USER MOD reduce.3.24.130724 H: found=0, std=0, add=901, rem=0, adj=20 USER MOD reduce.3.24.130724 removed 903 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: B 6 ASN : amide:sc= -0.188 K(o=-2.5,f=-4.6!) USER MOD Set 1.2: B 39 GLN : amide:sc= -2.34! X(o=-2.5!,f=-2.6) USER MOD Set 2.1: B 15 CYS SG : rot -92:sc= 0.156 USER MOD Set 2.2: B 19 MET CE :methyl -124:sc= -0.298 (180deg=-0.463) USER MOD Single : A 6 ASN : amide:sc= -0.0909! X(o=-0.091!,f=-0.52) USER MOD Single : A 9 LYS NZ :NH3+ 164:sc= -0.0256 (180deg=-0.252) USER MOD Single : A 15 CYS SG : rot 180:sc= 0 USER MOD Single : A 19 MET CE :methyl -118:sc= -1.06 (180deg=-4.74!) USER MOD Single : A 20 LYS NZ :NH3+ -144:sc= 0.322 (180deg=-1.22) USER MOD Single : A 21 GLN :FLIP amide:sc= -0.404 F(o=-2.2!,f=-0.4) USER MOD Single : A 25 TYR OH : rot 180:sc= 0 USER MOD Single : A 29 SER OG : rot -78:sc= 0.94 USER MOD Single : A 30 ASN : amide:sc= -0.7 K(o=-0.7,f=-2.2) USER MOD Single : A 34 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 35 LYS NZ :NH3+ -159:sc= 1.78 (180deg=1.48) USER MOD Single : A 39 GLN : amide:sc= -3.21! C(o=-3.2!,f=-4.2!) USER MOD Single : A 44 THR OG1 : rot 180:sc= 0 USER MOD Single : A 45 HIS : no HD1:sc= -5.88! C(o=-5.9!,f=-5.4!) USER MOD Single : A 54 ASN : amide:sc= -0.207 K(o=-0.21,f=-3.1!) USER MOD Single : A 57 GLN :FLIP amide:sc= -0.392 F(o=-5.2!,f=-0.39) USER MOD Single : B 9 LYS NZ :NH3+ 162:sc= -0.0817 (180deg=-0.393) USER MOD Single : B 20 LYS NZ :NH3+ -169:sc= 0.496 (180deg=0.156) USER MOD Single : B 21 GLN : amide:sc= -0.372 K(o=-0.37,f=-1.4) USER MOD Single : B 25 TYR OH : rot 180:sc= 0 USER MOD Single : B 29 SER OG : rot -94:sc= 0.0915 USER MOD Single : B 30 ASN : amide:sc= -0.0267 K(o=-0.027,f=-4.8!) USER MOD Single : B 34 LYS NZ :NH3+ -178:sc= 0.765 (180deg=0.758) USER MOD Single : B 35 LYS NZ :NH3+ 162:sc= 0.911 (180deg=0.696) USER MOD Single : B 44 THR OG1 : rot 65:sc= 1.16 USER MOD Single : B 45 HIS : no HD1:sc= -7.53! C(o=-7.5!,f=-9.1!) USER MOD Single : B 54 ASN : amide:sc=-0.000996 K(o=-0.001,f=-0.51) USER MOD Single : B 57 GLN :FLIP amide:sc= -0.571 F(o=-1.6,f=-0.57) USER MOD ----------------------------------------------------------------- ATOM 56 N VAL A 5 -5.841 -8.001 7.035 1.00 0.00 N ATOM 57 CA VAL A 5 -6.676 -6.852 6.761 1.00 0.00 C ATOM 58 C VAL A 5 -5.900 -5.604 7.099 1.00 0.00 C ATOM 59 O VAL A 5 -5.716 -5.264 8.268 1.00 0.00 O ATOM 60 CB VAL A 5 -8.002 -6.881 7.566 1.00 0.00 C ATOM 61 CG1 VAL A 5 -8.839 -5.658 7.245 1.00 0.00 C ATOM 62 CG2 VAL A 5 -8.790 -8.146 7.271 1.00 0.00 C ATOM 0 HA VAL A 5 -6.945 -6.869 5.705 1.00 0.00 H new ATOM 0 HB VAL A 5 -7.754 -6.873 8.627 1.00 0.00 H new ATOM 0 HG11 VAL A 5 -9.766 -5.691 7.817 1.00 0.00 H new ATOM 0 HG12 VAL A 5 -8.283 -4.758 7.507 1.00 0.00 H new ATOM 0 HG13 VAL A 5 -9.070 -5.644 6.180 1.00 0.00 H new ATOM 0 HG21 VAL A 5 -9.715 -8.141 7.848 1.00 0.00 H new ATOM 0 HG22 VAL A 5 -9.026 -8.188 6.208 1.00 0.00 H new ATOM 0 HG23 VAL A 5 -8.195 -9.017 7.546 1.00 0.00 H new ATOM 72 N ASN A 6 -5.412 -4.969 6.094 1.00 0.00 N ATOM 73 CA ASN A 6 -4.542 -3.829 6.226 1.00 0.00 C ATOM 74 C ASN A 6 -4.879 -2.836 5.179 1.00 0.00 C ATOM 75 O ASN A 6 -4.652 -3.056 3.987 1.00 0.00 O ATOM 76 CB ASN A 6 -3.044 -4.200 6.122 1.00 0.00 C ATOM 77 CG ASN A 6 -2.331 -4.568 7.438 1.00 0.00 C ATOM 78 OD1 ASN A 6 -1.132 -4.325 7.583 1.00 0.00 O ATOM 79 ND2 ASN A 6 -3.024 -5.127 8.395 1.00 0.00 N ATOM 0 H ASN A 6 -5.605 -5.226 5.126 1.00 0.00 H new ATOM 0 HA ASN A 6 -4.699 -3.413 7.221 1.00 0.00 H new ATOM 0 HB2 ASN A 6 -2.948 -5.042 5.436 1.00 0.00 H new ATOM 0 HB3 ASN A 6 -2.515 -3.360 5.672 1.00 0.00 H new ATOM 0 HD21 ASN A 6 -2.573 -5.368 9.277 1.00 0.00 H new ATOM 0 HD22 ASN A 6 -4.016 -5.322 8.259 1.00 0.00 H new ATOM 86 N VAL A 7 -5.515 -1.812 5.595 1.00 0.00 N ATOM 87 CA VAL A 7 -5.884 -0.729 4.740 1.00 0.00 C ATOM 88 C VAL A 7 -5.151 0.496 5.272 1.00 0.00 C ATOM 89 O VAL A 7 -5.218 0.746 6.473 1.00 0.00 O ATOM 90 CB VAL A 7 -7.414 -0.463 4.833 1.00 0.00 C ATOM 91 CG1 VAL A 7 -7.838 0.724 4.000 1.00 0.00 C ATOM 92 CG2 VAL A 7 -8.225 -1.696 4.479 1.00 0.00 C ATOM 0 H VAL A 7 -5.807 -1.689 6.565 1.00 0.00 H new ATOM 0 HA VAL A 7 -5.633 -0.952 3.703 1.00 0.00 H new ATOM 0 HB VAL A 7 -7.622 -0.219 5.875 1.00 0.00 H new ATOM 0 HG11 VAL A 7 -8.914 0.871 4.097 1.00 0.00 H new ATOM 0 HG12 VAL A 7 -7.318 1.617 4.347 1.00 0.00 H new ATOM 0 HG13 VAL A 7 -7.589 0.542 2.954 1.00 0.00 H new ATOM 0 HG21 VAL A 7 -9.288 -1.467 4.557 1.00 0.00 H new ATOM 0 HG22 VAL A 7 -7.994 -2.003 3.459 1.00 0.00 H new ATOM 0 HG23 VAL A 7 -7.977 -2.504 5.167 1.00 0.00 H new ATOM 102 N LEU A 8 -4.460 1.243 4.438 1.00 0.00 N ATOM 103 CA LEU A 8 -3.727 2.405 4.931 1.00 0.00 C ATOM 104 C LEU A 8 -3.299 3.346 3.820 1.00 0.00 C ATOM 105 O LEU A 8 -3.436 3.039 2.641 1.00 0.00 O ATOM 106 CB LEU A 8 -2.521 2.027 5.836 1.00 0.00 C ATOM 107 CG LEU A 8 -1.358 1.248 5.234 1.00 0.00 C ATOM 108 CD1 LEU A 8 -0.283 1.121 6.265 1.00 0.00 C ATOM 109 CD2 LEU A 8 -1.761 -0.133 4.754 1.00 0.00 C ATOM 0 H LEU A 8 -4.386 1.078 3.434 1.00 0.00 H new ATOM 0 HA LEU A 8 -4.440 2.943 5.556 1.00 0.00 H new ATOM 0 HB2 LEU A 8 -2.118 2.952 6.250 1.00 0.00 H new ATOM 0 HB3 LEU A 8 -2.908 1.445 6.673 1.00 0.00 H new ATOM 0 HG LEU A 8 -1.006 1.798 4.361 1.00 0.00 H new ATOM 0 HD11 LEU A 8 0.557 0.565 5.848 1.00 0.00 H new ATOM 0 HD12 LEU A 8 0.052 2.114 6.565 1.00 0.00 H new ATOM 0 HD13 LEU A 8 -0.673 0.591 7.134 1.00 0.00 H new ATOM 0 HD21 LEU A 8 -0.892 -0.641 4.335 1.00 0.00 H new ATOM 0 HD22 LEU A 8 -2.149 -0.711 5.593 1.00 0.00 H new ATOM 0 HD23 LEU A 8 -2.532 -0.042 3.989 1.00 0.00 H new ATOM 121 N LYS A 9 -2.764 4.472 4.217 1.00 0.00 N ATOM 122 CA LYS A 9 -2.397 5.542 3.320 1.00 0.00 C ATOM 123 C LYS A 9 -0.868 5.601 3.201 1.00 0.00 C ATOM 124 O LYS A 9 -0.160 5.443 4.198 1.00 0.00 O ATOM 125 CB LYS A 9 -2.997 6.847 3.915 1.00 0.00 C ATOM 126 CG LYS A 9 -2.914 8.137 3.075 1.00 0.00 C ATOM 127 CD LYS A 9 -1.496 8.648 2.928 1.00 0.00 C ATOM 128 CE LYS A 9 -1.439 9.984 2.238 1.00 0.00 C ATOM 129 NZ LYS A 9 -2.066 11.048 3.043 1.00 0.00 N ATOM 0 H LYS A 9 -2.566 4.677 5.196 1.00 0.00 H new ATOM 0 HA LYS A 9 -2.784 5.393 2.312 1.00 0.00 H new ATOM 0 HB2 LYS A 9 -4.048 6.660 4.135 1.00 0.00 H new ATOM 0 HB3 LYS A 9 -2.501 7.037 4.867 1.00 0.00 H new ATOM 0 HG2 LYS A 9 -3.333 7.949 2.086 1.00 0.00 H new ATOM 0 HG3 LYS A 9 -3.528 8.909 3.540 1.00 0.00 H new ATOM 0 HD2 LYS A 9 -1.038 8.731 3.914 1.00 0.00 H new ATOM 0 HD3 LYS A 9 -0.908 7.924 2.363 1.00 0.00 H new ATOM 0 HE2 LYS A 9 -0.400 10.245 2.038 1.00 0.00 H new ATOM 0 HE3 LYS A 9 -1.941 9.916 1.273 1.00 0.00 H new ATOM 0 HZ1 LYS A 9 -1.776 11.977 2.677 1.00 0.00 H new ATOM 0 HZ2 LYS A 9 -3.101 10.962 2.987 1.00 0.00 H new ATOM 0 HZ3 LYS A 9 -1.764 10.957 4.034 1.00 0.00 H new ATOM 143 N GLY A 10 -0.373 5.801 1.985 1.00 0.00 N ATOM 144 CA GLY A 10 1.050 5.898 1.763 1.00 0.00 C ATOM 145 C GLY A 10 1.419 5.595 0.325 1.00 0.00 C ATOM 146 O GLY A 10 0.709 6.002 -0.605 1.00 0.00 O ATOM 0 H GLY A 10 -0.942 5.898 1.144 1.00 0.00 H new ATOM 0 HA2 GLY A 10 1.390 6.901 2.022 1.00 0.00 H new ATOM 0 HA3 GLY A 10 1.569 5.205 2.425 1.00 0.00 H new ATOM 150 N VAL A 11 2.511 4.890 0.144 1.00 0.00 N ATOM 151 CA VAL A 11 3.025 4.528 -1.156 1.00 0.00 C ATOM 152 C VAL A 11 3.151 3.008 -1.276 1.00 0.00 C ATOM 153 O VAL A 11 3.686 2.325 -0.394 1.00 0.00 O ATOM 154 CB VAL A 11 4.395 5.228 -1.442 1.00 0.00 C ATOM 155 CG1 VAL A 11 5.005 4.771 -2.760 1.00 0.00 C ATOM 156 CG2 VAL A 11 4.212 6.734 -1.463 1.00 0.00 C ATOM 0 H VAL A 11 3.081 4.544 0.916 1.00 0.00 H new ATOM 0 HA VAL A 11 2.317 4.876 -1.908 1.00 0.00 H new ATOM 0 HB VAL A 11 5.079 4.946 -0.642 1.00 0.00 H new ATOM 0 HG11 VAL A 11 5.955 5.282 -2.918 1.00 0.00 H new ATOM 0 HG12 VAL A 11 5.173 3.694 -2.729 1.00 0.00 H new ATOM 0 HG13 VAL A 11 4.325 5.009 -3.578 1.00 0.00 H new ATOM 0 HG21 VAL A 11 5.170 7.214 -1.663 1.00 0.00 H new ATOM 0 HG22 VAL A 11 3.501 7.003 -2.244 1.00 0.00 H new ATOM 0 HG23 VAL A 11 3.833 7.068 -0.497 1.00 0.00 H new ATOM 166 N LEU A 12 2.655 2.503 -2.354 1.00 0.00 N ATOM 167 CA LEU A 12 2.641 1.098 -2.626 