 1.00 24.05 C ATOM 1085 CE1 TYR A 68 1.977 -0.079 6.679 1.00 64.00 C ATOM 1086 CE2 TYR A 68 -0.400 0.201 6.703 1.00 60.52 C ATOM 1087 CZ TYR A 68 0.870 0.720 6.861 1.00 31.34 C ATOM 1088 OH TYR A 68 1.034 2.045 7.204 1.00 61.45 O ATOM 0 H TYR A 68 0.532 -5.896 5.374 1.00 21.40 H new ATOM 0 HA TYR A 68 1.638 -4.265 7.387 1.00 74.01 H new ATOM 0 HB2 TYR A 68 1.061 -3.673 4.955 1.00 12.21 H new ATOM 0 HB3 TYR A 68 -0.628 -3.610 5.421 1.00 12.21 H new ATOM 0 HD1 TYR A 68 2.693 -2.029 6.199 1.00 45.12 H new ATOM 0 HD2 TYR A 68 -1.555 -1.532 6.239 1.00 24.05 H new ATOM 0 HE1 TYR A 68 2.967 0.333 6.802 1.00 64.00 H new ATOM 0 HE2 TYR A 68 -1.265 0.832 6.846 1.00 60.52 H new ATOM 0 HH TYR A 68 1.686 2.461 6.601 1.00 61.45 H new ATOM 1098 N LEU A 69 -1.546 -4.969 7.899 1.00 4.34 N ATOM 1099 CA LEU A 69 -2.653 -4.903 8.884 1.00 52.43 C ATOM 1100 C LEU A 69 -2.234 -5.442 10.281 1.00 4.10 C ATOM 1101 O LEU A 69 -2.484 -4.797 11.300 1.00 52.13 O ATOM 1102 CB LEU A 69 -3.915 -5.650 8.354 1.00 74.12 C ATOM 1103 CG LEU A 69 -4.850 -4.842 7.394 1.00 52.14 C ATOM 1104 CD1 LEU A 69 -5.450 -3.621 8.108 1.00 74.10 C ATOM 1105 CD2 LEU A 69 -4.137 -4.419 6.093 1.00 24.21 C ATOM 0 H LEU A 69 -1.741 -5.570 7.099 1.00 4.34 H new ATOM 0 HA LEU A 69 -2.903 -3.850 9.012 1.00 52.43 H new ATOM 0 HB2 LEU A 69 -3.586 -6.549 7.833 1.00 74.12 H new ATOM 0 HB3 LEU A 69 -4.505 -5.975 9.211 1.00 74.12 H new ATOM 0 HG LEU A 69 -5.661 -5.512 7.109 1.00 52.14 H new ATOM 0 HD11 LEU A 69 -6.096 -3.077 7.418 1.00 74.10 H new ATOM 0 HD12 LEU A 69 -6.034 -3.952 8.967 1.00 74.10 H new ATOM 0 HD13 LEU A 69 -4.647 -2.966 8.446 1.00 74.10 H new ATOM 0 HD21 LEU A 69 -4.830 -3.862 5.463 1.00 24.21 H new ATOM 0 HD22 LEU A 69 -3.281 -3.790 6.335 1.00 24.21 H new ATOM 0 HD23 LEU A 69 -3.796 -5.306 5.560 1.00 24.21 H new ATOM 1117 N LYS A 70 -1.626 -6.635 10.332 1.00 23.14 N ATOM 1118 CA LYS A 70 -1.116 -7.182 11.607 1.00 74.43 C ATOM 1119 C LYS A 70 0.079 -6.364 12.188 1.00 40.21 C ATOM 1120 O LYS A 70 0.233 -6.301 13.414 1.00 52.52 O ATOM 1121 CB LYS A 70 -0.746 -8.689 11.488 1.00 31.51 C ATOM 1122 CG LYS A 70 0.530 -8.996 10.678 1.00 61.24 C ATOM 1123 CD LYS A 70 0.963 -10.479 10.779 1.00 73.14 C ATOM 1124 CE LYS A 70 2.331 -10.739 10.132 1.00 71.33 C ATOM 1125 NZ LYS A 70 2.763 -12.151 10.277 1.00 55.21 N ATOM 0 H LYS A 70 -1.474 -7.236 9.522 1.00 23.14 H new ATOM 0 HA LYS A 70 -1.939 -7.089 12.315 1.00 74.43 H new ATOM 0 HB2 LYS A 70 -0.625 -9.096 12.492 1.00 31.51 H new ATOM 0 HB3 LYS A 70 -1.583 -9.216 11.029 1.00 31.51 H new ATOM 0 HG2 LYS A 70 0.360 -8.742 9.632 1.00 61.24 H new ATOM 0 HG3 LYS A 70 1.341 -8.360 11.032 1.00 61.24 H new ATOM 0 HD2 LYS A 70 1.000 -10.773 11.828 1.00 73.14 H new ATOM 0 HD3 LYS A 70 0.212 -11.107 10.298 1.00 73.14 H new ATOM 0 HE2 LYS A 70 2.285 -10.482 9.074 1.00 71.33 H new ATOM 0 HE3 LYS A 70 3.075 -10.085 10.586 1.00 71.33 H new ATOM 0 HZ1 LYS A 70 3.691 -12.278 9.825 1.00 55.21 H new ATOM 0 HZ2 LYS A 70 2.834 -12.390 11.287 1.00 55.21 H new ATOM 0 HZ3 LYS A 70 2.067 -12.775 9.821 1.00 55.21 H new ATOM 1139 N GLU A 71 0.926 -5.741 11.326 1.00 5.43 N ATOM 1140 CA GLU A 71 2.128 -5.005 11.804 1.00 4.33 C ATOM 1141 C GLU A 71 1.850 -3.513 12.158 1.00 14.22 C ATOM 1142 O GLU A 71 2.055 -3.112 13.305 1.00 64.10 O ATOM 1143 CB GLU A 71 3.234 -5.082 10.716 1.00 14.44 C ATOM 1144 CG GLU A 71 3.650 -6.513 10.305 1.00 12.32 C ATOM 1145 CD GLU A 71 4.338 -7.314 11.421 1.00 23.24 C ATOM 1146 OE1 GLU A 71 5.550 -7.112 11.643 1.00 64.22 O ATOM 1147 OE2 GLU A 71 3.687 -8.160 12.070 1.00 61.45 O ATOM 0 H GLU A 71 0.803 -5.733 10.314 1.00 5.43 H new ATOM 0 HA GLU A 71 2.447 -5.486 12.729 1.00 4.33 H new ATOM 0 HB2 GLU A 71 2.887 -4.552 9.829 1.00 14.44 H new ATOM 0 HB3 GLU A 71 4.116 -4.554 11.078 1.00 14.44 H new ATOM 0 HG2 GLU A 71 2.764 -7.056 9.976 1.00 12.32 H new ATOM 0 HG3 GLU A 71 4.322 -6.452 9.449 1.00 12.32 H new ATOM 1154 N PHE A 72 1.397 -2.685 11.184 1.00 73.41 N ATOM 1155 CA PHE A 72 1.111 -1.240 11.428 1.00 0.05 C ATOM 1156 C PHE A 72 -0.406 -0.913 11.342 1.00 14.31 C ATOM 1157 O PHE A 72 -0.833 -0.089 10.522 1.00 21.02 O ATOM 1158 CB PHE A 72 1.918 -0.378 10.411 1.00 25.23 C ATOM 1159 CG PHE A 72 3.434 -0.614 10.429 1.00 14.32 C ATOM 1160 CD1 PHE A 72 4.248 0.059 11.337 1.00 44.35 C ATOM 1161 CD2 PHE A 72 4.043 -1.501 9.531 1.00 40.41 C ATOM 1162 CE1 PHE A 72 5.617 -0.149 11.357 1.00 70.23 C ATOM 1163 CE2 PHE A 72 5.412 -1.708 9.554 1.00 23.23 C ATOM 1164 CZ PHE A 72 6.199 -1.029 10.465 1.00 21.21 C ATOM 0 H PHE A 72 1.221 -2.987 10.226 1.00 73.41 H new ATOM 0 HA PHE A 72 1.422 -1.002 12.445 1.00 0.05 H new ATOM 0 HB2 PHE A 72 1.545 -0.581 9.407 1.00 25.23 H new ATOM 0 HB3 PHE A 72 1.726 0.675 10.616 1.00 25.23 H new ATOM 0 HD1 PHE A 72 3.805 0.753 12.036 1.00 44.35 H new ATOM 0 HD2 PHE A 72 3.436 -2.030 8.811 1.00 40.41 H new ATOM 0 HE1 PHE A 72 6.231 0.378 12.072 1.00 70.23 H new ATOM 0 HE2 PHE A 72 5.865 -2.400 8.860 1.00 23.23 H new ATOM 0 HZ PHE A 72 7.267 -1.186 10.480 1.00 21.21 H new ATOM 1174 N TYR A 73 -1.203 -1.556 12.212 1.00 40.41 N ATOM 1175 CA TYR A 73 -2.661 -1.298 12.324 1.00 71.21 C ATOM 1176 C TYR A 73 -3.214 -1.911 13.626 1.00 34.32 C ATOM 1177 O TYR A 73 -3.769 -1.205 14.468 1.00 5.24 O ATOM 1178 CB TYR A 73 -3.415 -1.849 11.074 1.00 5.44 C ATOM 1179 CG TYR A 73 -4.955 -1.760 11.111 1.00 72.25 C ATOM 1180 CD1 TYR A 73 -5.743 -2.799 11.638 1.00 0.24 C ATOM 1181 CD2 TYR A 73 -5.618 -0.650 10.605 1.00 30.01 C ATOM 1182 CE1 TYR A 73 -7.124 -2.710 11.660 1.00 25.04 C ATOM 1183 CE2 TYR A 73 -6.993 -0.556 10.627 1.00 11.42 C ATOM 1184 CZ TYR A 73 -7.743 -1.586 11.151 1.00 4.22 C ATOM 1185 OH TYR A 73 -9.118 -1.487 11.177 1.00 33.34 O ATOM 0 H TYR A 73 -0.863 -2.268 12.858 1.00 40.41 H new ATOM 0 HA TYR A 73 -2.824 -0.221 12.361 1.00 71.21 H new ATOM 0 HB2 TYR A 73 -3.062 -1.309 10.196 1.00 5.44 H new ATOM 0 HB3 TYR A 73 -3.136 -2.894 10.939 1.00 5.44 H new ATOM 0 HD1 TYR A 73 -5.262 -3.682 12.032 1.00 0.24 H new ATOM 0 HD2 TYR A 73 -5.042 0.160 10.183 1.00 30.01 H new ATOM 0 HE1 TYR A 73 -7.714 -3.515 12.073 1.00 25.04 H new ATOM 0 HE2 TYR A 73 -7.481 0.323 10.234 1.00 11.42 H new ATOM 0 HH TYR A 73 -9.392 -0.633 10.781 1.00 33.34 H new ATOM 1195 N THR A 74 -3.046 -3.240 13.772 1.00 31.14 N ATOM 1196 CA THR A 74 -3.583 -4.013 14.925 1.00 12.02 C ATOM 1197 C THR A 74 -2.953 -3.585 16.298 1.00 50.34 C ATOM 1198 O THR A 74 -3.701 -3.337 17.248 1.00 62.41 O ATOM 1199 CB THR A 74 -3.439 -5.566 14.710 1.00 25.01 C ATOM 1200 OG1 THR A 74 -4.078 -5.965 13.477 1.00 44.03 O ATOM 1201 CG2 THR A 74 -4.044 -6.380 15.873 1.00 21.13 C ATOM 0 H THR A 74 -2.536 -3.813 13.099 1.00 31.14 H new ATOM 0 HA THR A 74 -4.645 -3.771 14.971 1.00 12.02 H new ATOM 0 HB THR A 74 -2.370 -5.777 14.667 1.00 25.01 H new ATOM 0 HG1 THR A 74 -3.591 -5.583 12.717 1.00 44.03 H new ATOM 0 HG21 THR A 74 -3.919 -7.445 15.676 1.00 21.13 H new ATOM 0 HG22 THR A 74 -3.536 -6.121 16.802 1.00 21.13 H new ATOM 0 HG23 THR A 74 -5.106 -6.150 15.964 1.00 21.13 H new ATOM 1209 N PRO A 75 -1.577 -3.475 16.446 1.00 24.04 N ATOM 1210 CA PRO A 75 -0.956 -2.986 17.706 1.00 71.22 C ATOM 1211 C PRO A 75 -0.819 -1.438 17.770 1.00 21.44 C ATOM 1212 O PRO A 75 -0.112 -0.910 18.631 1.00 10.23 O ATOM 1213 CB PRO A 75 0.423 -3.681 17.672 1.00 23.11 C ATOM 1214 CG PRO A 75 0.785 -3.711 16.220 1.00 40.21 C ATOM 1215 CD PRO A 75 -0.523 -3.834 15.451 1.00 0.55 C ATOM 0 HA PRO A 75 -1.555 -3.216 18.587 1.00 71.22 H new ATOM 0 HB2 PRO A 75 1.161 -3.130 18.255 1.00 23.11 H new ATOM 0 HB3 PRO A 75 0.373 -4.686 18.090 1.00 23.11 H new ATOM 0 HG2 PRO A 75 1.319 -2.805 15.935 1.00 40.21 H new ATOM 0 HG3 PRO A 75 1.444 -4.551 16.002 1.00 40.21 H new ATOM 0 HD2 PRO A 75 -0.543 -3.163 14.592 1.00 0.55 H new ATOM 0 HD3 PRO A 75 -0.665 -4.845 15.069 1.00 0.55 H new ATOM 1223 N TYR A 76 -1.503 -0.720 16.853 1.00 50.34 N ATOM 1224 CA TYR A 76 -1.452 0.765 16.763 