1.00 0.00 C ATOM 168 C LEU A 12 3.820 0.730 -3.501 1.00 0.00 C ATOM 169 O LEU A 12 4.083 1.406 -4.500 1.00 0.00 O ATOM 170 CB LEU A 12 1.354 0.761 -3.360 1.00 0.00 C ATOM 171 CG LEU A 12 1.271 -0.631 -3.956 1.00 0.00 C ATOM 172 CD1 LEU A 12 1.238 -1.687 -2.867 1.00 0.00 C ATOM 173 CD2 LEU A 12 0.072 -0.728 -4.862 1.00 0.00 C ATOM 0 H LEU A 12 2.236 3.067 -3.093 1.00 0.00 H new ATOM 0 HA LEU A 12 2.704 0.543 -1.690 1.00 0.00 H new ATOM 0 HB2 LEU A 12 0.521 0.888 -2.668 1.00 0.00 H new ATOM 0 HB3 LEU A 12 1.216 1.486 -4.162 1.00 0.00 H new ATOM 0 HG LEU A 12 2.165 -0.815 -4.552 1.00 0.00 H new ATOM 0 HD11 LEU A 12 1.178 -2.676 -3.321 1.00 0.00 H new ATOM 0 HD12 LEU A 12 2.144 -1.618 -2.266 1.00 0.00 H new ATOM 0 HD13 LEU A 12 0.367 -1.527 -2.231 1.00 0.00 H new ATOM 0 HD21 LEU A 12 0.017 -1.730 -5.287 1.00 0.00 H new ATOM 0 HD22 LEU A 12 -0.834 -0.527 -4.290 1.00 0.00 H new ATOM 0 HD23 LEU A 12 0.163 0.003 -5.666 1.00 0.00 H new ATOM 185 N ILE A 13 4.537 -0.316 -3.131 1.00 0.00 N ATOM 186 CA ILE A 13 5.633 -0.767 -3.943 1.00 0.00 C ATOM 187 C ILE A 13 5.329 -2.104 -4.580 1.00 0.00 C ATOM 188 O ILE A 13 4.846 -3.048 -3.917 1.00 0.00 O ATOM 189 CB ILE A 13 6.964 -1.007 -3.161 1.00 0.00 C ATOM 190 CG1 ILE A 13 7.368 0.121 -2.258 1.00 0.00 C ATOM 191 CG2 ILE A 13 8.120 -1.290 -4.121 1.00 0.00 C ATOM 192 CD1 ILE A 13 7.484 1.472 -2.914 1.00 0.00 C ATOM 0 H ILE A 13 4.376 -0.858 -2.282 1.00 0.00 H new ATOM 0 HA ILE A 13 5.758 0.042 -4.663 1.00 0.00 H new ATOM 0 HB ILE A 13 6.756 -1.871 -2.530 1.00 0.00 H new ATOM 0 HG12 ILE A 13 6.642 0.192 -1.448 1.00 0.00 H new ATOM 0 HG13 ILE A 13 8.328 -0.126 -1.805 1.00 0.00 H new ATOM 0 HG21 ILE A 13 9.035 -1.453 -3.551 1.00 0.00 H new ATOM 0 HG22 ILE A 13 7.895 -2.180 -4.709 1.00 0.00 H new ATOM 0 HG23 ILE A 13 8.256 -0.439 -4.788 1.00 0.00 H new ATOM 0 HD11 ILE A 13 7.781 2.213 -2.172 1.00 0.00 H new ATOM 0 HD12 ILE A 13 8.234 1.430 -3.704 1.00 0.00 H new ATOM 0 HD13 ILE A 13 6.521 1.753 -3.342 1.00 0.00 H new ATOM 204 N GLU A 14 5.554 -2.147 -5.832 1.00 0.00 N ATOM 205 CA GLU A 14 5.776 -3.340 -6.546 1.00 0.00 C ATOM 206 C GLU A 14 6.961 -2.989 -7.407 1.00 0.00 C ATOM 207 O GLU A 14 6.907 -2.019 -8.156 1.00 0.00 O ATOM 208 CB GLU A 14 4.574 -3.737 -7.421 1.00 0.00 C ATOM 209 CG GLU A 14 4.860 -4.885 -8.412 1.00 0.00 C ATOM 210 CD GLU A 14 5.405 -6.165 -7.783 1.00 0.00 C ATOM 211 OE1 GLU A 14 6.484 -6.142 -7.213 1.00 0.00 O ATOM 212 OE2 GLU A 14 4.739 -7.216 -7.885 1.00 0.00 O ATOM 0 H GLU A 14 5.591 -1.312 -6.417 1.00 0.00 H new ATOM 0 HA GLU A 14 5.934 -4.195 -5.888 1.00 0.00 H new ATOM 0 HB2 GLU A 14 3.749 -4.030 -6.772 1.00 0.00 H new ATOM 0 HB3 GLU A 14 4.244 -2.863 -7.982 1.00 0.00 H new ATOM 0 HG2 GLU A 14 3.938 -5.124 -8.943 1.00 0.00 H new ATOM 0 HG3 GLU A 14 5.574 -4.532 -9.156 1.00 0.00 H new ATOM 219 N CYS A 15 8.027 -3.679 -7.257 1.00 0.00 N ATOM 220 CA CYS A 15 9.190 -3.362 -8.033 1.00 0.00 C ATOM 221 C CYS A 15 9.739 -4.595 -8.743 1.00 0.00 C ATOM 222 O CYS A 15 9.503 -4.808 -9.940 1.00 0.00 O ATOM 223 CB CYS A 15 10.248 -2.744 -7.112 1.00 0.00 C ATOM 224 SG CYS A 15 11.639 -1.938 -7.940 1.00 0.00 S ATOM 0 H CYS A 15 8.131 -4.463 -6.613 1.00 0.00 H new ATOM 0 HA CYS A 15 8.917 -2.645 -8.807 1.00 0.00 H new ATOM 0 HB2 CYS A 15 9.759 -2.012 -6.468 1.00 0.00 H new ATOM 0 HB3 CYS A 15 10.640 -3.527 -6.464 1.00 0.00 H new ATOM 0 HG CYS A 15 12.455 -1.458 -7.049 1.00 0.00 H new ATOM 230 N ASP A 16 10.414 -5.411 -7.983 1.00 0.00 N ATOM 231 CA ASP A 16 11.122 -6.577 -8.424 1.00 0.00 C ATOM 232 C ASP A 16 11.677 -7.169 -7.164 1.00 0.00 C ATOM 233 O ASP A 16 12.370 -6.464 -6.443 1.00 0.00 O ATOM 234 CB ASP A 16 12.278 -6.203 -9.379 1.00 0.00 C ATOM 235 CG ASP A 16 13.091 -7.402 -9.823 1.00 0.00 C ATOM 236 OD1 ASP A 16 12.724 -8.062 -10.816 1.00 0.00 O ATOM 237 OD2 ASP A 16 14.118 -7.713 -9.190 1.00 0.00 O ATOM 0 H ASP A 16 10.488 -5.269 -6.976 1.00 0.00 H new ATOM 0 HA ASP A 16 10.475 -7.261 -8.973 1.00 0.00 H new ATOM 0 HB2 ASP A 16 11.869 -5.703 -10.257 1.00 0.00 H new ATOM 0 HB3 ASP A 16 12.935 -5.489 -8.883 1.00 0.00 H new ATOM 242 N PRO A 17 11.394 -8.455 -6.886 1.00 0.00 N ATOM 243 CA PRO A 17 11.706 -9.162 -5.591 1.00 0.00 C ATOM 244 C PRO A 17 13.098 -8.892 -4.994 1.00 0.00 C ATOM 245 O PRO A 17 13.304 -9.004 -3.777 1.00 0.00 O ATOM 246 CB PRO A 17 11.554 -10.612 -5.986 1.00 0.00 C ATOM 247 CG PRO A 17 10.460 -10.561 -6.976 1.00 0.00 C ATOM 248 CD PRO A 17 10.745 -9.379 -7.828 1.00 0.00 C ATOM 0 HA PRO A 17 11.053 -8.817 -4.790 1.00 0.00 H new ATOM 0 HB2 PRO A 17 12.472 -11.014 -6.416 1.00 0.00 H new ATOM 0 HB3 PRO A 17 11.300 -11.241 -5.132 1.00 0.00 H new ATOM 0 HG2 PRO A 17 10.427 -11.474 -7.571 1.00 0.00 H new ATOM 0 HG3 PRO A 17 9.492 -10.466 -6.485 1.00 0.00 H new ATOM 0 HD2 PRO A 17 11.397 -9.630 -8.664 1.00 0.00 H new ATOM 0 HD3 PRO A 17 9.834 -8.954 -8.250 1.00 0.00 H new ATOM 256 N ALA A 18 14.020 -8.522 -5.843 1.00 0.00 N ATOM 257 CA ALA A 18 15.360 -8.153 -5.467 1.00 0.00 C ATOM 258 C ALA A 18 15.352 -7.009 -4.435 1.00 0.00 C ATOM 259 O ALA A 18 16.030 -7.089 -3.370 1.00 0.00 O ATOM 260 CB ALA A 18 16.063 -7.693 -6.703 1.00 0.00 C ATOM 0 H ALA A 18 13.854 -8.467 -6.848 1.00 0.00 H new ATOM 0 HA ALA A 18 15.862 -9.009 -5.016 1.00 0.00 H new ATOM 0 HB1 ALA A 18 17.084 -7.405 -6.455 1.00 0.00 H new ATOM 0 HB2 ALA A 18 16.082 -8.502 -7.433 1.00 0.00 H new ATOM 0 HB3 ALA A 18 15.536 -6.836 -7.124 1.00 0.00 H new ATOM 266 N MET A 19 14.527 -5.976 -4.708 1.00 0.00 N ATOM 267 CA MET A 19 14.474 -4.799 -3.842 1.00 0.00 C ATOM 268 C MET A 19 13.941 -5.202 -2.511 1.00 0.00 C ATOM 269 O MET A 19 14.393 -4.740 -1.479 1.00 0.00 O ATOM 270 CB MET A 19 13.599 -3.634 -4.419 1.00 0.00 C ATOM 271 CG MET A 19 12.139 -3.522 -3.876 1.00 0.00 C ATOM 272 SD MET A 19 11.017 -4.816 -4.446 1.00 0.00 S ATOM 273 CE MET A 19 9.578 -4.458 -3.455 1.00 0.00 C ATOM 0 H MET A 19 13.900 -5.941 -5.512 1.00 0.00 H new ATOM 0 HA MET A 19 15.491 -4.415 -3.765 1.00 0.00 H new ATOM 0 HB2 MET A 19 14.110 -2.692 -4.219 1.00 0.00 H new ATOM 0 HB3 MET A 19 13.552 -3.747 -5.502 1.00 0.00 H new ATOM 0 HG2 MET A 19 12.169 -3.541 -2.787 1.00 0.00 H new ATOM 0 HG3 MET A 19 11.732 -2.554 -4.167 1.00 0.00 H new ATOM 0 HE1 MET A 19 9.361 -5.308 -2.809 1.00 0.00 H new ATOM 0 HE2 MET A 19 9.768 -3.576 -2.843 1.00 0.00 H new ATOM 0 HE3 MET A 19 8.725 -4.270 -4.107 1.00 0.00 H new ATOM 283 N LYS A 20 13.017 -6.123 -2.564 1.00 0.00 N ATOM 284 CA LYS A 20 12.316 -6.590 -1.442 1.00 0.00 C ATOM 285 C LYS A 20 13.244 -7.239 -0.435 1.00 0.00 C ATOM 286 O LYS A 20 13.141 -6.984 0.774 1.00 0.00 O ATOM 287 CB LYS A 20 11.172 -7.525 -1.894 1.00 0.00 C ATOM 288 CG LYS A 20 10.532 -8.284 -0.773 1.00 0.00 C ATOM 289 CD LYS A 20 10.102 -7.360 0.312 1.00 0.00 C ATOM 290 CE LYS A 20 10.003 -8.090 1.572 1.00 0.00 C ATOM 291 NZ LYS A 20 9.783 -7.169 2.667 1.00 0.00 N ATOM 0 H LYS A 20 12.735 -6.574 -3.434 1.00 0.00 H new ATOM 0 HA LYS A 20 11.866 -5.743 -0.925 1.00 0.00 H new ATOM 0 HB2 LYS A 20 10.410 -6.933 -2.401 1.00 0.00 H new ATOM 0 HB3 LYS A 20 11.562 -8.234 -2.624 1.00 0.00 H new ATOM 0 HG2 LYS A 20 9.671 -8.838 -1.148 1.00 0.00 H new ATOM 0 HG3 LYS A 20 11.235 -9.017 -0.376 1.00 0.00 H new ATOM 0 HD2 LYS A 20 10.816 -6.542 0.410 1.00 0.00 H new ATOM 0 HD3 LYS A 20 9.139 -6.914 0.063 1.00 0.00 H new ATOM 0 HE2 LYS A 20 9.185 -8.808 1.521 1.00 0.00 H new ATOM 0 HE3 LYS A 20 10.917 -8.659 1.744 1.00 0.00 H new ATOM 0 HZ1 LYS A 20 10.287 -7.507 3.512 1.00 0.00 H new ATOM 0 HZ2 LYS A 20 10.139 -6.227 2.405 1.00 0.00 H new ATOM 0 HZ3 LYS A 20 8.765 -7.110 2.872 1.00 0.00 H new ATOM 305 N GLN A 21 14.157 -8.016 -0.906 1.00 0.00 N ATOM 306 CA GLN A 21 15.034 -8.682 -0.010 1.00 0.00 C ATOM 307 C GLN A 21 16.023 -7.720 0.655 1.00 0.00 C ATOM 308 O GLN A 21 16.297 -7.842 1.862 1.00 0.00 O ATOM 309 CB GLN A 21 15.684 -9.876 -0.649 1.00 0.00 C ATOM 310 CG GLN A 21 14.692 -10.975 -1.056 1.00 0.00 C ATOM 311 CD GLN A 21 13.805 -11.468 0.078 1.00 0.00 C ATOM 312 OE1 GLN A 21 12.576 -11.026 0.108 1.00 0.00 O flip ATOM 313 NE2 GLN A 21 14.202 -12.342 0.849 1.00 0.00 N flip ATOM 0 H GLN A 21 14.314 -8.204 -1.896 1.00 0.00 H new ATOM 0 HA GLN A 21 14.430 -9.078 0.806 1.00 0.00 H new ATOM 0 HB2 GLN A 21 16.234 -9.550 -1.532 1.00 0.00 H new ATOM 0 HB3 GLN A 21 16.413 -10.296 0.044 1.00 0.00 H new ATOM 0 HG2 GLN A 21 14.059 -10.598 -1.859 1.00 0.00 H new ATOM 0 HG3 GLN A 21 15.249 -11.820 -1.460 1.00 0.00 H new ATOM 0 HE21 GLN A 21 15.168 -12.665 0.800 1.00 0.00 H new ATOM 0 HE22 GLN A 21 13.565 -12.743 1.537 1.00 0.00 H new ATOM 322 N PHE A 22 16.535 -6.744 -0.093 1.00 0.00 N ATOM 323 CA PHE A 22 17.383 -5.734 0.547 1.00 0.00 C ATOM 324 C PHE A 22 16.592 -4.807 1.494 1.00 0.00 C ATOM 325 O PHE A 22 17.112 -4.333 2.497 1.00 0.00 O ATOM 326 CB PHE A 22 18.399 -4.993 -0.367 1.00 0.00 C ATOM 327 CG PHE A 22 17.859 -4.107 -1.473 1.00 0.00 C ATOM 328 CD1 PHE A 22 17.175 -2.940 -1.185 1.00 0.00 C ATOM 329 CD2 PHE A 22 18.090 -4.424 -2.795 1.00 0.00 C ATOM 330 CE1 PHE A 22 16.723 -2.113 -2.192 1.00 0.00 C ATOM 331 CE2 PHE A 22 17.649 -3.596 -3.813 1.00 0.00 C ATOM 332 CZ PHE A 22 16.963 -2.438 -3.508 1.00 0.00 C ATOM 0 H PHE A 22 16.389 -6.629 -1.096 1.00 0.00 H new ATOM 0 HA PHE A 22 18.050 -6.326 1.174 1.00 0.00 H new ATOM 0 HB2 PHE A 22 19.033 -4.378 0.271 1.00 0.00 H new ATOM 0 HB3 PHE A 22 19.042 -5.744 -0.827 1.00 0.00 H new ATOM 0 HD1 PHE A 22 16.992 -2.672 -0.155 1.00 0.00 H new ATOM 0 HD2 PHE A 22 18.623 -5.331 -3.040 1.00 0.00 H new ATOM 0 HE1 PHE A 22 16.181 -1.211 -1.948 1.00 0.00 H new ATOM 0 HE2 PHE A 22 17.841 -3.856 -4.844 1.00 0.00 H new ATOM 0 HZ PHE A 22 16.616 -1.789 -4.299 1.00 0.00 H new ATOM 342 N LEU A 23 15.350 -4.539 1.130 1.00 0.00 N ATOM 343 CA LEU A 23 14.407 -3.741 1.898 1.00 0.00 C ATOM 344 C LEU A 23 14.196 -4.408 3.267 1.00 0.00 C ATOM 345 O LEU A 23 13.980 -3.747 4.273 1.00 0.00 O ATOM 346 CB LEU A 23 13.115 -3.755 1.083 1.00 0.00 C ATOM 347 CG LEU A 23 12.078 -2.684 1.307 1.00 0.00 C ATOM 348 CD1 LEU A 23 12.670 -1.304 1.036 1.00 0.00 C ATOM 349 CD2 LEU A 23 10.935 -2.936 0.355 1.00 0.00 C ATOM 0 H LEU A 23 14.954 -4.885 0.256 1.00 0.00 H new ATOM 0 HA LEU A 23 14.751 -2.722 2.074 1.00 0.00 H new ATOM 0 HB2 LEU A 23 13.394 -3.723 0.030 1.00 0.00 H new ATOM 0 HB3 LEU A 23 12.632 -4.717 1.255 1.00 0.00 H new ATOM 0 HG LEU A 23 11.734 -2.713 2.341 1.00 0.00 H new ATOM 0 HD11 LEU A 23 11.908 -0.542 1.202 1.00 0.00 H new ATOM 0 HD12 LEU A 23 13.510 -1.130 1.708 1.00 0.00 H new ATOM 0 HD13 LEU A 23 13.015 -1.253 0.003 1.00 0.00 H new ATOM 0 HD21 LEU A 23 10.169 -2.174 0.496 1.00 0.00 H new ATOM 0 HD22 LEU A 23 11.301 -2.897 -0.671 1.00 0.00 H new ATOM 0 HD23 LEU A 23 10.508 -3.920 0.551 1.00 0.00 H new ATOM 361 N LEU A 24 14.275 -5.724 3.284 1.00 0.00 N ATOM 362 CA LEU A 24 14.235 -6.505 4.514 1.00 0.00 C ATOM 363 C LEU A 24 15.466 -6.261 5.358 1.00 0.00 C ATOM 364 O LEU A 24 15.355 -6.050 6.563 1.00 0.00 O ATOM 365 CB LEU A 24 14.125 -7.953 4.185 1.00 0.00 C ATOM 366 CG LEU A 24 12.782 -8.449 3.800 1.00 0.00 C ATOM 367 CD1 LEU A 24 12.952 -9.793 3.190 1.00 0.00 C ATOM 368 CD2 LEU A 24 11.894 -8.547 5.022 1.00 0.00 C ATOM 0 H LEU A 24 14.370 -6.290 2.441 1.00 0.00 H new ATOM 0 HA LEU A 24 13.364 -6.192 5.089 1.00 0.00 H new ATOM 0 HB2 LEU A 24 14.814 -8.170 3.369 1.00 0.00 H new ATOM 0 HB3 LEU A 24 14.464 -8.525 5.049 1.00 0.00 H new ATOM 0 HG LEU A 24 12.314 -7.765 3.092 1.00 0.00 H new ATOM 0 HD11 LEU A 24 11.978 -10.185 2.896 1.00 0.00 H new ATOM 0 HD12 LEU A 24 13.592 -9.715 2.311 1.00 0.00 H new ATOM 0 HD13 LEU A 24 13.410 -10.466 3.915 1.00 0.00 H new ATOM 0 HD21 LEU A 24 10.910 -8.912 4.728 1.00 0.00 H new ATOM 0 HD22 LEU A 24 12.338 -9.237 5.740 1.00 0.00 H new ATOM 0 HD23 LEU A 24 11.794 -7.563 5.479 1.00 0.00 H new ATOM 380 N TYR A 25 16.638 -6.290 4.717 1.00 0.00 N ATOM 381 CA TYR A 25 17.904 -5.966 5.388 1.00 0.00 C ATOM 382 C TYR A 25 17.827 -4.582 6.005 1.00 0.00 C ATOM 383 O TYR A 25 18.316 -4.342 7.129 1.00 0.00 O ATOM 384 CB TYR A 25 19.094 -6.040 4.393 1.00 0.00 C ATOM 385 CG TYR A 25 20.329 -5.252 4.826 1.00 0.00 C ATOM 386 CD1 TYR A 25 21.075 -5.615 5.941 1.00 0.00 C ATOM 387 CD2 TYR A 25 20.715 -4.113 4.128 1.00 0.00 C ATOM 388 CE1 TYR A 25 22.171 -4.871 6.339 1.00 0.00 C ATOM 389 CE2 TYR A 25 21.801 -3.367 4.520 1.00 0.00 C ATOM 390 CZ TYR A 25 22.529 -3.746 5.625 1.00 0.00 C ATOM 391 OH TYR A 25 23.613 -2.986 6.030 1.00 0.00 O ATOM 0 H TYR A 25 16.738 -6.535 3.732 1.00 0.00 H new ATOM 0 HA TYR A 25 18.071 -6.700 6.176 1.00 0.00 H new ATOM 0 HB2 TYR A 25 19.374 -7.085 4.257 1.00 0.00 H new ATOM 0 HB3 TYR A 25 18.764 -5.670 3.422 1.00 0.00 H new ATOM 0 HD1 TYR A 25 20.795 -6.492 6.506 1.00 0.00 H new ATOM 0 HD2 TYR A 25 20.150 -3.808 3.260 1.00 0.00 H new ATOM 0 HE1 TYR A 25 22.744 -5.169 7.205 1.00 0.00 H new ATOM 0 HE2 TYR A 25 22.082 -2.486 3.962 1.00 0.00 H new ATOM 0 HH TYR A 25 23.730 -2.230 5.418 1.00 0.00 H new ATOM 401 N LEU A 26 17.196 -3.691 5.288 1.00 0.00 N ATOM 402 CA LEU A 26 17.063 -2.343 5.721 1.00 0.00 C ATOM 403 C LEU A 26 16.089 -2.271 6.895 1.00 0.00 C ATOM 404 O LEU A 26 16.241 -1.463 7.739 1.00 0.00 O ATOM 405 CB LEU A 26 16.702 -1.409 4.543 1.00 0.00 C ATOM 406 CG LEU A 26 17.120 0.087 4.665 1.00 0.00 C ATOM 407 CD1 LEU A 26 16.245 0.870 5.624 1.00 0.00 C ATOM 408 CD2 LEU A 26 18.576 0.189 5.102 1.00 0.00 C ATOM 0 H LEU A 26 16.762 -3.889 4.386 1.00 0.00 H new ATOM 0 HA LEU A 26 18.022 -1.977 6.088 1.00 0.00 H new ATOM 0 HB2 LEU A 26 17.157 -1.814 3.639 1.00 0.00 H new ATOM 0 HB3 LEU A 26 15.622 -1.447 4.401 1.00 0.00 H new ATOM 0 HG LEU A 26 16.991 0.529 3.677 1.00 0.00 H new ATOM 0 HD11 LEU A 26 16.586 1.904 5.666 1.00 0.00 H new ATOM 0 HD12 LEU A 26 15.211 0.842 5.279 1.00 0.00 H new ATOM 0 HD13 LEU A 26 16.307 0.427 6.618 1.00 0.00 H new ATOM 0 HD21 LEU A 26 18.858 1.239 5.184 1.00 0.00 H new ATOM 0 HD22 LEU A 26 18.700 -0.297 6.070 1.00 0.00 H new ATOM 0 HD23 LEU A 26 19.212 -0.301 4.365 1.00 0.00 H new ATOM 420 N ASP A 27 15.097 -3.133 6.919 1.00 0.00 N ATOM 421 CA ASP A 27 14.157 -3.207 8.060 1.00 0.00 C ATOM 422 C ASP A 27 14.875 -3.687 9.325 1.00 0.00 C ATOM 423 O ASP A 27 14.591 -3.238 10.444 1.00 0.00 O ATOM 424 CB ASP A 27 12.981 -4.137 7.730 1.00 0.00 C ATOM 425 CG ASP A 27 12.062 -4.391 8.912 1.00 0.00 C ATOM 426 OD1 ASP A 27 11.327 -3.475 9.334 1.00 0.00 O ATOM 427 OD2 ASP A 27 12.029 -5.545 9.415 1.00 0.00 O ATOM 0 H ASP A 27 14.905 -3.800 6.171 1.00 0.00 H new ATOM 0 HA ASP A 27 13.768 -2.206 8.244 1.00 0.00 H new ATOM 0 HB2 ASP A 27 12.401 -3.702 6.916 1.00 0.00 H new ATOM 0 HB3 ASP A 27 13.371 -5.090 7.371 1.00 0.00 H new ATOM 432 N GLU A 28 15.814 -4.587 9.135 1.00 0.00 N ATOM 433 CA GLU A 28 16.603 -5.154 10.225 1.00 0.00 C ATOM 434 C GLU A 28 17.556 -4.112 10.831 1.00 0.00 C ATOM 435 O GLU A 28 17.691 -4.009 12.050 1.00 0.00 O ATOM 436 CB GLU A 28 17.402 -6.344 9.706 1.00 0.00 C ATOM 437 CG GLU A 28 16.539 -7.466 9.166 1.00 0.00 C ATOM 438 CD GLU A 28 17.341 -8.547 8.508 1.00 0.00 C ATOM 439 OE1 GLU A 28 17.915 -9.398 9.204 1.00 0.00 O ATOM 440 OE2 GLU A 28 17.429 -8.562 7.276 1.00 0.00 O ATOM 0 H GLU A 28 16.059 -4.954 8.215 1.00 0.00 H new ATOM 0 HA GLU A 28 15.919 -5.478 11.009 1.00 0.00 H new ATOM 0 HB2 GLU A 28 18.075 -6.004 8.919 1.00 0.00 H new ATOM 0 HB3 GLU A 28 18.025 -6.732 10.512 1.00 0.00 H new ATOM 0 HG2 GLU A 28 15.957 -7.896 9.981 1.00 0.00 H new ATOM 0 HG3 GLU A 28 15.828 -7.058 8.448 1.00 0.00 H new ATOM 447 N SER A 29 18.191 -3.343 9.977 1.00 0.00 N ATOM 448 CA SER A 29 19.151 -2.343 10.407 1.00 0.00 C ATOM 449 C SER A 29 18.460 -0.991 10.697 1.00 0.00 C ATOM 450 O SER A 29 18.715 -0.337 11.714 1.00 0.00 O ATOM 451 CB SER A 29 20.213 -2.205 9.316 1.00 0.00 C ATOM 452 OG SER A 29 19.593 -2.076 8.035 1.00 0.00 O ATOM 0 H SER A 29 18.060 -3.390 8.967 1.00 0.00 H new ATOM 0 HA SER A 29 19.620 -2.656 11.340 1.00 0.00 H new ATOM 0 HB2 SER A 29 20.838 -1.334 9.515 1.00 0.00 H new ATOM 0 HB3 SER A 29 20.868 -3.076 9.325 1.00 0.00 H new ATOM 0 HG SER A 29 19.292 -2.956 7.727 1.00 0.00 H new ATOM 458 N ASN A 30 17.582 -0.629 9.803 1.00 0.00 N ATOM 459 CA ASN A 30 16.783 0.588 9.803 1.00 0.00 C ATOM 460 C ASN A 30 17.605 1.862 9.738 1.00 0.00 C ATOM 461 O ASN A 30 17.802 2.565 10.727 1.00 0.00 O ATOM 462 CB