1.00 35.11 C ATOM 1225 C TYR A 76 -2.870 1.388 16.853 1.00 54.22 C ATOM 1226 O TYR A 76 -3.851 0.755 16.442 1.00 2.31 O ATOM 1227 CB TYR A 76 -0.755 1.194 15.438 1.00 31.31 C ATOM 1228 CG TYR A 76 0.765 0.957 15.430 1.00 42.34 C ATOM 1229 CD1 TYR A 76 1.650 1.931 15.896 1.00 14.52 C ATOM 1230 CD2 TYR A 76 1.308 -0.241 14.974 1.00 53.20 C ATOM 1231 CE1 TYR A 76 3.015 1.719 15.902 1.00 11.40 C ATOM 1232 CE2 TYR A 76 2.675 -0.460 14.984 1.00 44.53 C ATOM 1233 CZ TYR A 76 3.523 0.523 15.447 1.00 51.34 C ATOM 1234 OH TYR A 76 4.888 0.309 15.468 1.00 61.33 O ATOM 0 H TYR A 76 -2.107 -1.149 16.152 1.00 50.34 H new ATOM 0 HA TYR A 76 -0.873 1.135 17.609 1.00 35.11 H new ATOM 0 HB2 TYR A 76 -1.203 0.646 14.609 1.00 31.31 H new ATOM 0 HB3 TYR A 76 -0.949 2.252 15.263 1.00 31.31 H new ATOM 0 HD1 TYR A 76 1.259 2.870 16.259 1.00 14.52 H new ATOM 0 HD2 TYR A 76 0.650 -1.014 14.605 1.00 53.20 H new ATOM 0 HE1 TYR A 76 3.681 2.489 16.262 1.00 11.40 H new ATOM 0 HE2 TYR A 76 3.076 -1.398 14.630 1.00 44.53 H new ATOM 0 HH TYR A 76 5.085 -0.584 15.115 1.00 61.33 H new ATOM 1244 N PRO A 77 -3.011 2.644 17.399 1.00 22.01 N ATOM 1245 CA PRO A 77 -4.311 3.368 17.409 1.00 63.31 C ATOM 1246 C PRO A 77 -4.708 3.890 16.003 1.00 31.44 C ATOM 1247 O PRO A 77 -3.860 3.979 15.104 1.00 25.24 O ATOM 1248 CB PRO A 77 -4.055 4.529 18.401 1.00 34.53 C ATOM 1249 CG PRO A 77 -2.586 4.800 18.283 1.00 51.43 C ATOM 1250 CD PRO A 77 -1.936 3.447 18.061 1.00 61.11 C ATOM 0 HA PRO A 77 -5.145 2.729 17.699 1.00 63.31 H new ATOM 0 HB2 PRO A 77 -4.644 5.409 18.143 1.00 34.53 H new ATOM 0 HB3 PRO A 77 -4.327 4.250 19.419 1.00 34.53 H new ATOM 0 HG2 PRO A 77 -2.378 5.475 17.453 1.00 51.43 H new ATOM 0 HG3 PRO A 77 -2.202 5.276 19.185 1.00 51.43 H new ATOM 0 HD2 PRO A 77 -1.050 3.527 17.431 1.00 61.11 H new ATOM 0 HD3 PRO A 77 -1.620 2.995 19.001 1.00 61.11 H new ATOM 1258 N ASN A 78 -5.986 4.290 15.854 1.00 71.32 N ATOM 1259 CA ASN A 78 -6.587 4.627 14.540 1.00 4.15 C ATOM 1260 C ASN A 78 -5.901 5.844 13.868 1.00 43.02 C ATOM 1261 O ASN A 78 -5.779 5.880 12.644 1.00 20.11 O ATOM 1262 CB ASN A 78 -8.112 4.876 14.683 1.00 24.53 C ATOM 1263 CG ASN A 78 -8.894 3.640 15.152 1.00 73.21 C ATOM 1264 OD1 ASN A 78 -8.378 2.791 15.866 1.00 73.33 O ATOM 1265 ND2 ASN A 78 -10.146 3.530 14.757 1.00 33.54 N ATOM 0 H ASN A 78 -6.633 4.390 16.636 1.00 71.32 H new ATOM 0 HA ASN A 78 -6.425 3.768 13.889 1.00 4.15 H new ATOM 0 HB2 ASN A 78 -8.274 5.689 15.391 1.00 24.53 H new ATOM 0 HB3 ASN A 78 -8.510 5.205 13.723 1.00 24.53 H new ATOM 0 HD21 ASN A 78 -10.703 2.726 15.046 1.00 33.54 H new ATOM 0 HD22 ASN A 78 -10.558 4.249 14.162 1.00 33.54 H new ATOM 1272 N THR A 79 -5.455 6.830 14.675 1.00 21.44 N ATOM 1273 CA THR A 79 -4.734 8.030 14.182 1.00 24.32 C ATOM 1274 C THR A 79 -3.309 7.695 13.678 1.00 4.24 C ATOM 1275 O THR A 79 -2.842 8.269 12.688 1.00 74.42 O ATOM 1276 CB THR A 79 -4.653 9.119 15.309 1.00 33.24 C ATOM 1277 OG1 THR A 79 -5.983 9.448 15.752 1.00 72.22 O ATOM 1278 CG2 THR A 79 -3.935 10.411 14.857 1.00 73.23 C ATOM 0 H THR A 79 -5.583 6.820 15.687 1.00 21.44 H new ATOM 0 HA THR A 79 -5.302 8.416 13.336 1.00 24.32 H new ATOM 0 HB THR A 79 -4.064 8.692 16.120 1.00 33.24 H new ATOM 0 HG1 THR A 79 -5.934 10.127 16.457 1.00 72.22 H new ATOM 0 HG21 THR A 79 -3.913 11.123 15.682 1.00 73.23 H new ATOM 0 HG22 THR A 79 -2.915 10.174 14.555 1.00 73.23 H new ATOM 0 HG23 THR A 79 -4.470 10.849 14.014 1.00 73.23 H new ATOM 1286 N LYS A 80 -2.607 6.774 14.372 1.00 63.11 N ATOM 1287 CA LYS A 80 -1.247 6.334 13.965 1.00 32.20 C ATOM 1288 C LYS A 80 -1.281 5.523 12.645 1.00 43.45 C ATOM 1289 O LYS A 80 -0.351 5.601 11.835 1.00 22.22 O ATOM 1290 CB LYS A 80 -0.589 5.492 15.082 1.00 20.14 C ATOM 1291 CG LYS A 80 0.933 5.280 14.917 1.00 12.35 C ATOM 1292 CD LYS A 80 1.735 6.588 15.113 1.00 4.51 C ATOM 1293 CE LYS A 80 3.251 6.353 15.176 1.00 60.14 C ATOM 1294 NZ LYS A 80 3.991 7.614 15.423 1.00 62.23 N ATOM 0 H LYS A 80 -2.955 6.319 15.216 1.00 63.11 H new ATOM 0 HA LYS A 80 -0.652 7.232 13.797 1.00 32.20 H new ATOM 0 HB2 LYS A 80 -0.773 5.977 16.041 1.00 20.14 H new ATOM 0 HB3 LYS A 80 -1.076 4.518 15.119 1.00 20.14 H new ATOM 0 HG2 LYS A 80 1.274 4.537 15.638 1.00 12.35 H new ATOM 0 HG3 LYS A 80 1.136 4.878 13.924 1.00 12.35 H new ATOM 0 HD2 LYS A 80 1.512 7.272 14.294 1.00 4.51 H new ATOM 0 HD3 LYS A 80 1.409 7.074 16.032 1.00 4.51 H new ATOM 0 HE2 LYS A 80 3.476 5.638 15.967 1.00 60.14 H new ATOM 0 HE3 LYS A 80 3.590 5.909 14.240 1.00 60.14 H new ATOM 0 HZ1 LYS A 80 5.012 7.442 15.325 1.00 62.23 H new ATOM 0 HZ2 LYS A 80 3.693 8.332 14.733 1.00 62.23 H new ATOM 0 HZ3 LYS A 80 3.788 7.953 16.385 1.00 62.23 H new ATOM 1308 N VAL A 81 -2.369 4.745 12.457 1.00 64.33 N ATOM 1309 CA VAL A 81 -2.665 4.039 11.183 1.00 54.33 C ATOM 1310 C VAL A 81 -2.729 5.039 10.000 1.00 42.25 C ATOM 1311 O VAL A 81 -2.351 4.717 8.880 1.00 14.22 O ATOM 1312 CB VAL A 81 -4.026 3.250 11.274 1.00 2.32 C ATOM 1313 CG1 VAL A 81 -4.417 2.605 9.917 1.00 61.40 C ATOM 1314 CG2 VAL A 81 -3.976 2.186 12.397 1.00 43.10 C ATOM 0 H VAL A 81 -3.069 4.586 13.182 1.00 64.33 H new ATOM 0 HA VAL A 81 -1.856 3.329 11.009 1.00 54.33 H new ATOM 0 HB VAL A 81 -4.801 3.975 11.522 1.00 2.32 H new ATOM 0 HG11 VAL A 81 -5.361 2.072 10.026 1.00 61.40 H new ATOM 0 HG12 VAL A 81 -4.525 3.384 9.162 1.00 61.40 H new ATOM 0 HG13 VAL A 81 -3.639 1.906 9.609 1.00 61.40 H new ATOM 0 HG21 VAL A 81 -4.927 1.656 12.439 1.00 43.10 H new ATOM 0 HG22 VAL A 81 -3.174 1.477 12.191 1.00 43.10 H new ATOM 0 HG23 VAL A 81 -3.791 2.675 13.353 1.00 43.10 H new ATOM 1324 N ILE A 82 -3.218 6.252 10.293 1.00 71.52 N ATOM 1325 CA ILE A 82 -3.318 7.346 9.315 1.00 20.31 C ATOM 1326 C ILE A 82 -1.941 7.966 9.002 1.00 3.14 C ATOM 1327 O ILE A 82 -1.599 8.138 7.825 1.00 44.31 O ATOM 1328 CB ILE A 82 -4.303 8.447 9.837 1.00 54.32 C ATOM 1329 CG1 ILE A 82 -5.715 7.823 10.071 1.00 13.41 C ATOM 1330 CG2 ILE A 82 -4.368 9.675 8.895 1.00 74.23 C ATOM 1331 CD1 ILE A 82 -6.654 8.700 10.858 1.00 43.33 C ATOM 0 H ILE A 82 -3.558 6.504 11.221 1.00 71.52 H new ATOM 0 HA ILE A 82 -3.706 6.925 8.387 1.00 20.31 H new ATOM 0 HB ILE A 82 -3.921 8.819 10.788 1.00 54.32 H new ATOM 0 HG12 ILE A 82 -6.167 7.601 9.104 1.00 13.41 H new ATOM 0 HG13 ILE A 82 -5.598 6.874 10.594 1.00 13.41 H new ATOM 0 HG21 ILE A 82 -5.064 10.409 9.301 1.00 74.23 H new ATOM 0 HG22 ILE A 82 -3.377 10.122 8.811 1.00 74.23 H new ATOM 0 HG23 ILE A 82 -4.708 9.359 7.909 1.00 74.23 H new ATOM 0 HD11 ILE A 82 -7.612 8.193 10.976 1.00 43.33 H new ATOM 0 HD12 ILE A 82 -6.226 8.901 11.840 1.00 43.33 H new ATOM 0 HD13 ILE A 82 -6.804 9.640 10.328 1.00 43.33 H new ATOM 1343 N GLU A 83 -1.144 8.305 10.041 1.00 3.03 N ATOM 1344 CA GLU A 83 0.174 8.944 9.858 1.00 63.11 C ATOM 1345 C GLU A 83 1.181 8.013 9.143 1.00 13.20 C ATOM 1346 O GLU A 83 1.685 8.356 8.071 1.00 63.43 O ATOM 1347 CB GLU A 83 0.715 9.367 11.245 1.00 54.22 C ATOM 1348 CG GLU A 83 2.121 9.995 11.227 1.00 4.33 C ATOM 1349 CD GLU A 83 2.607 10.418 12.620 1.00 53.51 C ATOM 1350 OE1 GLU A 83 3.050 9.542 13.397 1.00 75.15 O ATOM 1351 OE2 GLU A 83 2.544 11.624 12.950 1.00 44.45 O ATOM 0 H GLU A 83 -1.394 8.145 11.017 1.00 3.03 H new ATOM 0 HA GLU A 83 0.050 9.818 9.218 1.00 63.11 H new ATOM 0 HB2 GLU A 83 0.020 10.080 11.688 1.00 54.22 H new ATOM 0 HB3 GLU A 83 0.732 8.492 11.895 1.00 54.22 H new ATOM 0 HG2 GLU A 83 2.827 9.280 10.804 1.00 4.33 H new ATOM 0 HG3 GLU A 83 2.116 10.865 10.570 1.00 4.33 H new ATOM 1358 N LEU A 84 1.440 6.820 9.729 1.00 1.32 N ATOM 1359 CA LEU A 84 2.257 5.751 9.086 1.00 53.31 C ATOM 1360 C LEU A 84 1.597 5.261 7.769 1.00 64.25 C ATOM 1361 O LEU A 84 2.272 4.800 6.853 1.00 33.20 O ATOM 1362 CB LEU A 84 2.445 4.563 10.077 1.00 43.13 C ATOM 1363 CG LEU A 84 3.115 4.906 11.444 1.00 50.43 C ATOM 1364 CD1 LEU A 84 3.313 3.633 12.301 1.00 72.53 C ATOM 1365 CD2 LEU A 84 4.439 5.682 11.257 1.00 14.12 C ATOM 