ASN A 30 15.689 0.610 10.877 1.00 0.00 C ATOM 463 CG ASN A 30 14.785 1.825 10.762 1.00 0.00 C ATOM 464 OD1 ASN A 30 14.633 2.411 9.680 1.00 0.00 O ATOM 465 ND2 ASN A 30 14.158 2.191 11.844 1.00 0.00 N ATOM 0 H ASN A 30 17.384 -1.213 8.991 1.00 0.00 H new ATOM 0 HA ASN A 30 16.241 0.562 8.858 1.00 0.00 H new ATOM 0 HB2 ASN A 30 15.087 -0.295 10.797 1.00 0.00 H new ATOM 0 HB3 ASN A 30 16.153 0.598 11.863 1.00 0.00 H new ATOM 0 HD21 ASN A 30 13.517 2.984 11.818 1.00 0.00 H new ATOM 0 HD22 ASN A 30 14.308 1.685 12.717 1.00 0.00 H new ATOM 472 N ALA A 31 18.122 2.117 8.548 1.00 0.00 N ATOM 473 CA ALA A 31 18.921 3.307 8.249 1.00 0.00 C ATOM 474 C ALA A 31 18.090 4.571 8.262 1.00 0.00 C ATOM 475 O ALA A 31 18.597 5.675 8.461 1.00 0.00 O ATOM 476 CB ALA A 31 19.634 3.157 6.919 1.00 0.00 C ATOM 0 H ALA A 31 18.000 1.498 7.747 1.00 0.00 H new ATOM 0 HA ALA A 31 19.665 3.398 9.040 1.00 0.00 H new ATOM 0 HB1 ALA A 31 20.221 4.053 6.718 1.00 0.00 H new ATOM 0 HB2 ALA A 31 20.295 2.291 6.956 1.00 0.00 H new ATOM 0 HB3 ALA A 31 18.899 3.019 6.126 1.00 0.00 H new ATOM 482 N LEU A 32 16.823 4.404 8.046 1.00 0.00 N ATOM 483 CA LEU A 32 15.919 5.519 7.929 1.00 0.00 C ATOM 484 C LEU A 32 15.393 5.979 9.282 1.00 0.00 C ATOM 485 O LEU A 32 14.890 7.086 9.410 1.00 0.00 O ATOM 486 CB LEU A 32 14.808 5.183 6.925 1.00 0.00 C ATOM 487 CG LEU A 32 15.105 5.486 5.445 1.00 0.00 C ATOM 488 CD1 LEU A 32 16.478 5.012 4.998 1.00 0.00 C ATOM 489 CD2 LEU A 32 14.092 4.814 4.607 1.00 0.00 C ATOM 0 H LEU A 32 16.379 3.491 7.945 1.00 0.00 H new ATOM 0 HA LEU A 32 16.467 6.376 7.538 1.00 0.00 H new ATOM 0 HB2 LEU A 32 14.575 4.122 7.016 1.00 0.00 H new ATOM 0 HB3 LEU A 32 13.911 5.732 7.212 1.00 0.00 H new ATOM 0 HG LEU A 32 15.078 6.570 5.333 1.00 0.00 H new ATOM 0 HD11 LEU A 32 16.623 5.257 3.946 1.00 0.00 H new ATOM 0 HD12 LEU A 32 17.245 5.506 5.594 1.00 0.00 H new ATOM 0 HD13 LEU A 32 16.552 3.933 5.133 1.00 0.00 H new ATOM 0 HD21 LEU A 32 14.293 5.022 3.556 1.00 0.00 H new ATOM 0 HD22 LEU A 32 14.134 3.738 4.778 1.00 0.00 H new ATOM 0 HD23 LEU A 32 13.101 5.185 4.867 1.00 0.00 H new ATOM 501 N GLY A 33 15.516 5.118 10.275 1.00 0.00 N ATOM 502 CA GLY A 33 15.167 5.452 11.656 1.00 0.00 C ATOM 503 C GLY A 33 13.677 5.428 11.935 1.00 0.00 C ATOM 504 O GLY A 33 13.247 5.676 13.054 1.00 0.00 O ATOM 0 H GLY A 33 15.860 4.165 10.154 1.00 0.00 H new ATOM 0 HA2 GLY A 33 15.664 4.750 12.326 1.00 0.00 H new ATOM 0 HA3 GLY A 33 15.555 6.444 11.889 1.00 0.00 H new ATOM 508 N LYS A 34 12.903 5.088 10.940 1.00 0.00 N ATOM 509 CA LYS A 34 11.463 5.019 11.055 1.00 0.00 C ATOM 510 C LYS A 34 10.951 3.826 10.287 1.00 0.00 C ATOM 511 O LYS A 34 11.711 3.168 9.569 1.00 0.00 O ATOM 512 CB LYS A 34 10.799 6.308 10.539 1.00 0.00 C ATOM 513 CG LYS A 34 10.937 7.526 11.451 1.00 0.00 C ATOM 514 CD LYS A 34 10.344 8.791 10.815 1.00 0.00 C ATOM 515 CE LYS A 34 8.852 8.654 10.479 1.00 0.00 C ATOM 516 NZ LYS A 34 8.010 8.413 11.673 1.00 0.00 N ATOM 0 H LYS A 34 13.255 4.847 10.013 1.00 0.00 H new ATOM 0 HA LYS A 34 11.207 4.911 12.109 1.00 0.00 H new ATOM 0 HB2 LYS A 34 11.227 6.553 9.567 1.00 0.00 H new ATOM 0 HB3 LYS A 34 9.739 6.112 10.381 1.00 0.00 H new ATOM 0 HG2 LYS A 34 10.436 7.328 12.399 1.00 0.00 H new ATOM 0 HG3 LYS A 34 11.990 7.693 11.676 1.00 0.00 H new ATOM 0 HD2 LYS A 34 10.481 9.631 11.496 1.00 0.00 H new ATOM 0 HD3 LYS A 34 10.895 9.025 9.904 1.00 0.00 H new ATOM 0 HE2 LYS A 34 8.513 9.561 9.979 1.00 0.00 H new ATOM 0 HE3 LYS A 34 8.718 7.833 9.775 1.00 0.00 H new ATOM 0 HZ1 LYS A 34 7.014 8.329 11.384 1.00 0.00 H new ATOM 0 HZ2 LYS A 34 8.311 7.533 12.138 1.00 0.00 H new ATOM 0 HZ3 LYS A 34 8.113 9.208 12.336 1.00 0.00 H new ATOM 530 N LYS A 35 9.682 3.555 10.411 1.00 0.00 N ATOM 531 CA LYS A 35 9.073 2.460 9.700 1.00 0.00 C ATOM 532 C LYS A 35 8.807 2.822 8.262 1.00 0.00 C ATOM 533 O LYS A 35 7.820 3.493 7.945 1.00 0.00 O ATOM 534 CB LYS A 35 7.785 1.980 10.383 1.00 0.00 C ATOM 535 CG LYS A 35 7.970 1.095 11.622 1.00 0.00 C ATOM 536 CD LYS A 35 7.978 -0.410 11.274 1.00 0.00 C ATOM 537 CE LYS A 35 9.178 -0.849 10.436 1.00 0.00 C ATOM 538 NZ LYS A 35 9.053 -2.256 10.002 1.00 0.00 N ATOM 0 H LYS A 35 9.041 4.082 11.004 1.00 0.00 H new ATOM 0 HA LYS A 35 9.785 1.635 9.719 1.00 0.00 H new ATOM 0 HB2 LYS A 35 7.202 2.855 10.670 1.00 0.00 H new ATOM 0 HB3 LYS A 35 7.194 1.428 9.652 1.00 0.00 H new ATOM 0 HG2 LYS A 35 8.906 1.356 12.115 1.00 0.00 H new ATOM 0 HG3 LYS A 35 7.168 1.297 12.332 1.00 0.00 H new ATOM 0 HD2 LYS A 35 7.964 -0.986 12.199 1.00 0.00 H new ATOM 0 HD3 LYS A 35 7.063 -0.652 10.734 1.00 0.00 H new ATOM 0 HE2 LYS A 35 9.267 -0.204 9.562 1.00 0.00 H new ATOM 0 HE3 LYS A 35 10.092 -0.727 11.017 1.00 0.00 H new ATOM 0 HZ1 LYS A 35 9.993 -2.629 9.758 1.00 0.00 H new ATOM 0 HZ2 LYS A 35 8.645 -2.822 10.773 1.00 0.00 H new ATOM 0 HZ3 LYS A 35 8.433 -2.308 9.169 1.00 0.00 H new ATOM 552 N PHE A 36 9.728 2.450 7.409 1.00 0.00 N ATOM 553 CA PHE A 36 9.525 2.597 5.997 1.00 0.00 C ATOM 554 C PHE A 36 8.578 1.500 5.555 1.00 0.00 C ATOM 555 O PHE A 36 7.495 1.766 5.094 1.00 0.00 O ATOM 556 CB PHE A 36 10.874 2.589 5.190 1.00 0.00 C ATOM 557 CG PHE A 36 11.695 1.328 5.321 1.00 0.00 C ATOM 558 CD1 PHE A 36 12.388 1.070 6.485 1.00 0.00 C ATOM 559 CD2 PHE A 36 11.740 0.381 4.292 1.00 0.00 C ATOM 560 CE1 PHE A 36 13.104 -0.082 6.628 1.00 0.00 C ATOM 561 CE2 PHE A 36 12.456 -0.776 4.445 1.00 0.00 C ATOM 562 CZ PHE A 36 13.135 -1.004 5.607 1.00 0.00 C ATOM 0 H PHE A 36 10.626 2.043 7.672 1.00 0.00 H new ATOM 0 HA PHE A 36 9.086 3.572 5.787 1.00 0.00 H new ATOM 0 HB2 PHE A 36 10.649 2.749 4.136 1.00 0.00 H new ATOM 0 HB3 PHE A 36 11.480 3.434 5.518 1.00 0.00 H new ATOM 0 HD1 PHE A 36 12.364 1.788 7.292 1.00 0.00 H new ATOM 0 HD2 PHE A 36 11.206 0.564 3.371 1.00 0.00 H new ATOM 0 HE1 PHE A 36 13.647 -0.271 7.543 1.00 0.00 H new ATOM 0 HE2 PHE A 36 12.483 -1.506 3.649 1.00 0.00 H new ATOM 0 HZ PHE A 36 13.701 -1.916 5.726 1.00 0.00 H new ATOM 572 N ILE A 37 8.965 0.272 5.803 1.00 0.00 N ATOM 573 CA ILE A 37 8.158 -0.850 5.476 1.00 0.00 C ATOM 574 C ILE A 37 7.135 -1.003 6.601 1.00 0.00 C ATOM 575 O ILE A 37 7.471 -1.355 7.744 1.00 0.00 O ATOM 576 CB ILE A 37 9.055 -2.151 5.221 1.00 0.00 C ATOM 577 CG1 ILE A 37 8.290 -3.370 4.676 1.00 0.00 C ATOM 578 CG2 ILE A 37 9.876 -2.562 6.413 1.00 0.00 C ATOM 579 CD1 ILE A 37 7.257 -3.982 5.599 1.00 0.00 C ATOM 0 H ILE A 37 9.856 0.035 6.240 1.00 0.00 H new ATOM 0 HA ILE A 37 7.624 -0.707 4.537 1.00 0.00 H new ATOM 0 HB ILE A 37 9.730 -1.818 4.433 1.00 0.00 H new ATOM 0 HG12 ILE A 37 7.792 -3.076 3.752 1.00 0.00 H new ATOM 0 HG13 ILE A 37 9.015 -4.141 4.416 1.00 0.00 H new ATOM 0 HG21 ILE A 37 10.457 -3.450 6.166 1.00 0.00 H new ATOM 0 HG22 ILE A 37 10.551 -1.751 6.687 1.00 0.00 H new ATOM 0 HG23 ILE A 37 9.215 -2.783 7.251 1.00 0.00 H new ATOM 0 HD11 ILE A 37 6.786 -4.832 5.105 1.00 0.00 H new ATOM 0 HD12 ILE A 37 7.742 -4.318 6.516 1.00 0.00 H new ATOM 0 HD13 ILE A 37 6.499 -3.237 5.842 1.00 0.00 H new ATOM 591 N ILE A 38 5.930 -0.642 6.297 1.00 0.00 N ATOM 592 CA ILE A 38 4.861 -0.712 7.245 1.00 0.00 C ATOM 593 C ILE A 38 4.256 -2.094 7.231 1.00 0.00 C ATOM 594 O ILE A 38 4.197 -2.770 8.254 1.00 0.00 O ATOM 595 CB ILE A 38 3.779 0.333 6.921 1.00 0.00 C ATOM 596 CG1 ILE A 38 4.316 1.759 7.142 1.00 0.00 C ATOM 597 CG2 ILE A 38 2.520 0.065 7.726 1.00 0.00 C ATOM 598 CD1 ILE A 38 3.339 2.855 6.768 1.00 0.00 C ATOM 0 H ILE A 38 5.657 -0.288 5.380 1.00 0.00 H new ATOM 0 HA ILE A 38 5.262 -0.501 8.236 1.00 0.00 H new ATOM 0 HB ILE A 38 3.514 0.249 5.867 1.00 0.00 H new ATOM 0 HG12 ILE A 38 4.589 1.874 8.191 1.00 0.00 H new ATOM 0 HG13 ILE A 38 5.228 1.886 6.559 1.00 0.00 H new ATOM 0 HG21 ILE A 38 1.767 0.814 7.483 1.00 0.00 H new ATOM 0 HG22 ILE A 38 2.137 -0.926 7.484 1.00 0.00 H new ATOM 0 HG23 ILE A 38 2.751 0.114 8.790 1.00 0.00 H new ATOM 0 HD11 ILE A 38 3.795 3.828 6.954 1.00 0.00 H new ATOM 0 HD12 ILE A 38 3.083 2.770 5.712 1.00 0.00 H new ATOM 0 HD13 ILE A 38 2.435 2.757 7.369 1.00 0.00 H new ATOM 610 N GLN A 39 3.856 -2.535 6.076 1.00 0.00 N ATOM 611 CA GLN A 39 3.300 -3.835 5.973 1.00 0.00 C ATOM 612 C GLN A 39 3.841 -4.534 4.791 1.00 0.00 C ATOM 613 O GLN A 39 4.141 -3.904 3.752 1.00 0.00 O ATOM 614 CB GLN A 39 1.762 -3.865 5.932 1.00 0.00 C ATOM 615 CG GLN A 39 1.141 -3.168 4.732 1.00 0.00 C ATOM 616 CD GLN A 39 -0.159 -3.826 4.253 1.00 0.00 C ATOM 617 OE1 GLN A 39 -1.040 -3.164 3.741 1.00 0.00 O ATOM 618 NE2 GLN A 39 -0.266 -5.144 4.370 1.00 0.00 N ATOM 0 H GLN A 39 3.907 -2.012 5.202 1.00 0.00 H new ATOM 0 HA GLN A 39 3.592 -4.349 6.889 1.00 0.00 H new ATOM 0 HB2 GLN A 39 1.433 -4.904 5.941 1.00 0.00 H new ATOM 0 HB3 GLN A 39 1.379 -3.402 6.841 1.00 0.00 H new ATOM 0 HG2 GLN A 39 0.940 -2.128 4.989 1.00 0.00 H new ATOM 0 HG3 GLN A 39 1.860 -3.161 3.913 1.00 0.00 H new ATOM 0 HE21 GLN A 39 0.486 -5.680 4.803 1.00 0.00 H new ATOM 0 HE22 GLN A 39 -1.100 -5.620 4.027 1.00 0.00 H new ATOM 627 N ASP A 40 4.014 -5.799 4.948 1.00 0.00 N ATOM 628 CA ASP A 40 4.389 -6.630 3.870 1.00 0.00 C ATOM 629 C ASP A 40 3.140 -7.069 3.189 1.00 0.00 C ATOM 630 O ASP A 40 2.106 -7.287 3.836 1.00 0.00 O ATOM 631 CB ASP A 40 5.192 -7.854 4.318 1.00 0.00 C ATOM 632 CG ASP A 40 6.602 -7.524 4.714 1.00 0.00 C ATOM 633 OD1 ASP A 40 7.485 -7.520 3.839 1.00 0.00 O ATOM 634 OD2 ASP A 40 6.864 -7.273 5.906 1.00 0.00 O ATOM 0 H ASP A 40 3.897 -6.286 5.837 1.00 0.00 H new ATOM 0 HA ASP A 40 5.037 -6.065 3.201 1.00 0.00 H new ATOM 0 HB2 ASP A 40 4.685 -8.324 5.161 1.00 0.00 H new ATOM 0 HB3 ASP A 40 5.210 -8.584 3.509 1.00 0.00 H new ATOM 639 N ILE A 41 3.206 -7.128 1.927 1.00 0.00 N ATOM 640 CA ILE A 41 2.136 -7.564 1.099 1.00 0.00 C ATOM 641 C ILE A 41 2.758 -8.613 0.169 1.00 0.00 C ATOM 642 O ILE A 41 3.911 -8.461 -0.204 1.00 0.00 O ATOM 643 CB ILE A 41 1.411 -6.335 0.409 1.00 0.00 C ATOM 644 CG1 ILE A 41 2.351 -5.124 0.389 1.00 0.00 C ATOM 645 CG2 ILE A 41 0.116 -5.958 1.159 1.00 0.00 C ATOM 646 CD1 ILE A 41 1.745 -3.853 -0.122 1.00 0.00 C ATOM 0 H ILE A 41 4.041 -6.864 1.404 1.00 0.00 H new ATOM 0 HA ILE A 41 1.313 -8.032 1.639 1.00 0.00 H new ATOM 0 HB ILE A 41 1.152 -6.625 -0.609 1.00 0.00 H new ATOM 0 HG12 ILE A 41 2.717 -4.952 1.401 1.00 0.00 H new ATOM 0 HG13 ILE A 41 3.217 -5.367 -0.226 1.00 0.00 H new ATOM 0 HG21 ILE A 41 -0.359 -5.112 0.662 1.00 0.00 H new ATOM 0 HG22 ILE A 41 -0.566 -6.809 1.158 1.00 0.00 H new ATOM 0 HG23 ILE A 41 0.357 -5.687 2.187 1.00 0.00 H new ATOM 0 HD11 ILE A 41 2.490 -3.058 -0.096 1.00 0.00 H new ATOM 0 HD12 ILE A 41 1.406 -3.998 -1.148 1.00 0.00 H new ATOM 0 HD13 ILE A 41 0.897 -3.576 0.505 1.00 0.00 H new ATOM 658 N ASP A 42 2.000 -9.626 -0.206 1.00 0.00 N ATOM 659 CA ASP A 42 2.530 -10.965 -0.659 1.00 0.00 C ATOM 660 C ASP A 42 3.854 -10.987 -1.388 1.00 0.00 C ATOM 661 O ASP A 42 3.932 -10.809 -2.602 1.00 0.00 O ATOM 662 CB ASP A 42 1.526 -11.787 -1.395 1.00 0.00 C ATOM 663 CG ASP A 42 1.967 -13.227 -1.600 1.00 0.00 C ATOM 664 OD1 ASP A 42 2.623 -13.538 -2.601 1.00 0.00 O ATOM 665 OD2 ASP A 42 1.640 -14.094 -0.743 1.00 0.00 O ATOM 0 H ASP A 42 0.981 -9.574 -0.216 1.00 0.00 H new ATOM 0 HA ASP A 42 2.742 -11.424 0.307 1.00 0.00 H new ATOM 0 HB2 ASP A 42 0.584 -11.777 -0.846 1.00 0.00 H new ATOM 0 HB3 ASP A 42 1.334 -11.331 -2.366 1.00 0.00 H new ATOM 670 N ASP A 43 4.862 -11.111 -0.561 1.00 0.00 N ATOM 671 CA ASP A 43 6.321 -11.348 -0.831 1.00 0.00 C ATOM 672 C ASP A 43 7.032 -10.394 -1.748 1.00 0.00 C ATOM 673 O ASP A 43 8.254 -10.266 -1.689 1.00 0.00 O ATOM 674 CB ASP A 43 6.646 -12.791 -1.201 1.00 0.00 C ATOM 675 CG ASP A 43 6.555 -13.720 -0.025 1.00 0.00 C ATOM 676 OD1 ASP A 43 7.345 -13.568 0.942 1.00 0.00 O ATOM 677 OD2 ASP A 43 5.719 -14.649 -0.041 1.00 0.00 O ATOM 0 H ASP A 43 4.696 -11.046 0.443 1.00 0.00 H new ATOM 0 HA ASP A 43 6.736 -11.124 0.152 1.00 0.00 H new ATOM 0 HB2 ASP A 43 5.960 -13.127 -1.979 1.00 0.00 H new ATOM 0 HB3 ASP A 43 7.651 -12.838 -1.620 1.00 0.00 H new ATOM 682 N THR A 44 6.327 -9.752 -2.572 1.00 0.00 N ATOM 683 CA THR A 44 6.948 -8.867 -3.516 1.00 0.00 C ATOM 684 C THR A 44 6.540 -7.439 -3.254 1.00 0.00 C ATOM 685 O THR A 44 7.261 -6.508 -3.572 1.00 0.00 O ATOM 686 CB THR A 44 6.568 -9.230 -4.956 1.00 0.00 C ATOM 687 OG1 THR A 44 6.501 -10.667 -5.095 1.00 0.00 O ATOM 688 CG2 THR A 44 7.629 -8.697 -5.906 1.00 0.00 C ATOM 0 H THR A 44 5.310 -9.806 -2.633 1.00 0.00 H new ATOM 0 HA THR A 44 8.026 -8.973 -3.394 1.00 0.00 H new ATOM 0 HB THR A 44 5.598 -8.791 -5.192 1.00 0.00 H new ATOM 0 HG1 THR A 44 6.256 -10.896 -6.016 1.00 0.00 H new ATOM 0 HG21 THR A 44 7.362 -8.954 -6.931 1.00 0.00 H new ATOM 0 HG22 THR A 44 7.694 -7.613 -5.808 1.00 0.00 H new ATOM 0 HG23 THR A 44 8.594 -9.142 -5.661 1.00 0.00 H new ATOM 696 N HIS A 45 5.410 -7.260 -2.638 1.00 0.00 N ATOM 697 CA HIS A 45 4.917 -5.939 -2.454 1.00 0.00 C ATOM 698 C HIS A 45 5.294 -5.445 -1.073 1.00 0.00 C ATOM 699 O HIS A 45 5.406 -6.224 -0.130 1.00 0.00 O ATOM 700 CB HIS A 45 3.395 -5.896 -2.636 1.00 0.00 C ATOM 701 CG HIS A 45 2.914 -6.267 -4.001 1.00 0.00 C ATOM 702 ND1 HIS A 45 2.793 -5.360 -5.021 1.00 0.00 N ATOM 703 CD2 HIS A 45 2.508 -7.456 -4.508 1.00 0.00 C ATOM 704 CE1 HIS A 45 2.330 -5.972 -6.099 1.00 0.00 C ATOM 705 NE2 HIS A 45 2.153 -7.240 -5.811 1.00 0.00 N ATOM 0 H HIS A 45 4.823 -8.004 -2.261 1.00 0.00 H new ATOM 0 HA HIS A 45 5.366 -5.289 -3.205 1.00 0.00 H new ATOM 0 HB2 HIS A 45 2.938 -6.569 -1.910 1.00 0.00 H new ATOM 0 HB3 HIS A 45 3.044 -4.890 -2.404 1.00 0.00 H new ATOM 0 HD2 HIS A 45 2.472 -8.398 -3.982 1.00 0.00 H new ATOM 0 HE1 HIS A 45 2.132 -5.507 -7.053 1.00 0.00 H new ATOM 0 HE2 HIS A 45 1.806 -7.950 -6.456 1.00 0.00 H new ATOM 714 N VAL A 46 5.502 -4.185 -0.955 1.00 0.00 N ATOM 715 CA VAL A 46 5.789 -3.568 0.319 1.00 0.00 C ATOM 716 C VAL A 46 5.079 -2.249 0.389 1.00 0.00 C ATOM 717 O VAL A 46 4.943 -1.565 -0.627 1.00 0.00 O ATOM 718 CB VAL A 46 7.338 -3.425 0.593 1.00 0.00 C ATOM 719 CG1 VAL A 46 7.654 -2.213 1.478 1.00 0.00 C ATOM 720 CG2 VAL A 46 7.866 -4.694 1.272 1.00 0.00 C ATOM 0 H VAL A 46 5.481 -3.533 -1.739 1.00 0.00 H new ATOM 0 HA VAL A 46 5.419 -4.218 1.112 1.00 0.00 H new ATOM 0 HB VAL A 46 7.827 -3.279 -0.370 1.00 0.00 H new ATOM 0 HG11 VAL A 46 8.730 -2.152 1.641 1.00 0.00 H new ATOM 0 HG12 VAL A 46 7.310 -1.303 0.986 1.00 0.00 H new ATOM 0 HG13 VAL A 46 7.147 -2.321 2.437 1.00 0.00 H new ATOM 0 HG21 VAL A 46 8.935 -4.589 1.458 1.00 0.00 H new ATOM 0 HG22 VAL A 46 7.346 -4.844 2.218 1.00 0.00 H new ATOM 0 HG23 VAL A 46 7.693 -5.553 0.623 1.00 0.00 H new ATOM 730 N PHE A 47 4.554 -1.930 1.535 1.00 0.00 N ATOM 731 CA PHE A 47 3.924 -0.676 1.703 1.00 0.00 C ATOM 732 C PHE A 47 4.813 0.216 2.546 1.00 0.00 C ATOM 733 O PHE A 47 5.203 -0.155 3.664 1.00 0.00 O ATOM 734 CB PHE A 47 2.563 -0.834 2.347 1.00 0.00 C ATOM 735 CG PHE A 47 1.737 0.385 2.211 1.00 0.00 C ATOM 736 CD1 PHE A 47 1.124 0.663 1.008 1.00 0.00 C ATOM 737 CD2 PHE A 47 1.578 1.256 3.259 1.00 0.00 C ATOM 738 CE1 PHE A 47 0.364 1.786 0.851 1.00 0.00 C ATOM 739 CE2 PHE A 47 0.817 2.384 3.106 1.00 0.00 C ATOM 740 CZ PHE A 47 0.209 2.646 1.899 1.00 0.00 C ATOM 0 H PHE A 47 4.555 -2.528 2.361 1.00 0.00 H new ATOM 0 HA PHE A 47 3.773 -0.219 0.725 1.00 0.00 H new ATOM 0 HB2 PHE A 47 2.043 -1.676 1.891 1.00 0.00 H new ATOM 0 HB3 PHE A 47 2.688 -1.070 3.404 1.00 0.00 H new ATOM 0 HD1 PHE A 47 1.247 -0.017 0.178 1.00 0.00 H new ATOM 0 HD2 PHE A 47 2.054 1.052 4.207 1.00 0.00 H new ATOM 0 HE1 PHE A 47 -0.111 1.992 -0.096 1.00 0.00 H new ATOM 0 HE2 PHE A 47 0.694 3.068 3.932 1.00 0.00 H new ATOM 0 HZ PHE A 47 -0.393 3.535 1.781 1.00 0.00 H new ATOM 750 N VAL A 48 5.131 1.357 2.014 1.00 0.00 N ATOM 751 CA VAL A 48 5.968 2.336 2.665 1.00 0.00 C ATOM 752 C VAL A 48 5.239 3.662 2.645 1.00 0.00 C ATOM 753 O VAL A 48 4.454 3.894 1.770 1.00 0.00 O ATOM 754 CB VAL A 48 7.377 2.428 1.969 1.00 0.00 C ATOM 755 CG1 VAL A 48 7.254 2.593 0.477 1.00 0.00 C ATOM 756 CG2 VAL A 48 8.221 3.557 2.534 1.00 0.00 C ATOM 0 H VAL A 48 4.810 1.647 1.090 1.00 0.00 H new ATOM 0 HA VAL A 48 6.158 2.044 3.698 1.00 0.00 H new ATOM 0 HB VAL A 48 7.878 1.483 2.179 1.00 0.00 H new ATOM 0 HG11 VAL A 48 8.248 2.653 0.034 1.00 0.00 H new ATOM 0 HG12 VAL A 48 6.721 1.739 0.059 1.00 0.00 H new ATOM 0 HG13 VAL A 48 6.703 3.507 0.256 1.00 