0 H LEU A 84 1.093 6.568 10.655 1.00 1.32 H new ATOM 0 HA LEU A 84 3.234 6.165 8.835 1.00 53.31 H new ATOM 0 HB2 LEU A 84 1.467 4.124 10.275 1.00 43.13 H new ATOM 0 HB3 LEU A 84 3.044 3.797 9.584 1.00 43.13 H new ATOM 0 HG LEU A 84 2.437 5.566 11.985 1.00 50.43 H new ATOM 0 HD11 LEU A 84 3.782 3.901 13.248 1.00 72.53 H new ATOM 0 HD12 LEU A 84 2.345 3.170 12.493 1.00 72.53 H new ATOM 0 HD13 LEU A 84 3.952 2.930 11.766 1.00 72.53 H new ATOM 0 HD21 LEU A 84 4.873 5.901 12.232 1.00 14.12 H new ATOM 0 HD22 LEU A 84 5.136 5.077 10.677 1.00 14.12 H new ATOM 0 HD23 LEU A 84 4.242 6.615 10.729 1.00 14.12 H new ATOM 1377 N GLY A 85 0.273 5.436 7.709 1.00 31.40 N ATOM 1378 CA GLY A 85 -0.519 5.133 6.511 1.00 33.42 C ATOM 1379 C GLY A 85 -0.134 6.017 5.328 1.00 1.20 C ATOM 1380 O GLY A 85 -0.051 5.546 4.202 1.00 60.04 O ATOM 0 H GLY A 85 -0.280 5.791 8.489 1.00 31.40 H new ATOM 0 HA2 GLY A 85 -0.380 4.086 6.241 1.00 33.42 H new ATOM 0 HA3 GLY A 85 -1.578 5.267 6.734 1.00 33.42 H new ATOM 1384 N THR A 86 0.105 7.315 5.600 1.00 63.40 N ATOM 1385 CA THR A 86 0.530 8.294 4.575 1.00 51.34 C ATOM 1386 C THR A 86 2.046 8.177 4.252 1.00 62.33 C ATOM 1387 O THR A 86 2.437 8.233 3.089 1.00 23.10 O ATOM 1388 CB THR A 86 0.199 9.762 5.023 1.00 35.13 C ATOM 1389 OG1 THR A 86 -1.181 9.863 5.433 1.00 14.44 O ATOM 1390 CG2 THR A 86 0.455 10.796 3.908 1.00 5.53 C ATOM 0 H THR A 86 0.010 7.715 6.533 1.00 63.40 H new ATOM 0 HA THR A 86 -0.031 8.061 3.670 1.00 51.34 H new ATOM 0 HB THR A 86 0.865 9.986 5.856 1.00 35.13 H new ATOM 0 HG1 THR A 86 -1.327 9.310 6.229 1.00 14.44 H new ATOM 0 HG21 THR A 86 0.209 11.793 4.273 1.00 5.53 H new ATOM 0 HG22 THR A 86 1.505 10.765 3.617 1.00 5.53 H new ATOM 0 HG23 THR A 86 -0.168 10.562 3.045 1.00 5.53 H new ATOM 1398 N LYS A 87 2.904 8.052 5.293 1.00 21.14 N ATOM 1399 CA LYS A 87 4.389 8.012 5.140 1.00 11.34 C ATOM 1400 C LYS A 87 4.885 6.815 4.301 1.00 52.34 C ATOM 1401 O LYS A 87 5.702 6.979 3.386 1.00 34.12 O ATOM 1402 CB LYS A 87 5.043 8.003 6.552 1.00 1.42 C ATOM 1403 CG LYS A 87 4.650 9.219 7.430 1.00 4.24 C ATOM 1404 CD LYS A 87 5.160 9.145 8.898 1.00 73.14 C ATOM 1405 CE LYS A 87 6.640 9.552 9.069 1.00 35.51 C ATOM 1406 NZ LYS A 87 7.589 8.639 8.377 1.00 11.13 N ATOM 0 H LYS A 87 2.593 7.976 6.262 1.00 21.14 H new ATOM 0 HA LYS A 87 4.688 8.904 4.589 1.00 11.34 H new ATOM 0 HB2 LYS A 87 4.758 7.086 7.068 1.00 1.42 H new ATOM 0 HB3 LYS A 87 6.127 7.982 6.440 1.00 1.42 H new ATOM 0 HG2 LYS A 87 5.040 10.126 6.968 1.00 4.24 H new ATOM 0 HG3 LYS A 87 3.564 9.308 7.440 1.00 4.24 H new ATOM 0 HD2 LYS A 87 4.542 9.792 9.520 1.00 73.14 H new ATOM 0 HD3 LYS A 87 5.028 8.128 9.267 1.00 73.14 H new ATOM 0 HE2 LYS A 87 6.777 10.564 8.687 1.00 35.51 H new ATOM 0 HE3 LYS A 87 6.881 9.577 10.132 1.00 35.51 H new ATOM 0 HZ1 LYS A 87 8.480 8.594 8.912 1.00 11.13 H new ATOM 0 HZ2 LYS A 87 7.173 7.688 8.316 1.00 11.13 H new ATOM 0 HZ3 LYS A 87 7.778 8.996 7.419 1.00 11.13 H new ATOM 1420 N HIS A 88 4.399 5.616 4.649 1.00 55.13 N ATOM 1421 CA HIS A 88 4.690 4.366 3.904 1.00 63.10 C ATOM 1422 C HIS A 88 4.181 4.415 2.437 1.00 70.31 C ATOM 1423 O HIS A 88 4.799 3.845 1.544 1.00 70.33 O ATOM 1424 CB HIS A 88 4.047 3.152 4.637 1.00 15.51 C ATOM 1425 CG HIS A 88 4.664 2.801 5.976 1.00 4.10 C ATOM 1426 ND1 HIS A 88 4.918 1.503 6.365 1.00 1.03 N ATOM 1427 CD2 HIS A 88 5.050 3.576 7.018 1.00 72.03 C ATOM 1428 CE1 HIS A 88 5.418 1.497 7.582 1.00 52.20 C ATOM 1429 NE2 HIS A 88 5.511 2.739 8.003 1.00 63.24 N ATOM 0 H HIS A 88 3.791 5.477 5.456 1.00 55.13 H new ATOM 0 HA HIS A 88 5.774 4.257 3.871 1.00 63.10 H new ATOM 0 HB2 HIS A 88 2.988 3.359 4.787 1.00 15.51 H new ATOM 0 HB3 HIS A 88 4.112 2.280 3.986 1.00 15.51 H new ATOM 0 HD1 HIS A 88 4.745 0.674 5.796 1.00 1.03 H new ATOM 0 HD2 HIS A 88 5.003 4.654 7.065 1.00 72.03 H new ATOM 0 HE1 HIS A 88 5.704 0.619 8.142 1.00 52.20 H new ATOM 1438 N PHE A 89 3.082 5.153 2.212 1.00 2.20 N ATOM 1439 CA PHE A 89 2.313 5.099 0.949 1.00 20.33 C ATOM 1440 C PHE A 89 2.675 6.272 -0.007 1.00 11.14 C ATOM 1441 O PHE A 89 3.264 6.057 -1.068 1.00 24.34 O ATOM 1442 CB PHE A 89 0.790 5.076 1.272 1.00 75.03 C ATOM 1443 CG PHE A 89 -0.017 4.137 0.391 1.00 33.03 C ATOM 1444 CD1 PHE A 89 -0.202 2.809 0.771 1.00 14.45 C ATOM 1445 CD2 PHE A 89 -0.585 4.572 -0.801 1.00 2.14 C ATOM 1446 CE1 PHE A 89 -0.926 1.944 -0.013 1.00 21.35 C ATOM 1447 CE2 PHE A 89 -1.308 3.705 -1.587 1.00 25.41 C ATOM 1448 CZ PHE A 89 -1.484 2.389 -1.192 1.00 54.20 C ATOM 0 H PHE A 89 2.698 5.804 2.897 1.00 2.20 H new ATOM 0 HA PHE A 89 2.580 4.183 0.422 1.00 20.33 H new ATOM 0 HB2 PHE A 89 0.655 4.785 2.314 1.00 75.03 H new ATOM 0 HB3 PHE A 89 0.392 6.086 1.169 1.00 75.03 H new ATOM 0 HD1 PHE A 89 0.230 2.455 1.695 1.00 14.45 H new ATOM 0 HD2 PHE A 89 -0.458 5.598 -1.112 1.00 2.14 H new ATOM 0 HE1 PHE A 89 -1.058 0.917 0.294 1.00 21.35 H new ATOM 0 HE2 PHE A 89 -1.740 4.051 -2.515 1.00 25.41 H new ATOM 0 HZ PHE A 89 -2.058 1.712 -1.807 1.00 54.20 H new ATOM 1458 N LEU A 90 2.325 7.510 0.399 1.00 51.01 N ATOM 1459 CA LEU A 90 2.490 8.734 -0.433 1.00 44.12 C ATOM 1460 C LEU A 90 3.955 9.257 -0.482 1.00 40.31 C ATOM 1461 O LEU A 90 4.239 10.216 -1.213 1.00 23.41 O ATOM 1462 CB LEU A 90 1.538 9.874 0.058 1.00 42.45 C ATOM 1463 CG LEU A 90 -0.005 9.672 -0.142 1.00 52.13 C ATOM 1464 CD1 LEU A 90 -0.578 8.556 0.754 1.00 72.13 C ATOM 1465 CD2 LEU A 90 -0.775 11.001 0.069 1.00 42.42 C ATOM 0 H LEU A 90 1.918 7.696 1.316 1.00 51.01 H new ATOM 0 HA LEU A 90 2.222 8.441 -1.448 1.00 44.12 H new ATOM 0 HB2 LEU A 90 1.721 10.029 1.121 1.00 42.45 H new ATOM 0 HB3 LEU A 90 1.825 10.794 -0.452 1.00 42.45 H new ATOM 0 HG LEU A 90 -0.146 9.352 -1.174 1.00 52.13 H new ATOM 0 HD11 LEU A 90 -1.649 8.459 0.575 1.00 72.13 H new ATOM 0 HD12 LEU A 90 -0.084 7.613 0.521 1.00 72.13 H new ATOM 0 HD13 LEU A 90 -0.407 8.806 1.801 1.00 72.13 H new ATOM 0 HD21 LEU A 90 -1.842 10.830 -0.076 1.00 42.42 H new ATOM 0 HD22 LEU A 90 -0.600 11.366 1.081 1.00 42.42 H new ATOM 0 HD23 LEU A 90 -0.425 11.742 -0.650 1.00 42.42 H new ATOM 1477 N GLY A 91 4.866 8.637 0.299 1.00 14.45 N ATOM 1478 CA GLY A 91 6.275 9.073 0.370 1.00 30.32 C ATOM 1479 C GLY A 91 6.449 10.434 1.052 1.00 62.14 C ATOM 1480 O GLY A 91 7.347 11.215 0.702 1.00 40.03 O ATOM 0 H GLY A 91 4.649 7.833 0.889 1.00 14.45 H new ATOM 0 HA2 GLY A 91 6.854 8.325 0.912 1.00 30.32 H new ATOM 0 HA3 GLY A 91 6.685 9.124 -0.639 1.00 30.32 H new ATOM 1484 N ARG A 92 5.569 10.703 2.037 1.00 3.23 N ATOM 1485 CA ARG A 92 5.492 12.000 2.745 1.00 31.42 C ATOM 1486 C ARG A 92 4.768 11.856 4.104 1.00 24.34 C ATOM 1487 O ARG A 92 3.961 10.947 4.292 1.00 2.23 O ATOM 1488 CB ARG A 92 4.714 13.033 1.878 1.00 53.14 C ATOM 1489 CG ARG A 92 3.211 12.709 1.688 1.00 22.02 C ATOM 1490 CD ARG A 92 2.452 13.765 0.862 1.00 52.42 C ATOM 1491 NE ARG A 92 2.880 13.815 -0.549 1.00 72.34 N ATOM 1492 CZ ARG A 92 2.554 14.766 -1.403 1.00 51.33 C ATOM 1493 NH1 ARG A 92 1.852 15.791 -1.036 1.00 54.01 N ATOM 1494 NH2 ARG A 92 2.953 14.693 -2.620 1.00 11.35 N ATOM 0 H ARG A 92 4.885 10.022 2.367 1.00 3.23 H new ATOM 0 HA ARG A 92 6.512 12.341 2.920 1.00 31.42 H new ATOM 0 HB2 ARG A 92 4.805 14.017 2.338 1.00 53.14 H new ATOM 0 HB3 ARG A 92 5.186 13.095 0.898 1.00 53.14 H new ATOM 0 HG2 ARG A 92 3.116 11.740 1.198 1.00 22.02 H new ATOM 0 HG3 ARG A 92 2.741 12.619 2.667 1.00 22.02 H new ATOM 0 HD2 ARG A 92 1.384 13.551 0.904 1.00 52.42 H new ATOM 0 HD3 ARG A 92 2.599 14.746 1.315 1.00 52.42 H new ATOM 0 HE ARG A 92 3.472 13.058 -0.890 1.00 72.34 H new ATOM 0 HH11 ARG A 92 1.539 15.875 -0.069 1.00 54.01 H new ATOM 0 HH12 ARG A 92 1.612 16.514 -1.714 1.00 54.01 H new ATOM 0 HH21 ARG A 92 3.520 13.902 -2.924 1.00 11.35 H new ATOM 0 HH22 ARG A 92 2.703 15.426 -3.283 1.00 11.35 H new ATOM 1508 N ALA A 93 5.031 12.792 5.031 1.00 2.13 N ATOM 1509 CA ALA A 93 4.242 12.922 6.278 1.00 31.13 C ATOM 1510 C ALA A 93 2.808 13.449 5.949 1.00 13.01 C ATOM 1511 O ALA A 93 2.626 14.113 4.914 1.00 4.33 O ATOM 1512 CB ALA A 93 4.987 13.842 7.273 1.00 5.11 C ATOM 0 H ALA A 93 5.785 13.474 4.944 1.00 2.13 H new ATOM 0 HA ALA A 93 4.130 11.946 6.751 1.00 31.13 H new ATOM 0 HB1 ALA A 93 4.404 13.935 8.189 1.00 5.11 H new ATOM 0 HB2 ALA A 93 5.962 13.413 7.506 1.00 5.11 H new ATOM 0 HB3 ALA A 93 5.122 14.827 6.827 1.00 5.11 H new ATOM 1518 N PRO A 94 1.754 13.139 6.786 1.00 22.15 N ATOM 1519 CA PRO A 94 0.378 13.685 6.579 1.00 24.34 C ATOM 1520 C PRO A 94 0.332 15.243 6.585 1.00 65.42 C ATOM 1521 O PRO A 94 1.291 15.912 6.991 1.00 64.32 O ATOM 1522 CB PRO A 94 -0.448 13.059 7.748 1.00 63.44 C ATOM 1523 CG PRO A 94 0.580 12.647 8.756 1.00 62.53 C ATOM 1524 CD PRO A 94 1.797 12.228 7.957 1.00 40.21 C ATOM 0 HA PRO A 94 -0.021 13.428 5.598 1.00 24.34 H new ATOM 0 HB2 PRO A 94 -1.149 13.780 8.168 1.00 63.44 H new ATOM 0 HB3 PRO A 94 -1.034 12.205 7.407 1.00 63.44 H new ATOM 0 HG2 PRO A 94 0.819 13.470 9.430 1.00 62.53 H new ATOM 0 HG3 PRO A 94 0.216 11.826 9.373 1.00 62.53 H new ATOM 0 HD2 PRO A 94 2.717 12.348 8.529 1.00 40.21 H new ATOM 0 HD3 PRO A 94 1.743 11.181 7.657 1.00 40.21 H new ATOM 1532 N ILE A 95 -0.809 15.800 6.142 1.00 53.40 N ATOM 1533 CA ILE A 95 -0.947 17.246 5.863 1.00 53.33 C ATOM 1534 C ILE A 95 -1.189 18.031 7.181 1.00 71.50 C ATOM 1535 O ILE A 95 -0.434 18.950 7.521 1.00 42.21 O ATOM 1536 CB ILE A 95 -2.116 17.538 4.826 1.00 54.30 C ATOM 1537 CG1 ILE A 95 -1.827 16.909 3.408 1.00 54.45 C ATOM 1538 CG2 ILE A 95 -2.370 19.069 4.698 1.00 23.40 C ATOM 1539 CD1 ILE A 95 -1.876 15.383 3.298 1.00 34.31 C ATOM 0 H ILE A 95 -1.660 15.266 5.967 1.00 53.40 H new ATOM 0 HA ILE A 95 -0.014 17.583 5.413 1.00 53.33 H new ATOM 0 HB ILE A 95 -3.015 17.061 5.217 1.00 54.30 H new ATOM 0 HG12 ILE A 95 -2.547 17.322 2.702 1.00 54.45 H new ATOM 0 HG13 ILE A 95 -0.839 17.240 3.086 1.00 54.45 H new ATOM 0 HG21 ILE A 95 -3.174 19.246 3.983 1.00 23.40 H new ATOM 0 HG22 ILE A 95 -2.653 19.473 5.670 1.00 23.40 H new ATOM 0 HG23 ILE A 95 -1.461 19.561 4.351 1.00 23.40 H new ATOM 0 HD11 ILE A 95 -1.659 15.085 2.272 1.00 34.31 H new ATOM 0 HD12 ILE A 95 -1.135 14.946 3.967 1.00 34.31 H new ATOM 0 HD13 ILE A 95 -2.869 15.030 3.576 1.00 34.31 H new ATOM 1551 N ASP A 96 -2.202 17.601 7.940 1.00 72.45 N ATOM 1552 CA ASP A 96 -2.722 18.339 9.110 1.00 74.01 C ATOM 1553 C ASP A 96 -3.699 17.430 9.891 1.00 24.12 C ATOM 1554 O ASP A 96 -4.158 16.414 9.359 1.00 3.22 O ATOM 1555 CB ASP A 96 -3.433 19.646 8.640 1.00 31.43 C ATOM 1556 CG ASP A 96 -3.887 20.548 9.800 1.00 55.12 C ATOM 1557 OD1 ASP A 96 -3.023 21.159 10.453 1.00 62.40 O ATOM 1558 OD2 ASP A 96 -5.099 20.604 10.097 1.00 45.22 O ATOM 0 H ASP A 96 -2.692 16.724 7.763 1.00 72.45 H new ATOM 0 HA ASP A 96 -1.899 18.618 9.768 1.00 74.01 H new ATOM 0 HB2 ASP A 96 -2.755 20.208 7.997 1.00 31.43 H new ATOM 0 HB3 ASP A 96 -4.300 19.381 8.035 1.00 31.43 H new ATOM 1563 N GLN A 97 -4.031 17.814 11.141 1.00 70.20 N ATOM 1564 CA GLN A 97 -4.974 17.053 11.991 1.00 34.42 C ATOM 1565 C GLN A 97 -6.388 16.983 11.358 1.00 5.33 C ATOM 1566 O GLN A 97 -7.096 15.997 11.538 1.00 64.13 O ATOM 1567 CB GLN A 97 -5.045 17.656 13.421 1.00 53.12 C ATOM 1568 CG GLN A 97 -5.870 16.820 14.434 1.00 1.41 C ATOM 1569 CD GLN A 97 -5.327 15.395 14.649 1.00 11.05 C ATOM 1570 OE1 GLN A 97 -4.127 15.145 14.564 1.00 51.12 O ATOM 1571 NE2 GLN A 97 -6.204 14.447 14.911 1.00 45.20 N ATOM 0 H GLN A 97 -3.658 18.652 11.587 1.00 70.20 H new ATOM 0 HA GLN A 97 -4.593 16.034 12.065 1.00 34.42 H new ATOM 0 HB2 GLN A 97 -4.031 17.769 13.804 1.00 53.12 H new ATOM 0 HB3 GLN A 97 -5.476 18.655 13.359 1.00 53.12 H new ATOM 0 HG2 GLN A 97 -5.888 17.341 15.391 1.00 1.41 H new ATOM 0 HG3 GLN A 97 -6.901 16.758 14.086 1.00 1.41 H new ATOM 0 HE21 GLN A 97 -7.196 14.674 14.978 1.00 45.20 H new ATOM 0 HE22 GLN A 97 -5.891 13.486 15.047 1.00 45.20 H new ATOM 1580 N ALA A 98 -6.767 18.019 10.585 1.00 62.32 N ATOM 1581 CA ALA A 98 -8.050 18.047 9.842 1.00 34.01 C ATOM 1582 C ALA A 98 -8.112 16.940 8.762 1.00 13.41 C ATOM 1583 O ALA A 98 -9.130 16.252 8.615 1.00 33.42 O ATOM 1584 CB ALA A 98 -8.253 19.423 9.199 1.00 43.34 C ATOM 0 H ALA A 98 -6.199 18.857 10.456 1.00 62.32 H new ATOM 0 HA ALA A 98 -8.852 17.857 10.556 1.00 34.01 H new ATOM 0 HB1 ALA A 98 -9.198 19.435 8.655 1.00 43.34 H new ATOM 0 HB2 ALA A 98 -8.271 20.188 9.975 1.00 43.34 H new ATOM 0 HB3 ALA A 98 -7.434 19.626 8.509 1.00 43.34 H new ATOM 1590 N GLU A 99 -7.016 16.798 7.995 1.00 42.12 N ATOM 1591 CA GLU A 99 -6.870 15.728 6.978 1.00 54.05 C ATOM 1592 C GLU A 99 -6.901 14.318 7.633 1.00 33.33 C ATOM 1593 O GLU A 99 -7.479 13.370 7.083 1.00 41.23 O ATOM 1594 CB GLU A 99 -5.560 15.917 6.174 1.00 52.42 C ATOM 1595 CG GLU A 99 -5.446 15.026 4.916 1.00 75.40 C ATOM 1596 CD GLU A 99 -6.488 15.365 3.825 1.00 63.31 C ATOM 1597 OE1 GLU A 99 -7.628 14.843 3.875 1.00 43.42 O ATOM 1598 OE2 GLU A 99 -6.178 16.174 2.922 1.00 71.14 O ATOM 0 H GLU A 99 -6.207 17.416 8.058 1.00 42.12 H new ATOM 0 HA GLU A 99 -7.716 15.802 6.295 1.00 54.05 H new ATOM 0 HB2 GLU A 99 -5.481 16.961 5.872 1.00 52.42 H new ATOM 0 HB3 GLU A 99 -4.714 15.710 6.829 1.00 52.42 H new ATOM 0 HG2 GLU A 99 -4.445 15.129 4.496 1.00 75.40 H new ATOM 0 HG3 GLU A 99 -5.563 13.982 5.208 1.00 75.40 H new ATOM 1605 N ILE A 100 -6.273 14.217 8.821 1.00 52.33 N ATOM 1606 CA ILE A 100 -6.299 13.003 9.663 1.00 4.23 C ATOM 1607 C ILE A 100 -7.751 12.641 10.083 1.00 44.54 C ATOM 1608 O ILE A 100 -8.127 11.476 10.041 1.00 0.55 O ATOM 1609 CB ILE A 100 -5.378 13.186 10.937 1.00 11.15 C ATOM 1610 CG1 ILE A 100 -3.876 13.321 10.512 1.00 44.10 C ATOM 1611 CG2 ILE A 100 -5.565 12.047 11.969 1.00 10.12 C ATOM 1612 CD1 ILE A 100 -2.889 13.553 11.653 1.00 35.11 C ATOM 0 H ILE A 100 -5.730 14.979 9.226 1.00 52.33 H new ATOM 0 HA ILE A 100 -5.906 12.177 9.070 1.00 4.23 H new ATOM 0 HB ILE A 100 -5.686 14.108 11.431 1.00 11.15 H new ATOM 0 HG12 ILE A 100 -3.584 12.415 9.981 1.00 44.10 H new ATOM 0 HG13 ILE A 100 -3.789 14.147 9.806 1.00 44.10 H new ATOM 0 HG21 ILE A 100 -4.911 12.219 12.824 1.00 10.12 H new ATOM 0 HG22 ILE A 100 -6.602 12.026 12.304 1.00 10.12 H new ATOM 0 HG23 ILE A 100 -5.314 11.092 11.507 1.00 10.12 H new ATOM 0 HD11 ILE A 100 -1.879 13.632 11.250 1.00 35.11 H new ATOM 0 HD12 ILE A 100 -3.145 14.476 12.174 1.00 35.11 H new ATOM 0 HD13 ILE A 100 -2.937 12.717 12.351 1.00 35.11 H new ATOM 1624 N ARG A 101 -8.559 13.656 10.468 1.00 61.40 N ATOM 1625 CA ARG A 101 -9.990 13.462 10.844 1.00 52.44 C ATOM 1626 C ARG A 101 -10.822 12.823 9.709 1.00 52.34 C ATOM 1627 O ARG A 101 -11.716 12.017 9.984 1.00 44.43 O ATOM 1628 CB ARG A 101 -10.649 14.800 11.257 1.00 62.32 C ATOM 1629 CG ARG A 101 -10.026 15.475 12.491 1.00 63.43 C ATOM 1630 CD ARG A 101 -10.592 16.885 12.727 1.00 20.44 C ATOM 1631 NE ARG A 101 -9.829 17.628 13.745 1.00 24.14 N ATOM 1632 CZ ARG A 101 -9.804 18.937 13.867 1.00 33.42 C ATOM 1633 NH1 ARG A 101 -10.515 19.709 13.101 1.00 2.21 N ATOM 1634 NH2 ARG A 101 -9.070 19.470 14.778 1.00 45.01 N ATOM 0 H ARG A 101 -8.247 14.625 10.528 1.00 61.40 H new ATOM 0 HA ARG A 101 -9.984 12.777 11.692 1.00 52.44 H new ATOM 0 HB2 ARG A 101 -10.593 15.491 10.416 1.00 62.32 H new ATOM 0 HB3 ARG A 101 -11.706 14.622 11.453 1.00 62.32 H new ATOM 0 HG2 ARG A 101 -10.209 14.859 13.372 1.00 63.43 H new ATOM 0 HG3 ARG A 101 -8.945 15.535 12.364 1.00 63.43 H new ATOM 0 HD2 ARG A 101 -10.581 17.441 11.789 1.00 20.44 H new ATOM 0 HD3 ARG A 101 -11.633 16.809 13.040 1.00 20.44 H new ATOM 0 HE ARG A 101 -9.276 17.084 14.408 1.00 24.14 H new ATOM 0 HH11 ARG A 101 -11.113 19.303 12.382 1.00 2.21 H new ATOM 0 HH12 ARG A 101 -10.475 20.721 13.219 1.00 2.21 H new ATOM 0 HH21 ARG A 101 -8.515 18.879 15.397 1.00 45.01 H new ATOM 0 HH22 ARG A 101 -9.043 20.484 14.882 1.00 45.01 H new ATOM 1648 N LYS A 102 -10.529 13.196 8.441 1.00 44.24 N ATOM 1649 CA LYS A 102 -11.212 12.604 7.266 1.00 62.02 C ATOM 1650 C LYS A 102 -10.938 11.089 7.186 1.00 25.15 C ATOM 1651 O LYS A 102 -11.868 10.279 7.130 1.00 33.40 O ATOM 1652 CB LYS A 102 -10.746 13.273 5.942 1.00 52.33 C ATOM 1653 CG LYS A 102 -11.407 12.670 4.673 1.00 13.34 C ATOM 1654 CD LYS A 102 -10.862 13.249 3.348 1.00 52.10 C ATOM 1655 CE LYS A 102 -11.040 14.771 3.242 1.00 53.21 C ATOM 1656 NZ LYS A 102 -12.451 15.196 3.439 1.00 0.20 N ATOM 0 H LYS A 102 -9.829 13.900 8.206 1.00 44.24 H new ATOM 0 HA LYS A 102 -12.281 12.778 7.392 1.00 62.02 H new ATOM 0 HB2 LYS A 102 -10.969 14.339 5.986 1.00 52.33 H new ATOM 0 HB3 LYS A 102 -9.664 13.177 5.858 1.00 52.33 H new ATOM 0 HG2 LYS A 102 -11.257 11.590 4.675 1.00 13.34 H new ATOM 0 HG3 LYS A 102 -12.482 12.843 4.718 1.00 13.34 H new ATOM 0 HD2 LYS A 102 -9.803 13.005 3.259 1.00 52.10 H new ATOM 0 HD3 LYS A 102 -11.371 12.770 2.512 1.00 52.10 H new ATOM 0 HE2 LYS A 102 -10.410 15.260 3.985 1.00 53.21 H new ATOM 0 HE3 LYS A 102 -10.697 15.106 2.263 1.00 53.21 H new ATOM 0 HZ1 LYS A 102 -12.535 16.217 3.258 1.00 0.20 H new ATOM 0 HZ2 LYS A 102 -13.065 14.676 2.781 1.00 0.20 H new ATOM 0 HZ3 LYS A 102 -12.741 14.993 4.417 1.00 0.20 H new ATOM 1670 N TYR A 103 -9.645 10.733 7.202 1.00 1.03 N ATOM 1671 CA TYR A 103 -9.196 9.335 7.150 1.00 44.03 C ATOM 1672 C TYR A 103 -9.680 8.512 8.374 1.00 41.34 C ATOM 1673 O TYR A 103 -10.018 7.341 8.233 1.00 34.22 O ATOM 1674 CB TYR A 103 -7.656 9.283 7.007 1.00 43.05 C ATOM 1675 CG TYR A 103 -7.100 9.968 5.734 1.00 53.33 C ATOM 1676 CD1 TYR A 103 -7.779 9.894 4.512 1.00 51.41 C ATOM 1677 CD2 TYR A 103 -5.895 10.681 5.757 1.00 65.44 C ATOM 1678 CE1 TYR A 103 -7.279 10.503 3.374 1.00 33.32 C ATOM 1679 CE2 TYR A 103 -5.390 11.287 4.617 1.00 32.54 C ATOM 1680 CZ TYR A 103 -6.088 11.198 3.430 1.00 12.01 C ATOM 1681 OH TYR A 103 -5.588 11.797 2.286 1.00 30.21 O ATOM 0 H TYR A 103 -8.881 11.407 7.251 1.00 1.03 H new ATOM 0 HA TYR A 103 -9.648 8.871 6.274 1.00 44.03 H new ATOM 0 HB2 TYR A 103 -7.208 9.754 7.882 1.00 43.05 H new ATOM 0 HB3 TYR A 103 -7.340 8.240 7.009 1.00 43.05 H new ATOM 0 HD1 TYR A 103 -8.711 9.351 4.456 1.00 51.41 H new ATOM 0 HD2 TYR A 103 -5.347 10.761 6.684 1.00 65.44 H new ATOM 0 HE1 TYR A 103 -7.821 10.434 2.442 1.00 33.32 H new ATOM 0 HE2 TYR A 103 -4.455 11.826 4.658 1.00 32.54 H new ATOM 0 HH TYR A 103 -4.743 12.247 2.495 1.00 30.21 H new ATOM 1691 N ASN A 104 -9.730 9.138 9.567 1.00 32.21 N ATOM 1692 CA ASN A 104 -10.259 8.507 10.803 1.00 30.42 C ATOM 1693 C ASN A 104 -11.768 8.216 10.684 1.00 33.44 C ATOM 1694 O ASN A 104 -12.253 7.175 11.150 1.00 63.22 O ATOM 1695 CB ASN A 104 -9.982 9.439 12.016 1.00 55.15 C ATOM 1696 CG ASN A 104 -10.345 8.818 13.365 1.00 13.04 C ATOM 1697 OD1 ASN A 104 -11.456 8.976 13.858 1.00 64.03 O ATOM 1698 ND2 ASN A 104 -9.415 8.099 13.966 1.00 34.22 N ATOM 0 H ASN A 104 -9.406 10.095 9.706 1.00 32.21 H new ATOM 0 HA ASN A 104 -9.752 7.554 10.950 1.00 30.42 H new ATOM 0 HB2 ASN A 104 -8.926 9.708 12.022 1.00 55.15 H new ATOM 0 HB3 ASN A 104 -10.545 10.363 11.888 1.00 55.15 H new ATOM 0 HD21 ASN A 104 -9.613 7.658 14.864 1.00 34.22 H new ATOM 0 HD22 ASN A 104 -8.499 7.985 13.532 1.00 34.22 H new ATOM 1705 N GLN A 105 -12.493 9.157 10.053 1.00 24.14 N ATOM 1706 CA GLN A 105 -13.934 9.013 9.783 1.00 75.13 C ATOM 1707 C GLN A 105 -14.192 7.810 8.848 1.00 5.44 C ATOM 1708 O GLN A 105 -15.162 7.076 9.037 1.00 61.43 O ATOM 1709 CB GLN A 105 -14.511 10.322 9.168 1.00 51.45 C ATOM 1710 CG GLN A 105 -16.047 10.337 8.983 1.00 43.23 C ATOM 1711 CD GLN A 105 -16.818 10.247 10.306 1.00 53.20 C ATOM 1712 OE1 GLN A 105 -17.091 9.038 10.763 1.00 15.40 O flip ATOM 1713 NE2 GLN A 105 -17.148 11.256 10.921 1.00 70.23 N flip ATOM 0 H GLN A 105 -12.098 10.035 9.717 1.00 24.14 H new ATOM 0 HA GLN A 105 -14.444 8.828 10.728 1.00 75.13 H new ATOM 0 HB2 GLN A 105 -14.229 11.160 9.805 1.00 51.45 H new ATOM 0 HB3 GLN A 105 -14.042 10.487 8.198 1.00 51.45 H new ATOM 0 HG2 GLN A 105 -16.335 11.251 8.464 1.00 43.23 H new ATOM 0 HG3 GLN A 105 -16.337 9.503 8.344 1.00 43.23 H new ATOM 0 HE21 GLN A 105 -16.925 12.178 10.546 1.00 70.23 H new ATOM 0 HE22 GLN A 105 -17.646 11.173 11.808 1.00 70.23 H new ATOM 1722 N ILE A 106 -13.296 7.616 7.856 1.00 44.24 N ATOM 1723 CA ILE A 106 -13.340 6.466 6.927 1.00 53.34 C ATOM 1724 C ILE A 106 -13.112 5.125 7.678 1.00 60.34 C ATOM 1725 O ILE A 106 -13.887 4.184 7.502 1.00 3.31 O ATOM 1726 CB ILE A 106 -12.274 6.642 5.777 1.00 2.00 C ATOM 1727 CG1 ILE A 106 -12.536 7.966 4.975 1.00 40.34 C ATOM 1728 CG2 ILE A 106 -12.240 5.412 4.837 1.00 22.42 C ATOM 1729 CD1 ILE A 106 -11.451 8.348 3.969 1.00 70.11 C ATOM 0 H ILE A 106 -12.520 8.254 7.677 1.00 44.24 H new ATOM 0 HA ILE A 106 -14.334 6.436 6.481 1.00 53.34 H new ATOM 0 HB ILE A 106 -11.291 6.717 6.243 1.00 2.00 H new ATOM 0 HG12 ILE A 106 -13.482 7.868 4.443 1.00 40.34 H new ATOM 0 HG13 ILE A 106 -12.653 8.784 5.686 1.00 40.34 H new ATOM 0 HG21 ILE A 106 -11.494 5.570 4.058 1.00 22.42 H new ATOM 0 HG22 ILE A 106 -11.982 4.522 5.411 1.00 22.42 H new ATOM 0 HG23 ILE A 106 -13.220 5.277 4.379 1.00 22.42 H new ATOM 0 HD11 ILE A 106 -11.729 9.276 3.469 1.00 70.11 H new ATOM 0 HD12 ILE A 106 -10.504 8.486 4.490 1.00 70.11 H new ATOM 0 HD13 ILE A 106 -11.346 7.555 3.229 1.00 70.11 H new ATOM 1741 N LEU A 107 -12.059 5.066 8.527 1.00 50.45 N ATOM 1742 CA LEU A 107 -11.767 3.877 9.386 1.00 34.32 C ATOM 1743 C LEU A 107 -12.983 3.486 10.279 1.00 52.42 C ATOM 1744 O LEU A 107 -13.248 2.299 10.498 1.00 2.20 O ATOM 1745 CB LEU A 107 -10.493 4.108 10.277 1.00 32.34 C ATOM 1746 CG LEU A 107 -9.116 3.640 9.695 1.00 32.04 C ATOM 1747 CD1 LEU A 107 -9.148 2.157 9.279 1.00 75.02 C ATOM 1748 CD2 LEU A 107 -8.650 4.542 8.549 1.00 61.23 C ATOM 0 H LEU A 107 -11.391 5.828 8.641 1.00 50.45 H new ATOM 0 HA LEU A 107 -11.569 3.047 8.707 1.00 34.32 H new ATOM 0 HB2 LEU A 107 -10.423 5.174 10.495 1.00 32.34 H new ATOM 0 HB3 LEU A 107 -10.649 3.598 11.227 1.00 32.34 H new ATOM 0 HG LEU A 107 -8.381 3.732 10.494 1.00 32.04 H new ATOM 0 HD11 LEU A 107 -8.175 1.870 8.880 1.00 75.02 H new ATOM 0 HD12 LEU A 107 -9.381 1.540 10.147 1.00 75.02 H new ATOM 0 HD13 LEU A 107 -9.911 2.010 8.515 1.00 75.02 H new ATOM 0 HD21 LEU A 107 -7.692 4.185 8.172 1.00 61.23 H new ATOM 0 HD22 LEU A 107 -9.387 4.520 7.746 1.00 61.23 H new ATOM 0 HD23 LEU A 107 -8.539 5.564 8.912 1.00 61.23 H new ATOM 1760 N ALA A 108 -13.712 4.501 10.774 1.00 51.41 N ATOM 1761 CA ALA A 108 -14.907 4.301 11.626 1.00 30.04 C ATOM 1762 C ALA A 108 -16.124 3.795 10.806 1.00 12.13 C ATOM 1763 O ALA A 108 -16.796 2.823 11.190 1.00 1.23 O ATOM 1764 CB ALA A 108 -15.248 5.614 12.344 1.00 62.34 C ATOM 0 H ALA A 108 -13.494 5.482 10.598 1.00 51.41 H new ATOM 0 HA ALA A 108 -14.676 3.531 12.362 1.00 30.04 H new ATOM 0 HB1 ALA A 108 -16.127 5.468 12.971 1.00 62.34 H new ATOM 0 HB2 ALA A 108 -14.406 5.918 12.965 1.00 62.34 H new ATOM 0 HB3 ALA A 108 -15.454 6.389 11.606 1.00 62.34 H new ATOM 1770 N THR A 109 -16.388 4.476 9.677 1.00 22.32 N ATOM 1771 CA THR A 109 -17.546 4.181 8.803 1.00 24.54 C ATOM 1772 C THR A 109 -17.318 2.919 7.922 1.00 73.12 C ATOM 1773 O THR A 109 -17.920 1.873 8.168 1.00 34.01 O ATOM 1774 CB THR A 109 -17.918 5.415 7.900 1.00 63.44 C ATOM 1775 OG1 THR A 109 -16.787 5.810 7.094 1.00 44.22 O ATOM 1776 CG2 THR A 109 -18.405 6.620 8.734 1.00 23.32 C ATOM 0 H THR A 109 -15.808 5.245 9.342 1.00 22.32 H new ATOM 0 HA THR A 109 -18.384 3.972 9.468 1.00 24.54 H new ATOM 0 HB THR A 109 -18.738 5.101 7.253 1.00 63.44 H new ATOM 0 HG1 THR A 109 -16.138 6.287 7.652 1.00 44.22 H new ATOM 0 HG21 THR A 109 -18.650 7.448 8.069 1.00 23.32 H new ATOM 0 HG22 THR A 109 -19.291 6.336 9.301 1.00 23.32 H new ATOM 0 HG23 THR A 109 -17.618 6.928 9.422 1.00 23.32 H new ATOM 1784 N GLN A 110 -16.443 3.024 6.909 1.00 41.54 N ATOM 1785 CA GLN A 110 -16.252 1.973 5.880 1.00 20.45 C ATOM 1786 C GLN A 