0.00 H new ATOM 0 HG21 VAL A 48 9.184 3.582 2.024 1.00 0.00 H new ATOM 0 HG22 VAL A 48 7.706 4.506 2.384 1.00 0.00 H new ATOM 0 HG23 VAL A 48 8.379 3.394 3.600 1.00 0.00 H new ATOM 766 N ILE A 49 5.446 4.510 3.605 1.00 0.00 N ATOM 767 CA ILE A 49 4.690 5.745 3.605 1.00 0.00 C ATOM 768 C ILE A 49 5.437 6.855 2.854 1.00 0.00 C ATOM 769 O ILE A 49 6.677 6.848 2.767 1.00 0.00 O ATOM 770 CB ILE A 49 4.219 6.167 5.015 1.00 0.00 C ATOM 771 CG1 ILE A 49 3.111 7.225 4.936 1.00 0.00 C ATOM 772 CG2 ILE A 49 5.382 6.650 5.875 1.00 0.00 C ATOM 773 CD1 ILE A 49 2.465 7.531 6.264 1.00 0.00 C ATOM 0 H ILE A 49 6.103 4.388 4.375 1.00 0.00 H new ATOM 0 HA ILE A 49 3.770 5.557 3.052 1.00 0.00 H new ATOM 0 HB ILE A 49 3.803 5.283 5.497 1.00 0.00 H new ATOM 0 HG12 ILE A 49 3.528 8.144 4.525 1.00 0.00 H new ATOM 0 HG13 ILE A 49 2.345 6.884 4.240 1.00 0.00 H new ATOM 0 HG21 ILE A 49 5.012 6.938 6.859 1.00 0.00 H new ATOM 0 HG22 ILE A 49 6.113 5.848 5.983 1.00 0.00 H new ATOM 0 HG23 ILE A 49 5.854 7.509 5.399 1.00 0.00 H new ATOM 0 HD11 ILE A 49 1.692 8.287 6.127 1.00 0.00 H new ATOM 0 HD12 ILE A 49 2.017 6.623 6.668 1.00 0.00 H new ATOM 0 HD13 ILE A 49 3.219 7.904 6.958 1.00 0.00 H new ATOM 785 N ALA A 50 4.676 7.799 2.339 1.00 0.00 N ATOM 786 CA ALA A 50 5.160 8.815 1.431 1.00 0.00 C ATOM 787 C ALA A 50 6.269 9.700 1.990 1.00 0.00 C ATOM 788 O ALA A 50 7.211 10.019 1.271 1.00 0.00 O ATOM 789 CB ALA A 50 4.018 9.652 0.911 1.00 0.00 C ATOM 0 H ALA A 50 3.681 7.882 2.546 1.00 0.00 H new ATOM 0 HA ALA A 50 5.621 8.268 0.609 1.00 0.00 H new ATOM 0 HB1 ALA A 50 4.404 10.410 0.230 1.00 0.00 H new ATOM 0 HB2 ALA A 50 3.311 9.014 0.381 1.00 0.00 H new ATOM 0 HB3 ALA A 50 3.513 10.138 1.746 1.00 0.00 H new ATOM 795 N GLU A 51 6.172 10.075 3.262 1.00 0.00 N ATOM 796 CA GLU A 51 7.159 10.978 3.884 1.00 0.00 C ATOM 797 C GLU A 51 8.585 10.462 3.753 1.00 0.00 C ATOM 798 O GLU A 51 9.509 11.230 3.506 1.00 0.00 O ATOM 799 CB GLU A 51 6.873 11.245 5.378 1.00 0.00 C ATOM 800 CG GLU A 51 5.571 11.974 5.696 1.00 0.00 C ATOM 801 CD GLU A 51 4.351 11.139 5.452 1.00 0.00 C ATOM 802 OE1 GLU A 51 3.980 10.358 6.331 1.00 0.00 O ATOM 803 OE2 GLU A 51 3.746 11.255 4.367 1.00 0.00 O ATOM 0 H GLU A 51 5.425 9.773 3.888 1.00 0.00 H new ATOM 0 HA GLU A 51 7.060 11.913 3.332 1.00 0.00 H new ATOM 0 HB2 GLU A 51 6.867 10.289 5.902 1.00 0.00 H new ATOM 0 HB3 GLU A 51 7.700 11.827 5.786 1.00 0.00 H new ATOM 0 HG2 GLU A 51 5.584 12.289 6.739 1.00 0.00 H new ATOM 0 HG3 GLU A 51 5.511 12.878 5.090 1.00 0.00 H new ATOM 810 N LEU A 52 8.765 9.170 3.865 1.00 0.00 N ATOM 811 CA LEU A 52 10.103 8.632 3.842 1.00 0.00 C ATOM 812 C LEU A 52 10.409 7.728 2.666 1.00 0.00 C ATOM 813 O LEU A 52 11.511 7.187 2.574 1.00 0.00 O ATOM 814 CB LEU A 52 10.514 8.015 5.189 1.00 0.00 C ATOM 815 CG LEU A 52 9.488 7.120 5.892 1.00 0.00 C ATOM 816 CD1 LEU A 52 9.070 5.939 5.047 1.00 0.00 C ATOM 817 CD2 LEU A 52 10.032 6.647 7.211 1.00 0.00 C ATOM 0 H LEU A 52 8.019 8.482 3.971 1.00 0.00 H new ATOM 0 HA LEU A 52 10.740 9.501 3.681 1.00 0.00 H new ATOM 0 HB2 LEU A 52 11.420 7.430 5.030 1.00 0.00 H new ATOM 0 HB3 LEU A 52 10.774 8.828 5.867 1.00 0.00 H new ATOM 0 HG LEU A 52 8.596 7.725 6.058 1.00 0.00 H new ATOM 0 HD11 LEU A 52 8.342 5.339 5.594 1.00 0.00 H new ATOM 0 HD12 LEU A 52 8.622 6.296 4.119 1.00 0.00 H new ATOM 0 HD13 LEU A 52 9.943 5.329 4.817 1.00 0.00 H new ATOM 0 HD21 LEU A 52 9.295 6.012 7.702 1.00 0.00 H new ATOM 0 HD22 LEU A 52 10.947 6.079 7.044 1.00 0.00 H new ATOM 0 HD23 LEU A 52 10.249 7.507 7.844 1.00 0.00 H new ATOM 829 N VAL A 53 9.484 7.580 1.744 1.00 0.00 N ATOM 830 CA VAL A 53 9.782 6.805 0.542 1.00 0.00 C ATOM 831 C VAL A 53 10.806 7.589 -0.277 1.00 0.00 C ATOM 832 O VAL A 53 11.633 7.032 -0.969 1.00 0.00 O ATOM 833 CB VAL A 53 8.531 6.427 -0.300 1.00 0.00 C ATOM 834 CG1 VAL A 53 7.898 7.642 -0.926 1.00 0.00 C ATOM 835 CG2 VAL A 53 8.871 5.385 -1.362 1.00 0.00 C ATOM 0 H VAL A 53 8.543 7.970 1.791 1.00 0.00 H new ATOM 0 HA VAL A 53 10.189 5.842 0.849 1.00 0.00 H new ATOM 0 HB VAL A 53 7.804 5.987 0.383 1.00 0.00 H new ATOM 0 HG11 VAL A 53 7.027 7.340 -1.507 1.00 0.00 H new ATOM 0 HG12 VAL A 53 7.590 8.336 -0.144 1.00 0.00 H new ATOM 0 HG13 VAL A 53 8.619 8.131 -1.581 1.00 0.00 H new ATOM 0 HG21 VAL A 53 7.975 5.142 -1.933 1.00 0.00 H new ATOM 0 HG22 VAL A 53 9.632 5.784 -2.033 1.00 0.00 H new ATOM 0 HG23 VAL A 53 9.249 4.484 -0.879 1.00 0.00 H new ATOM 845 N ASN A 54 10.729 8.896 -0.145 1.00 0.00 N ATOM 846 CA ASN A 54 11.684 9.838 -0.714 1.00 0.00 C ATOM 847 C ASN A 54 13.081 9.511 -0.180 1.00 0.00 C ATOM 848 O ASN A 54 14.073 9.536 -0.905 1.00 0.00 O ATOM 849 CB ASN A 54 11.316 11.266 -0.258 1.00 0.00 C ATOM 850 CG ASN A 54 9.933 11.740 -0.699 1.00 0.00 C ATOM 851 OD1 ASN A 54 9.016 10.953 -0.924 1.00 0.00 O ATOM 852 ND2 ASN A 54 9.758 13.018 -0.759 1.00 0.00 N ATOM 0 H ASN A 54 9.980 9.351 0.376 1.00 0.00 H new ATOM 0 HA ASN A 54 11.664 9.770 -1.802 1.00 0.00 H new ATOM 0 HB2 ASN A 54 11.371 11.311 0.830 1.00 0.00 H new ATOM 0 HB3 ASN A 54 12.063 11.960 -0.644 1.00 0.00 H new ATOM 0 HD21 ASN A 54 8.841 13.397 -0.998 1.00 0.00 H new ATOM 0 HD22 ASN A 54 10.536 13.649 -0.568 1.00 0.00 H new ATOM 859 N VAL A 55 13.116 9.109 1.085 1.00 0.00 N ATOM 860 CA VAL A 55 14.352 8.833 1.798 1.00 0.00 C ATOM 861 C VAL A 55 14.887 7.494 1.328 1.00 0.00 C ATOM 862 O VAL A 55 16.089 7.246 1.233 1.00 0.00 O ATOM 863 CB VAL A 55 14.117 8.828 3.334 1.00 0.00 C ATOM 864 CG1 VAL A 55 15.408 8.653 4.088 1.00 0.00 C ATOM 865 CG2 VAL A 55 13.432 10.110 3.769 1.00 0.00 C ATOM 0 H VAL A 55 12.278 8.965 1.648 1.00 0.00 H new ATOM 0 HA VAL A 55 15.081 9.615 1.587 1.00 0.00 H new ATOM 0 HB VAL A 55 13.472 7.981 3.567 1.00 0.00 H new ATOM 0 HG11 VAL A 55 15.207 8.654 5.159 1.00 0.00 H new ATOM 0 HG12 VAL A 55 15.868 7.706 3.806 1.00 0.00 H new ATOM 0 HG13 VAL A 55 16.085 9.472 3.845 1.00 0.00 H new ATOM 0 HG21 VAL A 55 13.275 10.091 4.847 1.00 0.00 H new ATOM 0 HG22 VAL A 55 14.058 10.963 3.509 1.00 0.00 H new ATOM 0 HG23 VAL A 55 12.470 10.198 3.264 1.00 0.00 H new ATOM 875 N LEU A 56 13.971 6.638 1.050 1.00 0.00 N ATOM 876 CA LEU A 56 14.243 5.341 0.537 1.00 0.00 C ATOM 877 C LEU A 56 14.793 5.486 -0.901 1.00 0.00 C ATOM 878 O LEU A 56 15.688 4.767 -1.314 1.00 0.00 O ATOM 879 CB LEU A 56 12.935 4.569 0.571 1.00 0.00 C ATOM 880 CG LEU A 56 12.984 3.059 0.720 1.00 0.00 C ATOM 881 CD1 LEU A 56 13.587 2.382 -0.479 1.00 0.00 C ATOM 882 CD2 LEU A 56 13.737 2.661 1.966 1.00 0.00 C ATOM 0 H LEU A 56 12.977 6.826 1.177 1.00 0.00 H new ATOM 0 HA LEU A 56 14.990 4.806 1.123 1.00 0.00 H new ATOM 0 HB2 LEU A 56 12.340 4.963 1.395 1.00 0.00 H new ATOM 0 HB3 LEU A 56 12.395 4.793 -0.349 1.00 0.00 H new ATOM 0 HG LEU A 56 11.950 2.725 0.804 1.00 0.00 H new ATOM 0 HD11 LEU A 56 13.598 1.304 -0.321 1.00 0.00 H new ATOM 0 HD12 LEU A 56 12.994 2.613 -1.364 1.00 0.00 H new ATOM 0 HD13 LEU A 56 14.607 2.738 -0.623 1.00 0.00 H new ATOM 0 HD21 LEU A 56 13.757 1.574 2.048 1.00 0.00 H new ATOM 0 HD22 LEU A 56 14.758 3.039 1.911 1.00 0.00 H new ATOM 0 HD23 LEU A 56 13.241 3.082 2.841 1.00 0.00 H new ATOM 894 N GLN A 57 14.250 6.444 -1.635 1.00 0.00 N ATOM 895 CA GLN A 57 14.667 6.738 -2.987 1.00 0.00 C ATOM 896 C GLN A 57 16.065 7.248 -3.068 1.00 0.00 C ATOM 897 O GLN A 57 16.820 6.844 -3.950 1.00 0.00 O ATOM 898 CB GLN A 57 13.710 7.661 -3.633 1.00 0.00 C ATOM 899 CG GLN A 57 12.903 6.954 -4.716 1.00 0.00 C ATOM 900 CD GLN A 57 11.957 5.802 -4.268 1.00 0.00 C ATOM 901 OE1 GLN A 57 12.319 5.032 -3.275 1.00 0.00 O flip ATOM 902 NE2 GLN A 57 10.909 5.591 -4.872 1.00 0.00 N flip ATOM 0 H GLN A 57 13.497 7.045 -1.299 1.00 0.00 H new ATOM 0 HA GLN A 57 14.664 5.796 -3.535 1.00 0.00 H new ATOM 0 HB2 GLN A 57 13.034 8.071 -2.883 1.00 0.00 H new ATOM 0 HB3 GLN A 57 14.250 8.501 -4.069 1.00 0.00 H new ATOM 0 HG2 GLN A 57 12.301 7.703 -5.231 1.00 0.00 H new ATOM 0 HG3 GLN A 57 13.603 6.550 -5.448 1.00 0.00 H new ATOM 0 HE21 GLN A 57 10.635 6.197 -5.645 1.00 0.00 H new ATOM 0 HE22 GLN A 57 10.312 4.810 -4.600 1.00 0.00 H new ATOM 1237 N VAL B 5 7.315 -2.914 -12.492 1.00 0.00 N ATOM 1238 CA VAL B 5 7.609 -1.891 -11.539 