110 -15.163 0.947 6.292 1.00 32.53 C ATOM 1787 O GLN A 110 -15.402 -0.271 6.278 1.00 22.40 O ATOM 1788 CB GLN A 110 -15.886 2.663 4.541 1.00 21.24 C ATOM 1789 CG GLN A 110 -16.927 3.700 4.062 1.00 14.35 C ATOM 1790 CD GLN A 110 -16.480 4.467 2.818 1.00 70.12 C ATOM 1791 OE1 GLN A 110 -16.761 4.076 1.691 1.00 23.11 O ATOM 1792 NE2 GLN A 110 -15.757 5.553 3.015 1.00 2.10 N ATOM 0 H GLN A 110 -15.844 3.839 6.775 1.00 41.54 H new ATOM 0 HA GLN A 110 -17.178 1.409 5.771 1.00 20.45 H new ATOM 0 HB2 GLN A 110 -14.921 3.157 4.651 1.00 21.24 H new ATOM 0 HB3 GLN A 110 -15.768 1.900 3.772 1.00 21.24 H new ATOM 0 HG2 GLN A 110 -17.867 3.191 3.849 1.00 14.35 H new ATOM 0 HG3 GLN A 110 -17.123 4.408 4.867 1.00 14.35 H new ATOM 0 HE21 GLN A 110 -15.538 5.855 3.964 1.00 2.10 H new ATOM 0 HE22 GLN A 110 -15.417 6.091 2.218 1.00 2.10 H new ATOM 1801 N GLY A 111 -13.966 1.453 6.633 1.00 11.23 N ATOM 1802 CA GLY A 111 -12.853 0.613 7.110 1.00 33.40 C ATOM 1803 C GLY A 111 -11.499 0.928 6.460 1.00 34.43 C ATOM 1804 O GLY A 111 -11.284 2.031 5.931 1.00 4.02 O ATOM 0 H GLY A 111 -13.743 2.447 6.587 1.00 11.23 H new ATOM 0 HA2 GLY A 111 -12.761 0.732 8.190 1.00 33.40 H new ATOM 0 HA3 GLY A 111 -13.097 -0.433 6.924 1.00 33.40 H new ATOM 1808 N ILE A 112 -10.587 -0.068 6.501 1.00 32.22 N ATOM 1809 CA ILE A 112 -9.183 0.091 6.060 1.00 73.10 C ATOM 1810 C ILE A 112 -9.042 0.078 4.515 1.00 32.21 C ATOM 1811 O ILE A 112 -8.243 0.832 3.970 1.00 43.12 O ATOM 1812 CB ILE A 112 -8.247 -1.008 6.702 1.00 4.32 C ATOM 1813 CG1 ILE A 112 -6.741 -0.775 6.322 1.00 40.20 C ATOM 1814 CG2 ILE A 112 -8.710 -2.438 6.323 1.00 51.03 C ATOM 1815 CD1 ILE A 112 -6.117 0.471 6.923 1.00 32.23 C ATOM 0 H ILE A 112 -10.803 -1.005 6.841 1.00 32.22 H new ATOM 0 HA ILE A 112 -8.863 1.071 6.412 1.00 73.10 H new ATOM 0 HB ILE A 112 -8.329 -0.913 7.785 1.00 4.32 H new ATOM 0 HG12 ILE A 112 -6.163 -1.643 6.639 1.00 40.20 H new ATOM 0 HG13 ILE A 112 -6.660 -0.717 5.237 1.00 40.20 H new ATOM 0 HG21 ILE A 112 -8.044 -3.169 6.781 1.00 51.03 H new ATOM 0 HG22 ILE A 112 -9.727 -2.598 6.681 1.00 51.03 H new ATOM 0 HG23 ILE A 112 -8.685 -2.553 5.239 1.00 51.03 H new ATOM 0 HD11 ILE A 112 -5.077 0.547 6.605 1.00 32.23 H new ATOM 0 HD12 ILE A 112 -6.665 1.351 6.586 1.00 32.23 H new ATOM 0 HD13 ILE A 112 -6.160 0.411 8.011 1.00 32.23 H new ATOM 1827 N ARG A 113 -9.831 -0.761 3.812 1.00 34.03 N ATOM 1828 CA ARG A 113 -9.733 -0.890 2.328 1.00 73.43 C ATOM 1829 C ARG A 113 -10.160 0.414 1.616 1.00 75.40 C ATOM 1830 O ARG A 113 -9.637 0.758 0.550 1.00 41.03 O ATOM 1831 CB ARG A 113 -10.595 -2.072 1.822 1.00 64.12 C ATOM 1832 CG ARG A 113 -10.251 -3.442 2.447 1.00 51.22 C ATOM 1833 CD ARG A 113 -8.761 -3.820 2.312 1.00 24.34 C ATOM 1834 NE ARG A 113 -8.515 -5.234 2.658 1.00 44.32 N ATOM 1835 CZ ARG A 113 -7.777 -5.674 3.654 1.00 55.03 C ATOM 1836 NH1 ARG A 113 -7.159 -4.861 4.464 1.00 14.34 N ATOM 1837 NH2 ARG A 113 -7.664 -6.949 3.827 1.00 51.12 N ATOM 0 H ARG A 113 -10.540 -1.358 4.237 1.00 34.03 H new ATOM 0 HA ARG A 113 -8.688 -1.084 2.088 1.00 73.43 H new ATOM 0 HB2 ARG A 113 -11.643 -1.850 2.023 1.00 64.12 H new ATOM 0 HB3 ARG A 113 -10.486 -2.145 0.740 1.00 64.12 H new ATOM 0 HG2 ARG A 113 -10.521 -3.429 3.503 1.00 51.22 H new ATOM 0 HG3 ARG A 113 -10.858 -4.213 1.972 1.00 51.22 H new ATOM 0 HD2 ARG A 113 -8.431 -3.634 1.290 1.00 24.34 H new ATOM 0 HD3 ARG A 113 -8.164 -3.179 2.961 1.00 24.34 H new ATOM 0 HE ARG A 113 -8.960 -5.937 2.068 1.00 44.32 H new ATOM 0 HH11 ARG A 113 -7.240 -3.853 4.335 1.00 14.34 H new ATOM 0 HH12 ARG A 113 -6.594 -5.233 5.227 1.00 14.34 H new ATOM 0 HH21 ARG A 113 -8.142 -7.593 3.197 1.00 51.12 H new ATOM 0 HH22 ARG A 113 -7.097 -7.311 4.593 1.00 51.12 H new ATOM 1851 N ALA A 114 -11.097 1.127 2.255 1.00 71.14 N ATOM 1852 CA ALA A 114 -11.598 2.428 1.780 1.00 62.41 C ATOM 1853 C ALA A 114 -10.574 3.549 2.077 1.00 73.04 C ATOM 1854 O ALA A 114 -10.480 4.518 1.327 1.00 3.34 O ATOM 1855 CB ALA A 114 -12.950 2.731 2.426 1.00 52.05 C ATOM 0 H ALA A 114 -11.533 0.817 3.123 1.00 71.14 H new ATOM 0 HA ALA A 114 -11.734 2.382 0.699 1.00 62.41 H new ATOM 0 HB1 ALA A 114 -13.315 3.695 2.071 1.00 52.05 H new ATOM 0 HB2 ALA A 114 -13.664 1.952 2.159 1.00 52.05 H new ATOM 0 HB3 ALA A 114 -12.836 2.763 3.510 1.00 52.05 H new ATOM 1861 N PHE A 115 -9.820 3.393 3.189 1.00 33.41 N ATOM 1862 CA PHE A 115 -8.699 4.290 3.561 1.00 24.25 C ATOM 1863 C PHE A 115 -7.526 4.159 2.559 1.00 34.52 C ATOM 1864 O PHE A 115 -6.974 5.169 2.114 1.00 25.22 O ATOM 1865 CB PHE A 115 -8.241 3.960 5.012 1.00 54.35 C ATOM 1866 CG PHE A 115 -6.876 4.534 5.438 1.00 21.24 C ATOM 1867 CD1 PHE A 115 -6.707 5.891 5.713 1.00 64.25 C ATOM 1868 CD2 PHE A 115 -5.766 3.697 5.575 1.00 63.55 C ATOM 1869 CE1 PHE A 115 -5.471 6.386 6.104 1.00 14.23 C ATOM 1870 CE2 PHE A 115 -4.538 4.189 5.965 1.00 12.04 C ATOM 1871 CZ PHE A 115 -4.391 5.535 6.233 1.00 1.22 C ATOM 0 H PHE A 115 -9.972 2.638 3.858 1.00 33.41 H new ATOM 0 HA PHE A 115 -9.039 5.325 3.522 1.00 24.25 H new ATOM 0 HB2 PHE A 115 -8.999 4.328 5.703 1.00 54.35 H new ATOM 0 HB3 PHE A 115 -8.207 2.876 5.123 1.00 54.35 H new ATOM 0 HD1 PHE A 115 -7.547 6.564 5.621 1.00 64.25 H new ATOM 0 HD2 PHE A 115 -5.872 2.642 5.371 1.00 63.55 H new ATOM 0 HE1 PHE A 115 -5.353 7.440 6.308 1.00 14.23 H new ATOM 0 HE2 PHE A 115 -3.693 3.523 6.060 1.00 12.04 H new ATOM 0 HZ PHE A 115 -3.432 5.922 6.543 1.00 1.22 H new ATOM 1881 N ILE A 116 -7.163 2.909 2.215 1.00 11.21 N ATOM 1882 CA ILE A 116 -6.062 2.624 1.273 1.00 65.44 C ATOM 1883 C ILE A 116 -6.404 3.173 -0.126 1.00 20.45 C ATOM 1884 O ILE A 116 -5.640 3.966 -0.674 1.00 63.01 O ATOM 1885 CB ILE A 116 -5.734 1.088 1.193 1.00 52.33 C ATOM 1886 CG1 ILE A 116 -5.294 0.540 2.588 1.00 22.10 C ATOM 1887 CG2 ILE A 116 -4.659 0.785 0.112 1.00 1.33 C ATOM 1888 CD1 ILE A 116 -4.038 1.181 3.165 1.00 31.41 C ATOM 0 H ILE A 116 -7.620 2.073 2.579 1.00 11.21 H new ATOM 0 HA ILE A 116 -5.171 3.126 1.650 1.00 65.44 H new ATOM 0 HB ILE A 116 -6.648 0.573 0.896 1.00 52.33 H new ATOM 0 HG12 ILE A 116 -6.113 0.683 3.293 1.00 22.10 H new ATOM 0 HG13 ILE A 116 -5.130 -0.534 2.504 1.00 22.10 H new ATOM 0 HG21 ILE A 116 -4.460 -0.286 0.087 1.00 1.33 H new ATOM 0 HG22 ILE A 116 -5.022 1.109 -0.863 1.00 1.33 H new ATOM 0 HG23 ILE A 116 -3.740 1.320 0.353 1.00 1.33 H new ATOM 0 HD11 ILE A 116 -3.814 0.735 4.134 1.00 31.41 H new ATOM 0 HD12 ILE A 116 -3.201 1.016 2.487 1.00 31.41 H new ATOM 0 HD13 ILE A 116 -4.200 2.252 3.288 1.00 31.41 H new ATOM 1900 N ASN A 117 -7.564 2.752 -0.678 1.00 24.30 N ATOM 1901 CA ASN A 117 -8.104 3.300 -1.949 1.00 50.22 C ATOM 1902 C ASN A 117 -8.175 4.854 -1.937 1.00 3.11 C ATOM 1903 O ASN A 117 -7.887 5.492 -2.949 1.00 45.13 O ATOM 1904 CB ASN A 117 -9.503 2.698 -2.244 1.00 73.33 C ATOM 1905 CG ASN A 117 -10.099 3.181 -3.579 1.00 52.33 C ATOM 1906 OD1 ASN A 117 -10.805 4.179 -3.632 1.00 2.11 O ATOM 1907 ND2 ASN A 117 -9.818 2.490 -4.671 1.00 34.31 N ATOM 0 H ASN A 117 -8.150 2.029 -0.261 1.00 24.30 H new ATOM 0 HA ASN A 117 -7.415 3.014 -2.744 1.00 50.22 H new ATOM 0 HB2 ASN A 117 -9.428 1.611 -2.259 1.00 73.33 H new ATOM 0 HB3 ASN A 117 -10.183 2.960 -1.433 1.00 73.33 H new ATOM 0 HD21 ASN A 117 -10.191 2.787 -5.573 1.00 34.31 H new ATOM 0 HD22 ASN A 117 -9.228 1.660 -4.612 1.00 34.31 H new ATOM 1914 N ALA A 118 -8.546 5.448 -0.780 1.00 32.11 N ATOM 1915 CA ALA A 118 -8.565 6.926 -0.609 1.00 53.21 C ATOM 1916 C ALA A 118 -7.158 7.545 -0.796 1.00 45.03 C ATOM 1917 O ALA A 118 -7.032 8.619 -1.376 1.00 23.10 O ATOM 1918 CB ALA A 118 -9.135 7.319 0.762 1.00 25.11 C ATOM 0 H ALA A 118 -8.836 4.931 0.050 1.00 32.11 H new ATOM 0 HA ALA A 118 -9.216 7.326 -1.386 1.00 53.21 H new ATOM 0 HB1 ALA A 118 -9.136 8.405 0.858 1.00 25.11 H new ATOM 0 HB2 ALA A 118 -10.155 6.946 0.853 1.00 25.11 H new ATOM 0 HB3 ALA A 118 -8.519 6.886 1.550 1.00 25.11 H new ATOM 1924 N LEU A 119 -6.111 6.852 -0.292 1.00 2.23 N ATOM 1925 CA LEU A 119 -4.699 7.271 -0.465 1.00 21.11 C ATOM 1926 C LEU A 119 -4.227 7.116 -1.932 1.00 13.25 C ATOM 1927 O LEU A 119 -3.504 7.970 -2.440 1.00 12.41 O ATOM 1928 CB LEU A 119 -3.761 6.460 0.472 1.00 4.12 C ATOM 1929 CG LEU A 119 -4.032 6.579 2.004 1.00 14.55 C ATOM 1930 CD1 LEU A 119 -3.035 5.714 2.802 1.00 72.23 C ATOM 1931 CD2 LEU A 119 -4.010 8.056 2.475 1.00 64.34 C ATOM 0 H LEU A 119 -6.219 5.991 0.244 1.00 2.23 H new ATOM 0 HA LEU A 119 -4.648 8.327 -0.199 1.00 21.11 H new ATOM 0 HB2 LEU A 119 -3.829 5.408 0.195 1.00 4.12 H new ATOM 0 HB3 LEU A 119 -2.735 6.774 0.282 1.00 4.12 H new ATOM 0 HG LEU A 119 -5.035 6.199 2.197 1.00 14.55 H new ATOM 0 HD11 LEU A 119 -3.241 5.811 3.868 1.00 72.23 H new ATOM 0 HD12 LEU A 119 -3.140 4.670 2.506 1.00 72.23 H new ATOM 0 HD13 LEU A 119 -2.018 6.048 2.597 1.00 72.23 H new ATOM 0 HD21 LEU A 119 -4.203 8.099 3.547 1.00 64.34 H new ATOM 0 HD22 LEU A 119 -3.033 8.491 2.264 1.00 64.34 H new ATOM 0 HD23 LEU A 119 -4.779 8.618 1.945 1.00 64.34 H new ATOM 1943 N VAL A 120 -4.652 6.023 -2.601 1.00 70.34 N ATOM 1944 CA VAL A 120 -4.278 5.744 -4.014 1.00 30.24 C ATOM 1945 C VAL A 120 -4.920 6.788 -4.965 1.00 51.31 C ATOM 1946 O VAL A 120 -4.276 7.305 -5.886 1.00 60.04 O ATOM 1947 CB VAL A 120 -4.699 4.289 -4.467 1.00 11.33 C ATOM 1948 CG1 VAL A 120 -4.104 3.922 -5.852 1.00 62.33 C ATOM 1949 CG2 VAL A 120 -4.282 3.243 -3.423 1.00 21.25 C ATOM 0 H VAL A 120 -5.257 5.314 -2.188 1.00 70.34 H new ATOM 0 HA VAL A 120 -3.192 5.814 -4.072 1.00 30.24 H new ATOM 0 HB VAL A 120 -5.786 4.286 -4.554 1.00 11.33 H new ATOM 0 HG11 VAL A 120 -4.417 2.915 -6.127 1.00 62.33 H new ATOM 0 HG12 VAL A 120 -4.461 4.630 -6.600 1.00 62.33 H new ATOM 0 HG13 VAL A 120 -3.016 3.963 -5.803 1.00 62.33 H new ATOM 0 HG21 VAL A 120 -4.584 2.252 -3.761 1.00 21.25 H new ATOM 0 HG22 VAL A 120 -3.200 3.269 -3.294 1.00 21.25 H new ATOM 0 HG23 VAL A 120 -4.766 3.465 -2.472 1.00 21.25 H new ATOM 1959 N ASN A 121 -6.191 7.110 -4.689 1.00 51.23 N ATOM 1960 CA ASN A 121 -6.999 8.050 -5.498 1.00 51.51 C ATOM 1961 C ASN A 121 -6.798 9.518 -5.032 1.00 53.43 C ATOM 1962 O ASN A 121 -7.253 10.441 -5.708 1.00 60.44 O ATOM 1963 CB ASN A 121 -8.510 7.664 -5.440 1.00 64.31 C ATOM 1964 CG ASN A 121 -8.863 6.300 -6.068 1.00 33.35 C ATOM 1965 OD1 ASN A 121 -8.013 5.301 -5.920 1.00 73.32 O flip ATOM 1966 ND2 ASN A 121 -9.928 6.137 -6.660 1.00 34.14 N flip ATOM 0 H ASN A 121 -6.697 6.725 -3.892 1.00 51.23 H new ATOM 0 HA ASN A 121 -6.657 7.977 -6.530 1.00 51.51 H new ATOM 0 HB2 ASN A 121 -8.828 7.659 -4.397 1.00 64.31 H new ATOM 0 HB3 ASN A 121 -9.086 8.439 -5.945 1.00 64.31 H new ATOM 0 HD21 ASN A 121 -10.576 6.917 -6.768 1.00 34.14 H new ATOM 0 HD22 ASN A 121 -10.163 5.222 -7.044 1.00 34.14 H new ATOM 1973 N SER A 122 -6.119 9.719 -3.872 1.00 75.41 N ATOM 1974 CA SER A 122 -5.780 11.068 -3.349 1.00 53.30 C ATOM 1975 C SER A 122 -4.952 11.871 -4.362 1.00 54.50 C ATOM 1976 O SER A 122 -4.104 11.305 -5.057 1.00 14.23 O ATOM 1977 CB SER A 122 -4.985 10.961 -2.025 1.00 24.00 C ATOM 1978 OG SER A 122 -4.718 12.240 -1.470 1.00 11.55 O ATOM 0 H SER A 122 -5.794 8.957 -3.278 1.00 75.41 H new ATOM 0 HA SER A 122 -6.722 11.586 -3.170 1.00 53.30 H new ATOM 0 HB2 SER A 122 -5.549 10.364 -1.309 1.00 24.00 H new ATOM 0 HB3 SER A 122 -4.045 10.439 -2.206 1.00 24.00 H new ATOM 0 HG SER A 122 -4.217 12.136 -0.634 1.00 11.55 H new ATOM 1984 N GLN A 123 -5.155 13.199 -4.382 1.00 43.33 N ATOM 1985 CA GLN A 123 -4.520 14.096 -5.376 1.00 34.52 C ATOM 1986 C GLN A 123 -3.000 14.197 -5.117 1.00 34.32 C ATOM 1987 O GLN A 123 -2.195 14.187 -6.054 1.00 54.41 O ATOM 1988 CB GLN A 123 -5.197 15.496 -5.341 1.00 73.34 C ATOM 1989 CG GLN A 123 -5.255 16.154 -3.941 1.00 2.31 C ATOM 1990 CD GLN A 123 -5.909 17.537 -3.928 1.00 71.20 C ATOM 1991 OE1 GLN A 123 -6.770 17.848 -4.744 1.00 14.24 O ATOM 1992 NE2 GLN A 123 -5.511 18.370 -2.989 1.00 11.54 N ATOM 0 H GLN A 123 -5.758 13.683 -3.717 1.00 43.33 H new ATOM 0 HA GLN A 123 -4.659 13.679 -6.373 1.00 34.52 H new ATOM 0 HB2 GLN A 123 -4.660 16.161 -6.017 1.00 73.34 H new ATOM 0 HB3 GLN A 123 -6.213 15.403 -5.726 1.00 73.34 H new ATOM 0 HG2 GLN A 123 -5.804 15.498 -3.265 1.00 2.31 H new ATOM 0 HG3 GLN A 123 -4.241 16.239 -3.549 1.00 2.31 H new ATOM 0 HE21 GLN A 123 -4.793 18.083 -2.324 1.00 11.54 H new ATOM 0 HE22 GLN A 123 -5.921 19.302 -2.927 1.00 11.54 H new ATOM 2001 N GLU A 124 -2.634 14.224 -3.820 1.00 25.51 N ATOM 2002 CA GLU A 124 -1.232 14.328 -3.355 1.00 31.05 C ATOM 2003 C GLU A 124 -0.380 13.127 -3.828 1.00 53.43 C ATOM 2004 O GLU A 124 0.792 13.275 -4.168 1.00 30.24 O ATOM 2005 CB GLU A 124 -1.204 14.421 -1.805 1.00 41.32 C ATOM 2006 CG GLU A 124 -2.047 15.570 -1.208 1.00 3.32 C ATOM 2007 CD GLU A 124 -1.689 16.954 -1.780 1.00 53.32 C ATOM 2008 OE1 GLU A 124 -0.539 17.405 -1.590 1.00 14.20 O ATOM 2009 OE2 GLU A 124 -2.554 17.600 -2.409 1.00 62.34 O ATOM 0 H GLU A 124 -3.308 14.174 -3.056 1.00 25.51 H new ATOM 0 HA GLU A 124 -0.799 15.230 -3.788 1.00 31.05 H new ATOM 0 HB2 GLU A 124 -1.559 13.477 -1.392 1.00 41.32 H new ATOM 0 HB3 GLU A 124 -0.170 14.542 -1.481 1.00 41.32 H new ATOM 0 HG2 GLU A 124 -3.102 15.371 -1.394 1.00 3.32 H new ATOM 0 HG3 GLU A 124 -1.911 15.586 -0.127 1.00 3.32 H new ATOM 2016 N TYR A 125 -0.986 11.935 -3.813 1.00 65.11 N ATOM 2017 CA TYR A 125 -0.368 10.698 -4.331 1.00 45.22 C ATOM 2018 C TYR A 125 -0.412 10.648 -5.877 1.00 51.45 C ATOM 2019 O TYR A 125 0.560 10.268 -6.529 1.00 52.01 O ATOM 2020 CB TYR A 125 -1.116 9.483 -3.736 1.00 75.54 C ATOM 2021 CG TYR A 125 -0.487 8.103 -4.019 1.00 55.53 C ATOM 2022 CD1 TYR A 125 0.721 7.738 -3.431 1.00 64.04 C ATOM 2023 CD2 TYR A 125 -1.113 7.165 -4.841 1.00 45.34 C ATOM 2024 CE1 TYR A 125 1.280 6.496 -3.648 1.00 31.52 C ATOM 2025 CE2 TYR A 125 -0.557 5.921 -5.060 1.00 63.33 C ATOM 2026 CZ TYR A 125 0.638 5.593 -4.460 1.00 72.13 C ATOM 2027 OH TYR A 125 1.198 4.356 -4.681 1.00 3.10 O ATOM 0 H TYR A 125 -1.925 11.795 -3.440 1.00 65.11 H new ATOM 0 HA TYR A 125 0.681 10.676 -4.034 1.00 45.22 H new ATOM 0 HB2 TYR A 125 -1.184 9.616 -2.656 1.00 75.54 H new ATOM 0 HB3 TYR A 125 -2.135 9.483 -4.122 1.00 75.54 H new ATOM 0 HD1 TYR A 125 1.231 8.443 -2.791 1.00 64.04 H new ATOM 0 HD2 TYR A 125 -2.050 7.417 -5.315 1.00 45.34 H new ATOM 0 HE1 TYR A 125 2.218 6.235 -3.182 1.00 31.52 H new ATOM 0 HE2 TYR A 125 -1.057 5.208 -5.699 1.00 63.33 H new ATOM 0 HH TYR A 125 1.595 4.332 -5.577 1.00 3.10 H new ATOM 2037 N ASN A 126 -1.558 11.056 -6.442 1.00 1.21 N ATOM 2038 CA ASN A 126 -1.905 10.784 -7.854 1.00 53.51 C ATOM 2039 C ASN A 126 -0.997 11.533 -8.860 1.00 52.14 C ATOM 2040 O ASN A 126 -0.404 10.906 -9.745 1.00 41.44 O ATOM 2041 CB ASN A 126 -3.402 11.111 -8.108 1.00 53.34 C ATOM 2042 CG ASN A 126 -3.937 10.530 -9.418 1.00 71.15 C ATOM 2043 OD1 ASN A 126 -3.446 9.524 -9.905 1.00 25.05 O ATOM 2044 ND2 ASN A 126 -4.971 11.121 -9.974 1.00 62.33 N ATOM 0 H ASN A 126 -2.272 11.583 -5.939 1.00 1.21 H new ATOM 0 HA ASN A 126 -1.732 9.721 -8.025 1.00 53.51 H new ATOM 0 HB2 ASN A 126 -3.996 10.726 -7.279 1.00 53.34 H new ATOM 0 HB3 ASN A 126 -3.533 12.193 -8.119 1.00 53.34 H new ATOM 0 HD21 ASN A 126 -5.378 10.740 -10.828 1.00 62.33 H new ATOM 0 HD22 ASN A 126 -5.367 11.961 -9.551 1.00 62.33 H new ATOM 2051 N GLU A 127 -0.852 12.858 -8.690 1.00 72.00 N ATOM 2052 CA GLU A 127 -0.155 13.726 -9.678 1.00 64.14 C ATOM 2053 C GLU A 127 1.352 13.870 -9.375 1.00 63.11 C ATOM 2054 O GLU A 127 2.149 14.133 -10.281 1.00 1.22 O ATOM 2055 CB GLU A 127 -0.836 15.117 -9.729 1.00 71.10 C ATOM 2056 CG GLU A 127 -0.824 15.907 -8.400 1.00 52.13 C ATOM 2057 CD GLU A 127 -1.702 17.168 -8.445 1.00 65.21 C ATOM 2058 OE1 GLU A 127 -1.253 18.199 -8.992 1.00 40.21 O ATOM 2059 OE2 GLU A 127 -2.860 17.117 -7.976 1.00 31.53 O ATOM 0 H GLU A 127 -1.207 13.361 -7.877 1.00 72.00 H new ATOM 0 HA GLU A 127 -0.236 13.245 -10.653 1.00 64.14 H