1.00 0.00 C ATOM 1239 C VAL B 5 6.439 -0.948 -11.502 1.00 0.00 C ATOM 1240 O VAL B 5 6.122 -0.305 -12.510 1.00 0.00 O ATOM 1241 CB VAL B 5 8.899 -1.091 -11.871 1.00 0.00 C ATOM 1242 CG1 VAL B 5 9.076 0.055 -10.880 1.00 0.00 C ATOM 1243 CG2 VAL B 5 10.119 -1.996 -11.840 1.00 0.00 C ATOM 0 HA VAL B 5 7.782 -2.371 -10.576 1.00 0.00 H new ATOM 0 HB VAL B 5 8.798 -0.682 -12.876 1.00 0.00 H new ATOM 0 HG11 VAL B 5 9.983 0.609 -11.122 1.00 0.00 H new ATOM 0 HG12 VAL B 5 8.217 0.723 -10.939 1.00 0.00 H new ATOM 0 HG13 VAL B 5 9.155 -0.347 -9.870 1.00 0.00 H new ATOM 0 HG21 VAL B 5 11.010 -1.414 -12.075 1.00 0.00 H new ATOM 0 HG22 VAL B 5 10.223 -2.433 -10.847 1.00 0.00 H new ATOM 0 HG23 VAL B 5 10.001 -2.792 -12.576 1.00 0.00 H new ATOM 1253 N ASN B 6 5.762 -0.912 -10.404 1.00 0.00 N ATOM 1254 CA ASN B 6 4.692 0.002 -10.250 1.00 0.00 C ATOM 1255 C ASN B 6 4.637 0.438 -8.821 1.00 0.00 C ATOM 1256 O ASN B 6 4.226 -0.305 -7.928 1.00 0.00 O ATOM 1257 CB ASN B 6 3.360 -0.577 -10.694 1.00 0.00 C ATOM 1258 CG ASN B 6 2.459 0.516 -11.200 1.00 0.00 C ATOM 1259 OD1 ASN B 6 1.694 1.119 -10.462 1.00 0.00 O ATOM 1260 ND2 ASN B 6 2.552 0.784 -12.479 1.00 0.00 N ATOM 0 H ASN B 6 5.936 -1.511 -9.597 1.00 0.00 H new ATOM 0 HA ASN B 6 4.876 0.860 -10.897 1.00 0.00 H new ATOM 0 HB2 ASN B 6 3.521 -1.317 -11.478 1.00 0.00 H new ATOM 0 HB3 ASN B 6 2.884 -1.093 -9.860 1.00 0.00 H new ATOM 0 HD21 ASN B 6 1.974 1.517 -12.890 1.00 0.00 H new ATOM 0 HD22 ASN B 6 3.202 0.259 -13.064 1.00 0.00 H new ATOM 1267 N VAL B 7 5.152 1.589 -8.603 1.00 0.00 N ATOM 1268 CA VAL B 7 5.198 2.202 -7.313 1.00 0.00 C ATOM 1269 C VAL B 7 4.357 3.460 -7.411 1.00 0.00 C ATOM 1270 O VAL B 7 4.566 4.267 -8.330 1.00 0.00 O ATOM 1271 CB VAL B 7 6.664 2.592 -6.968 1.00 0.00 C ATOM 1272 CG1 VAL B 7 6.753 3.391 -5.685 1.00 0.00 C ATOM 1273 CG2 VAL B 7 7.559 1.360 -6.903 1.00 0.00 C ATOM 0 H VAL B 7 5.571 2.158 -9.339 1.00 0.00 H new ATOM 0 HA VAL B 7 4.830 1.527 -6.540 1.00 0.00 H new ATOM 0 HB VAL B 7 7.021 3.233 -7.774 1.00 0.00 H new ATOM 0 HG11 VAL B 7 7.795 3.641 -5.484 1.00 0.00 H new ATOM 0 HG12 VAL B 7 6.173 4.308 -5.786 1.00 0.00 H new ATOM 0 HG13 VAL B 7 6.356 2.800 -4.860 1.00 0.00 H new ATOM 0 HG21 VAL B 7 8.578 1.663 -6.660 1.00 0.00 H new ATOM 0 HG22 VAL B 7 7.189 0.682 -6.134 1.00 0.00 H new ATOM 0 HG23 VAL B 7 7.551 0.853 -7.868 1.00 0.00 H new ATOM 1283 N LEU B 8 3.443 3.654 -6.507 1.00 0.00 N ATOM 1284 CA LEU B 8 2.546 4.784 -6.608 1.00 0.00 C ATOM 1285 C LEU B 8 1.984 5.192 -5.257 1.00 0.00 C ATOM 1286 O LEU B 8 2.130 4.466 -4.274 1.00 0.00 O ATOM 1287 CB LEU B 8 1.435 4.543 -7.659 1.00 0.00 C ATOM 1288 CG LEU B 8 0.411 3.441 -7.420 1.00 0.00 C ATOM 1289 CD1 LEU B 8 -0.529 3.408 -8.576 1.00 0.00 C ATOM 1290 CD2 LEU B 8 1.012 2.057 -7.237 1.00 0.00 C ATOM 0 H LEU B 8 3.293 3.055 -5.695 1.00 0.00 H new ATOM 0 HA LEU B 8 3.137 5.629 -6.962 1.00 0.00 H new ATOM 0 HB2 LEU B 8 0.888 5.478 -7.778 1.00 0.00 H new ATOM 0 HB3 LEU B 8 1.924 4.336 -8.611 1.00 0.00 H new ATOM 0 HG LEU B 8 -0.093 3.682 -6.484 1.00 0.00 H new ATOM 0 HD11 LEU B 8 -1.270 2.623 -8.421 1.00 0.00 H new ATOM 0 HD12 LEU B 8 -1.033 4.371 -8.663 1.00 0.00 H new ATOM 0 HD13 LEU B 8 0.027 3.206 -9.491 1.00 0.00 H new ATOM 0 HD21 LEU B 8 0.214 1.333 -7.072 1.00 0.00 H new ATOM 0 HD22 LEU B 8 1.572 1.783 -8.131 1.00 0.00 H new ATOM 0 HD23 LEU B 8 1.681 2.062 -6.377 1.00 0.00 H new ATOM 1302 N LYS B 9 1.310 6.323 -5.230 1.00 0.00 N ATOM 1303 CA LYS B 9 0.894 6.959 -3.996 1.00 0.00 C ATOM 1304 C LYS B 9 -0.636 7.021 -3.910 1.00 0.00 C ATOM 1305 O LYS B 9 -1.308 7.291 -4.908 1.00 0.00 O ATOM 1306 CB LYS B 9 1.545 8.358 -3.988 1.00 0.00 C ATOM 1307 CG LYS B 9 1.482 9.188 -2.692 1.00 0.00 C ATOM 1308 CD LYS B 9 0.101 9.746 -2.409 1.00 0.00 C ATOM 1309 CE LYS B 9 0.099 10.652 -1.203 1.00 0.00 C ATOM 1310 NZ LYS B 9 0.977 11.827 -1.390 1.00 0.00 N ATOM 0 H LYS B 9 1.033 6.831 -6.070 1.00 0.00 H new ATOM 0 HA LYS B 9 1.214 6.395 -3.120 1.00 0.00 H new ATOM 0 HB2 LYS B 9 2.595 8.237 -4.254 1.00 0.00 H new ATOM 0 HB3 LYS B 9 1.081 8.945 -4.781 1.00 0.00 H new ATOM 0 HG2 LYS B 9 1.795 8.566 -1.854 1.00 0.00 H new ATOM 0 HG3 LYS B 9 2.193 10.011 -2.760 1.00 0.00 H new ATOM 0 HD2 LYS B 9 -0.253 10.299 -3.279 1.00 0.00 H new ATOM 0 HD3 LYS B 9 -0.597 8.924 -2.248 1.00 0.00 H new ATOM 0 HE2 LYS B 9 -0.919 10.988 -1.004 1.00 0.00 H new ATOM 0 HE3 LYS B 9 0.426 10.091 -0.328 1.00 0.00 H new ATOM 0 HZ1 LYS B 9 0.725 12.562 -0.699 1.00 0.00 H new ATOM 0 HZ2 LYS B 9 1.968 11.545 -1.250 1.00 0.00 H new ATOM 0 HZ3 LYS B 9 0.856 12.201 -2.353 1.00 0.00 H new ATOM 1324 N GLY B 10 -1.165 6.740 -2.731 1.00 0.00 N ATOM 1325 CA GLY B 10 -2.585 6.754 -2.509 1.00 0.00 C ATOM 1326 C GLY B 10 -2.950 5.976 -1.265 1.00 0.00 C ATOM 1327 O GLY B 10 -2.301 6.126 -0.216 1.00 0.00 O ATOM 0 H GLY B 10 -0.615 6.497 -1.907 1.00 0.00 H new ATOM 0 HA2 GLY B 10 -2.931 7.783 -2.412 1.00 0.00 H new ATOM 0 HA3 GLY B 10 -3.095 6.326 -3.372 1.00 0.00 H new ATOM 1331 N VAL B 11 -3.961 5.147 -1.376 1.00 0.00 N ATOM 1332 CA VAL B 11 -4.451 4.340 -0.282 1.00 0.00 C ATOM 1333 C VAL B 11 -4.516 2.868 -0.710 1.00 0.00 C ATOM 1334 O VAL B 11 -5.027 2.534 -1.782 1.00 0.00 O ATOM 1335 CB VAL B 11 -5.857 4.830 0.210 1.00 0.00 C ATOM 1336 CG1 VAL B 11 -6.390 3.965 1.343 1.00 0.00 C ATOM 1337 CG2 VAL B 11 -5.797 6.283 0.661 1.00 0.00 C ATOM 0 H VAL B 11 -4.476 5.011 -2.246 1.00 0.00 H new ATOM 0 HA VAL B 11 -3.758 4.442 0.553 1.00 0.00 H new ATOM 0 HB VAL B 11 -6.539 4.745 -0.636 1.00 0.00 H new ATOM 0 HG11 VAL B 11 -7.366 4.336 1.656 1.00 0.00 H new ATOM 0 HG12 VAL B 11 -6.487 2.935 1.000 1.00 0.00 H new ATOM 0 HG13 VAL B 11 -5.700 4.003 2.186 1.00 0.00 H new ATOM 0 HG21 VAL B 11 -6.784 6.600 0.998 1.00 0.00 H new ATOM 0 HG22 VAL B 11 -5.085 6.380 1.481 1.00 0.00 H new ATOM 0 HG23 VAL B 11 -5.479 6.910 -0.172 1.00 0.00 H new ATOM 1347 N LEU B 12 -3.981 2.015 0.114 1.00 0.00 N ATOM 1348 CA LEU B 12 -3.958 0.600 -0.136 1.00 0.00 C ATOM 1349 C LEU B 12 -5.024 -0.067 0.700 1.00 0.00 C ATOM 1350 O LEU B 12 -5.168 0.250 1.877 1.00 0.00 O ATOM 1351 CB LEU B 12 -2.606 0.029 0.242 1.00 0.00 C ATOM 1352 CG LEU B 12 -2.459 -1.474 0.088 1.00 0.00 C ATOM 1353 CD1 LEU B 12 -2.549 -1.881 -1.361 1.00 0.00 C ATOM 1354 CD2 LEU B 12 -1.175 -1.945 0.698 1.00 0.00 C ATOM 0 H LEU B 12 -3.541 2.286 0.993 1.00 0.00 H new ATOM 0 HA LEU B 12 -4.142 0.420 -1.195 1.00 0.00 H new ATOM 0 HB2 LEU B 12 -1.844 0.514 -0.368 1.00 0.00 H new ATOM 0 HB3 LEU B 12 -2.399 0.291 1.279 1.00 0.00 H new ATOM 0 HG LEU B 12 -3.283 -1.951 0.619 1.00 0.00 H new ATOM 0 HD11 LEU B 12 -2.440 -2.963 -1.443 1.00 0.00 H new ATOM 0 HD12 LEU B 12 -3.517 -1.582 -1.763 1.00 0.00 H new ATOM 0 HD13 LEU B 12 -1.755 -1.393 -1.926 1.00 0.00 H new ATOM 0 HD21 LEU B 12 -1.089 -3.025 0.577 1.00 0.00 H new ATOM 0 HD22 LEU B 12 -0.336 -1.456 0.202 1.00 0.00 H new ATOM 0 HD23 LEU B 12 -1.164 -1.697 1.759 1.00 0.00 H new ATOM 1366 N ILE B 13 -5.760 -0.971 0.112 1.00 0.00 N ATOM 1367 CA ILE B 13 -6.821 -1.633 0.819 1.00 0.00 C ATOM 1368 C ILE B 13 -6.619 -3.143 0.843 1.00 0.00 C ATOM 1369 O ILE B 13 -6.369 -3.744 -0.207 1.00 0.00 O ATOM 1370 CB ILE B 13 -8.193 -1.472 0.087 1.00 0.00 C ATOM 1371 CG1 ILE B 13 -8.494 -0.057 -0.402 1.00 0.00 C ATOM 1372 CG2 ILE B 13 -9.342 -1.975 0.951 1.00 0.00 C ATOM 1373 CD1 ILE B 13 -8.543 1.017 0.654 1.00 0.00 C ATOM 0 H ILE B 13 -5.643 -1.266 -0.857 1.00 0.00 H new ATOM 0 HA ILE B 13 -6.814 -1.184 1.812 1.00 0.00 H new ATOM 0 HB ILE B 13 -8.101 -2.089 -0.807 1.00 0.00 H new ATOM 0 HG12 ILE B 13 -7.738 0.219 -1.137 1.00 0.00 H new ATOM 0 HG13 ILE B 13 -9.452 -0.071 -0.921 1.00 0.00 H new ATOM 0 HG21 ILE B 13 -10.283 -1.850 0.415 1.00 0.00 H new ATOM 0 HG22 ILE B 13 -9.192 -3.030 1.178 1.00 0.00 H new ATOM 0 HG23 ILE B 13 -9.375 -1.405 1.880 1.00 0.00 H new ATOM 0 HD11 ILE B 13 -8.764 1.977 0.187 1.00 0.00 H new ATOM 0 HD12 ILE B 13 -9.321 0.779 1.379 1.00 0.00 H new ATOM 0 HD13 ILE B 13 -7.579 1.073 1.160 1.00 0.00 H new ATOM 1385 N GLU B 14 -6.658 -3.745 2.008 1.00 0.00 N ATOM 1386 CA GLU B 14 -7.029 -5.127 2.055 1.00 0.00 C ATOM 1387 C GLU B 14 -8.087 -5.238 3.067 1.00 