new ATOM 0 HB2 GLU A 127 -0.343 15.717 -10.494 1.00 71.10 H new ATOM 0 HB3 GLU A 127 -1.871 14.985 -10.045 1.00 71.10 H new ATOM 0 HG2 GLU A 127 -1.169 15.259 -7.595 1.00 52.13 H new ATOM 0 HG3 GLU A 127 0.201 16.192 -8.162 1.00 52.13 H new ATOM 2066 N VAL A 128 1.731 13.712 -8.098 1.00 4.51 N ATOM 2067 CA VAL A 128 3.138 13.819 -7.660 1.00 30.32 C ATOM 2068 C VAL A 128 3.915 12.519 -7.988 1.00 40.54 C ATOM 2069 O VAL A 128 4.986 12.557 -8.594 1.00 51.51 O ATOM 2070 CB VAL A 128 3.213 14.136 -6.121 1.00 60.23 C ATOM 2071 CG1 VAL A 128 4.670 14.120 -5.592 1.00 63.12 C ATOM 2072 CG2 VAL A 128 2.512 15.488 -5.810 1.00 72.55 C ATOM 0 H VAL A 128 1.078 13.508 -7.341 1.00 4.51 H new ATOM 0 HA VAL A 128 3.605 14.640 -8.204 1.00 30.32 H new ATOM 0 HB VAL A 128 2.681 13.343 -5.595 1.00 60.23 H new ATOM 0 HG11 VAL A 128 4.672 14.344 -4.525 1.00 63.12 H new ATOM 0 HG12 VAL A 128 5.106 13.135 -5.757 1.00 63.12 H new ATOM 0 HG13 VAL A 128 5.258 14.870 -6.122 1.00 63.12 H new ATOM 0 HG21 VAL A 128 2.573 15.692 -4.741 1.00 72.55 H new ATOM 0 HG22 VAL A 128 3.005 16.289 -6.361 1.00 72.55 H new ATOM 0 HG23 VAL A 128 1.465 15.433 -6.110 1.00 72.55 H new ATOM 2082 N PHE A 129 3.348 11.374 -7.584 1.00 64.31 N ATOM 2083 CA PHE A 129 3.958 10.038 -7.792 1.00 31.42 C ATOM 2084 C PHE A 129 3.702 9.496 -9.238 1.00 14.12 C ATOM 2085 O PHE A 129 4.626 8.979 -9.879 1.00 12.11 O ATOM 2086 CB PHE A 129 3.453 9.063 -6.669 1.00 71.22 C ATOM 2087 CG PHE A 129 3.312 7.593 -7.070 1.00 52.24 C ATOM 2088 CD1 PHE A 129 4.422 6.776 -7.203 1.00 45.13 C ATOM 2089 CD2 PHE A 129 2.060 7.040 -7.333 1.00 45.42 C ATOM 2090 CE1 PHE A 129 4.284 5.464 -7.585 1.00 32.42 C ATOM 2091 CE2 PHE A 129 1.932 5.720 -7.712 1.00 51.41 C ATOM 2092 CZ PHE A 129 3.041 4.933 -7.838 1.00 63.34 C ATOM 0 H PHE A 129 2.450 11.340 -7.101 1.00 64.31 H new ATOM 0 HA PHE A 129 5.042 10.118 -7.709 1.00 31.42 H new ATOM 0 HB2 PHE A 129 4.141 9.125 -5.826 1.00 71.22 H new ATOM 0 HB3 PHE A 129 2.484 9.417 -6.317 1.00 71.22 H new ATOM 0 HD1 PHE A 129 5.406 7.174 -7.004 1.00 45.13 H new ATOM 0 HD2 PHE A 129 1.177 7.654 -7.239 1.00 45.42 H new ATOM 0 HE1 PHE A 129 5.161 4.843 -7.688 1.00 32.42 H new ATOM 0 HE2 PHE A 129 0.953 5.308 -7.909 1.00 51.41 H new ATOM 0 HZ PHE A 129 2.942 3.899 -8.135 1.00 63.34 H new ATOM 2102 N GLY A 130 2.450 9.601 -9.732 1.00 31.51 N ATOM 2103 CA GLY A 130 2.074 9.058 -11.059 1.00 3.23 C ATOM 2104 C GLY A 130 1.406 7.678 -10.970 1.00 40.34 C ATOM 2105 O GLY A 130 0.635 7.431 -10.042 1.00 71.31 O ATOM 0 H GLY A 130 1.683 10.055 -9.235 1.00 31.51 H new ATOM 0 HA2 GLY A 130 1.395 9.754 -11.552 1.00 3.23 H new ATOM 0 HA3 GLY A 130 2.965 8.986 -11.683 1.00 3.23 H new ATOM 2109 N GLU A 131 1.672 6.782 -11.951 1.00 4.20 N ATOM 2110 CA GLU A 131 1.090 5.400 -11.992 1.00 52.31 C ATOM 2111 C GLU A 131 2.183 4.296 -12.120 1.00 71.04 C ATOM 2112 O GLU A 131 2.302 3.410 -11.265 1.00 43.44 O ATOM 2113 CB GLU A 131 0.066 5.256 -13.178 1.00 64.22 C ATOM 2114 CG GLU A 131 -1.378 5.757 -12.907 1.00 12.12 C ATOM 2115 CD GLU A 131 -1.514 7.283 -12.765 1.00 72.03 C ATOM 2116 OE1 GLU A 131 -1.304 7.999 -13.767 1.00 72.15 O ATOM 2117 OE2 GLU A 131 -1.841 7.777 -11.662 1.00 32.12 O ATOM 0 H GLU A 131 2.291 6.986 -12.736 1.00 4.20 H new ATOM 0 HA GLU A 131 0.575 5.257 -11.042 1.00 52.31 H new ATOM 0 HB2 GLU A 131 0.460 5.798 -14.038 1.00 64.22 H new ATOM 0 HB3 GLU A 131 0.016 4.204 -13.460 1.00 64.22 H new ATOM 0 HG2 GLU A 131 -2.022 5.423 -13.720 1.00 12.12 H new ATOM 0 HG3 GLU A 131 -1.746 5.287 -11.995 1.00 12.12 H new ATOM 2124 N ASP A 132 2.983 4.387 -13.192 1.00 51.31 N ATOM 2125 CA ASP A 132 3.828 3.266 -13.717 1.00 63.23 C ATOM 2126 C ASP A 132 5.102 2.935 -12.894 1.00 33.41 C ATOM 2127 O ASP A 132 5.935 2.138 -13.353 1.00 63.00 O ATOM 2128 CB ASP A 132 4.228 3.599 -15.178 1.00 22.04 C ATOM 2129 CG ASP A 132 4.996 4.933 -15.286 1.00 11.15 C ATOM 2130 OD1 ASP A 132 4.350 6.006 -15.270 1.00 30.13 O ATOM 2131 OD2 ASP A 132 6.244 4.920 -15.382 1.00 41.50 O ATOM 0 H ASP A 132 3.074 5.245 -13.737 1.00 51.31 H new ATOM 0 HA ASP A 132 3.212 2.370 -13.643 1.00 63.23 H new ATOM 0 HB2 ASP A 132 4.846 2.794 -15.576 1.00 22.04 H new ATOM 0 HB3 ASP A 132 3.331 3.648 -15.796 1.00 22.04 H new ATOM 2136 N THR A 133 5.239 3.479 -11.679 1.00 23.22 N ATOM 2137 CA THR A 133 6.494 3.371 -10.898 1.00 54.51 C ATOM 2138 C THR A 133 6.251 3.003 -9.409 1.00 64.23 C ATOM 2139 O THR A 133 5.112 2.880 -8.966 1.00 34.12 O ATOM 2140 CB THR A 133 7.312 4.705 -11.009 1.00 42.41 C ATOM 2141 OG1 THR A 133 8.578 4.576 -10.345 1.00 13.34 O ATOM 2142 CG2 THR A 133 6.549 5.915 -10.435 1.00 60.22 C ATOM 0 H THR A 133 4.500 4.001 -11.208 1.00 23.22 H new ATOM 0 HA THR A 133 7.069 2.552 -11.329 1.00 54.51 H new ATOM 0 HB THR A 133 7.470 4.887 -12.072 1.00 42.41 H new ATOM 0 HG1 THR A 133 9.297 4.561 -11.011 1.00 13.34 H new ATOM 0 HG21 THR A 133 7.160 6.812 -10.537 1.00 60.22 H new ATOM 0 HG22 THR A 133 5.615 6.048 -10.981 1.00 60.22 H new ATOM 0 HG23 THR A 133 6.332 5.742 -9.381 1.00 60.22 H new ATOM 2150 N VAL A 134 7.350 2.771 -8.667 1.00 52.32 N ATOM 2151 CA VAL A 134 7.333 2.604 -7.191 1.00 3.42 C ATOM 2152 C VAL A 134 7.385 3.997 -6.488 1.00 13.54 C ATOM 2153 O VAL A 134 8.148 4.872 -6.928 1.00 74.10 O ATOM 2154 CB VAL A 134 8.548 1.697 -6.736 1.00 0.32 C ATOM 2155 CG1 VAL A 134 8.741 1.677 -5.195 1.00 2.13 C ATOM 2156 CG2 VAL A 134 8.376 0.260 -7.285 1.00 25.12 C ATOM 0 H VAL A 134 8.283 2.693 -9.072 1.00 52.32 H new ATOM 0 HA VAL A 134 6.406 2.111 -6.899 1.00 3.42 H new ATOM 0 HB VAL A 134 9.452 2.138 -7.156 1.00 0.32 H new ATOM 0 HG11 VAL A 134 9.588 1.039 -4.943 1.00 2.13 H new ATOM 0 HG12 VAL A 134 8.930 2.690 -4.839 1.00 2.13 H new ATOM 0 HG13 VAL A 134 7.840 1.288 -4.720 1.00 2.13 H new ATOM 0 HG21 VAL A 134 9.218 -0.355 -6.966 1.00 25.12 H new ATOM 0 HG22 VAL A 134 7.449 -0.167 -6.903 1.00 25.12 H new ATOM 0 HG23 VAL A 134 8.340 0.288 -8.374 1.00 25.12 H new ATOM 2166 N PRO A 135 6.549 4.237 -5.407 1.00 41.01 N ATOM 2167 CA PRO A 135 6.593 5.498 -4.611 1.00 2.44 C ATOM 2168 C PRO A 135 7.989 5.747 -3.984 1.00 74.32 C ATOM 2169 O PRO A 135 8.602 4.845 -3.403 1.00 24.41 O ATOM 2170 CB PRO A 135 5.490 5.296 -3.529 1.00 42.33 C ATOM 2171 CG PRO A 135 5.272 3.813 -3.486 1.00 13.32 C ATOM 2172 CD PRO A 135 5.490 3.327 -4.899 1.00 2.14 C ATOM 0 HA PRO A 135 6.416 6.382 -5.224 1.00 2.44 H new ATOM 0 HB2 PRO A 135 5.810 5.678 -2.560 1.00 42.33 H new ATOM 0 HB3 PRO A 135 4.574 5.824 -3.793 1.00 42.33 H new ATOM 0 HG2 PRO A 135 5.967 3.335 -2.796 1.00 13.32 H new ATOM 0 HG3 PRO A 135 4.266 3.575 -3.141 1.00 13.32 H new ATOM 0 HD2 PRO A 135 5.808 2.285 -4.923 1.00 2.14 H new ATOM 0 HD3 PRO A 135 4.579 3.396 -5.494 1.00 2.14 H new ATOM 2180 N TYR A 136 8.465 6.990 -4.114 1.00 30.43 N ATOM 2181 CA TYR A 136 9.842 7.383 -3.772 1.00 24.41 C ATOM 2182 C TYR A 136 9.902 8.257 -2.498 1.00 72.14 C ATOM 2183 O TYR A 136 8.974 9.016 -2.195 1.00 71.14 O ATOM 2184 CB TYR A 136 10.492 8.098 -4.990 1.00 23.12 C ATOM 2185 CG TYR A 136 9.674 9.260 -5.607 1.00 73.30 C ATOM 2186 CD1 TYR A 136 8.602 9.017 -6.484 1.00 61.45 C ATOM 2187 CD2 TYR A 136 9.980 10.593 -5.327 1.00 74.42 C ATOM 2188 CE1 TYR A 136 7.880 10.056 -7.046 1.00 13.20 C ATOM 2189 CE2 TYR A 136 9.256 11.629 -5.888 1.00 4.12 C ATOM 2190 CZ TYR A 136 8.212 11.359 -6.744 1.00 41.45 C ATOM 2191 OH TYR A 136 7.496 12.400 -7.300 1.00 35.44 O ATOM 0 H TYR A 136 7.900 7.764 -4.464 1.00 30.43 H new ATOM 0 HA TYR A 136 10.411 6.482 -3.544 1.00 24.41 H new ATOM 0 HB2 TYR A 136 11.463 8.486 -4.683 1.00 23.12 H new ATOM 0 HB3 TYR A 136 10.676 7.356 -5.767 1.00 23.12 H new ATOM 0 HD1 TYR A 136 8.336 7.998 -6.724 1.00 61.45 H new ATOM 0 HD2 TYR A 136 10.798 10.820 -4.659 1.00 74.42 H new ATOM 0 HE1 TYR A 136 7.061 9.846 -7.718 1.00 13.20 H new ATOM 0 HE2 TYR A 136 9.510 12.652 -5.654 1.00 4.12 H new ATOM 0 HH TYR A 136 6.652 12.059 -7.663 1.00 35.44 H new