0.00 C ATOM 1388 O GLU B 14 -7.861 -4.945 4.249 1.00 0.00 O ATOM 1389 CB GLU B 14 -5.967 -6.146 2.460 1.00 0.00 C ATOM 1390 CG GLU B 14 -6.539 -7.582 2.299 1.00 0.00 C ATOM 1391 CD GLU B 14 -5.714 -8.744 2.818 1.00 0.00 C ATOM 1392 OE1 GLU B 14 -4.809 -9.198 2.119 1.00 0.00 O ATOM 1393 OE2 GLU B 14 -6.032 -9.283 3.889 1.00 0.00 O ATOM 0 H GLU B 14 -6.444 -3.311 2.906 1.00 0.00 H new ATOM 0 HA GLU B 14 -7.290 -5.375 1.026 1.00 0.00 H new ATOM 0 HB2 GLU B 14 -5.078 -6.026 1.841 1.00 0.00 H new ATOM 0 HB3 GLU B 14 -5.662 -5.978 3.493 1.00 0.00 H new ATOM 0 HG2 GLU B 14 -7.508 -7.612 2.798 1.00 0.00 H new ATOM 0 HG3 GLU B 14 -6.721 -7.751 1.238 1.00 0.00 H new ATOM 1400 N CYS B 15 -9.196 -5.654 2.627 1.00 0.00 N ATOM 1401 CA CYS B 15 -10.273 -6.004 3.466 1.00 0.00 C ATOM 1402 C CYS B 15 -10.461 -7.476 3.228 1.00 0.00 C ATOM 1403 O CYS B 15 -9.591 -8.126 2.637 1.00 0.00 O ATOM 1404 CB CYS B 15 -11.518 -5.253 3.023 1.00 0.00 C ATOM 1405 SG CYS B 15 -12.947 -5.369 4.146 1.00 0.00 S ATOM 0 H CYS B 15 -9.396 -5.768 1.633 1.00 0.00 H new ATOM 0 HA CYS B 15 -10.092 -5.766 4.514 1.00 0.00 H new ATOM 0 HB2 CYS B 15 -11.261 -4.201 2.898 1.00 0.00 H new ATOM 0 HB3 CYS B 15 -11.817 -5.627 2.044 1.00 0.00 H new ATOM 0 HG CYS B 15 -13.700 -6.367 3.789 1.00 0.00 H new ATOM 1411 N ASP B 16 -11.547 -8.011 3.647 1.00 0.00 N ATOM 1412 CA ASP B 16 -11.828 -9.366 3.333 1.00 0.00 C ATOM 1413 C ASP B 16 -12.195 -9.419 1.849 1.00 0.00 C ATOM 1414 O ASP B 16 -12.841 -8.487 1.360 1.00 0.00 O ATOM 1415 CB ASP B 16 -12.956 -9.892 4.198 1.00 0.00 C ATOM 1416 CG ASP B 16 -13.153 -11.357 4.004 1.00 0.00 C ATOM 1417 OD1 ASP B 16 -12.351 -12.148 4.565 1.00 0.00 O ATOM 1418 OD2 ASP B 16 -14.084 -11.744 3.282 1.00 0.00 O ATOM 0 H ASP B 16 -12.255 -7.536 4.206 1.00 0.00 H new ATOM 0 HA ASP B 16 -10.962 -9.998 3.529 1.00 0.00 H new ATOM 0 HB2 ASP B 16 -12.738 -9.688 5.246 1.00 0.00 H new ATOM 0 HB3 ASP B 16 -13.878 -9.364 3.956 1.00 0.00 H new ATOM 1423 N PRO B 17 -11.733 -10.460 1.096 1.00 0.00 N ATOM 1424 CA PRO B 17 -11.982 -10.638 -0.372 1.00 0.00 C ATOM 1425 C PRO B 17 -13.425 -10.365 -0.829 1.00 0.00 C ATOM 1426 O PRO B 17 -13.670 -10.092 -2.007 1.00 0.00 O ATOM 1427 CB PRO B 17 -11.602 -12.086 -0.587 1.00 0.00 C ATOM 1428 CG PRO B 17 -10.463 -12.255 0.339 1.00 0.00 C ATOM 1429 CD PRO B 17 -10.861 -11.545 1.593 1.00 0.00 C ATOM 0 HA PRO B 17 -11.414 -9.917 -0.960 1.00 0.00 H new ATOM 0 HB2 PRO B 17 -12.423 -12.761 -0.348 1.00 0.00 H new ATOM 0 HB3 PRO B 17 -11.318 -12.282 -1.621 1.00 0.00 H new ATOM 0 HG2 PRO B 17 -10.266 -13.310 0.531 1.00 0.00 H new ATOM 0 HG3 PRO B 17 -9.550 -11.831 -0.080 1.00 0.00 H new ATOM 0 HD2 PRO B 17 -11.390 -12.205 2.281 1.00 0.00 H new ATOM 0 HD3 PRO B 17 -9.995 -11.154 2.128 1.00 0.00 H new ATOM 1437 N ALA B 18 -14.350 -10.438 0.103 1.00 0.00 N ATOM 1438 CA ALA B 18 -15.736 -10.065 -0.103 1.00 0.00 C ATOM 1439 C ALA B 18 -15.821 -8.635 -0.678 1.00 0.00 C ATOM 1440 O ALA B 18 -16.548 -8.371 -1.666 1.00 0.00 O ATOM 1441 CB ALA B 18 -16.414 -10.107 1.228 1.00 0.00 C ATOM 0 H ALA B 18 -14.156 -10.766 1.049 1.00 0.00 H new ATOM 0 HA ALA B 18 -16.212 -10.748 -0.806 1.00 0.00 H new ATOM 0 HB1 ALA B 18 -17.462 -9.831 1.111 1.00 0.00 H new ATOM 0 HB2 ALA B 18 -16.348 -11.115 1.639 1.00 0.00 H new ATOM 0 HB3 ALA B 18 -15.928 -9.406 1.906 1.00 0.00 H new ATOM 1447 N MET B 19 -15.043 -7.719 -0.079 1.00 0.00 N ATOM 1448 CA MET B 19 -14.972 -6.344 -0.553 1.00 0.00 C ATOM 1449 C MET B 19 -14.428 -6.309 -1.922 1.00 0.00 C ATOM 1450 O MET B 19 -14.950 -5.635 -2.791 1.00 0.00 O ATOM 1451 CB MET B 19 -14.059 -5.471 0.319 1.00 0.00 C ATOM 1452 CG MET B 19 -13.570 -4.210 -0.430 1.00 0.00 C ATOM 1453 SD MET B 19 -12.615 -3.071 0.587 1.00 0.00 S ATOM 1454 CE MET B 19 -13.843 -2.564 1.801 1.00 0.00 C ATOM 0 H MET B 19 -14.458 -7.914 0.733 1.00 0.00 H new ATOM 0 HA MET B 19 -15.989 -5.953 -0.514 1.00 0.00 H new ATOM 0 HB2 MET B 19 -14.596 -5.172 1.219 1.00 0.00 H new ATOM 0 HB3 MET B 19 -13.198 -6.057 0.642 1.00 0.00 H new ATOM 0 HG2 MET B 19 -12.961 -4.519 -1.279 1.00 0.00 H new ATOM 0 HG3 MET B 19 -14.434 -3.682 -0.833 1.00 0.00 H new ATOM 0 HE1 MET B 19 -13.934 -1.478 1.795 1.00 0.00 H new ATOM 0 HE2 MET B 19 -14.806 -3.010 1.553 1.00 0.00 H new ATOM 0 HE3 MET B 19 -13.534 -2.896 2.792 1.00 0.00 H new ATOM 1464 N LYS B 20 -13.415 -7.083 -2.110 1.00 0.00 N ATOM 1465 CA LYS B 20 -12.696 -7.128 -3.326 1.00 0.00 C ATOM 1466 C LYS B 20 -13.602 -7.513 -4.508 1.00 0.00 C ATOM 1467 O LYS B 20 -13.489 -6.942 -5.604 1.00 0.00 O ATOM 1468 CB LYS B 20 -11.471 -8.045 -3.162 1.00 0.00 C ATOM 1469 CG LYS B 20 -10.781 -8.379 -4.440 1.00 0.00 C ATOM 1470 CD LYS B 20 -10.437 -7.142 -5.217 1.00 0.00 C ATOM 1471 CE LYS B 20 -10.367 -7.447 -6.656 1.00 0.00 C ATOM 1472 NZ LYS B 20 -10.232 -6.209 -7.427 1.00 0.00 N ATOM 0 H LYS B 20 -13.057 -7.719 -1.397 1.00 0.00 H new ATOM 0 HA LYS B 20 -12.327 -6.132 -3.569 1.00 0.00 H new ATOM 0 HB2 LYS B 20 -10.758 -7.564 -2.493 1.00 0.00 H new ATOM 0 HB3 LYS B 20 -11.786 -8.970 -2.680 1.00 0.00 H new ATOM 0 HG2 LYS B 20 -9.872 -8.942 -4.228 1.00 0.00 H new ATOM 0 HG3 LYS B 20 -11.421 -9.023 -5.043 1.00 0.00 H new ATOM 0 HD2 LYS B 20 -11.186 -6.371 -5.037 1.00 0.00 H new ATOM 0 HD3 LYS B 20 -9.482 -6.743 -4.876 1.00 0.00 H new ATOM 0 HE2 LYS B 20 -9.520 -8.103 -6.856 1.00 0.00 H new ATOM 0 HE3 LYS B 20 -11.265 -7.982 -6.966 1.00 0.00 H new ATOM 0 HZ1 LYS B 20 -10.370 -6.413 -8.437 1.00 0.00 H new ATOM 0 HZ2 LYS B 20 -10.947 -5.523 -7.111 1.00 0.00 H new ATOM 0 HZ3 LYS B 20 -9.282 -5.811 -7.281 1.00 0.00 H new ATOM 1486 N GLN B 21 -14.516 -8.397 -4.273 1.00 0.00 N ATOM 1487 CA GLN B 21 -15.407 -8.808 -5.310 1.00 0.00 C ATOM 1488 C GLN B 21 -16.415 -7.728 -5.670 1.00 0.00 C ATOM 1489 O GLN B 21 -16.668 -7.484 -6.853 1.00 0.00 O ATOM 1490 CB GLN B 21 -16.010 -10.146 -4.990 1.00 0.00 C ATOM 1491 CG GLN B 21 -14.933 -11.215 -4.957 1.00 0.00 C ATOM 1492 CD GLN B 21 -14.326 -11.494 -6.311 1.00 0.00 C ATOM 1493 OE1 GLN B 21 -14.982 -11.372 -7.350 1.00 0.00 O ATOM 1494 NE2 GLN B 21 -13.082 -11.865 -6.315 1.00 0.00 N ATOM 0 H GLN B 21 -14.666 -8.849 -3.371 1.00 0.00 H new ATOM 0 HA GLN B 21 -14.833 -8.948 -6.226 1.00 0.00 H new ATOM 0 HB2 GLN B 21 -16.518 -10.102 -4.027 1.00 0.00 H new ATOM 0 HB3 GLN B 21 -16.762 -10.401 -5.736 1.00 0.00 H new ATOM 0 HG2 GLN B 21 -14.145 -10.906 -4.270 1.00 0.00 H new ATOM 0 HG3 GLN B 21 -15.358 -12.137 -4.560 1.00 0.00 H new ATOM 0 HE21 GLN B 21 -12.574 -11.954 -5.435 1.00 0.00 H new ATOM 0 HE22 GLN B 21 -12.613 -12.067 -7.198 1.00 0.00 H new ATOM 1503 N PHE B 22 -16.949 -7.030 -4.678 1.00 0.00 N ATOM 1504 CA PHE B 22 -17.821 -5.901 -5.000 1.00 0.00 C ATOM 1505 C PHE B 22 -17.037 -4.736 -5.630 1.00 0.00 C ATOM 1506 O PHE B 22 -17.552 -3.995 -6.438 1.00 0.00 O ATOM 1507 CB PHE B 22 -18.808 -5.447 -3.887 1.00 0.00 C ATOM 1508 CG PHE B 22 -18.228 -4.833 -2.630 1.00 0.00 C ATOM 1509 CD1 PHE B 22 -17.584 -3.601 -2.665 1.00 0.00 C ATOM 1510 CD2 PHE B 22 -18.360 -5.468 -1.415 1.00 0.00 C ATOM 1511 CE1 PHE B 22 -17.081 -3.030 -1.520 1.00 0.00 C ATOM 1512 CE2 PHE B 22 -17.865 -4.896 -0.260 1.00 0.00 C ATOM 1513 CZ PHE B 22 -17.223 -3.677 -0.313 1.00 0.00 C ATOM 0 H PHE B 22 -16.806 -7.210 -3.684 1.00 0.00 H new ATOM 0 HA PHE B 22 -18.498 -6.299 -5.756 1.00 0.00 H new ATOM 0 HB2 PHE B 22 -19.496 -4.724 -4.325 1.00 0.00 H new ATOM 0 HB3 PHE B 22 -19.401 -6.313 -3.593 1.00 0.00 H new ATOM 0 HD1 PHE B 22 -17.477 -3.084 -3.607 1.00 0.00 H new ATOM 0 HD2 PHE B 22 -18.857 -6.426 -1.365 1.00 0.00 H new ATOM 0 HE1 PHE B 22 -16.576 -2.077 -1.567 1.00 0.00 H new ATOM 0 HE2 PHE B 22 -17.981 -5.404 0.686 1.00 0.00 H new ATOM 0 HZ PHE B 22 -16.833 -3.231 0.590 1.00 0.00 H new ATOM 1523 N LEU B 23 -15.804 -4.575 -5.193 1.00 0.00 N ATOM 1524 CA LEU B 23 -14.875 -3.568 -5.671 1.00 0.00 C ATOM 1525 C LEU B 23 -14.648 -3.797 -7.179 1.00 0.00 C ATOM 1526 O LEU B 23 -14.503 -2.868 -7.945 1.00 0.00 O ATOM 1527 CB LEU B 23 -13.588 -3.772 -4.859 1.00 0.00 C ATOM 1528 CG LEU B 23 -12.692 -2.579 -4.574 1.00 0.00 C ATOM 1529 CD1 LEU B 23 -13.493 -1.451 -3.928 1.00 0.00 C ATOM 1530 CD2 LEU B 23 -11.611 -3.016 -3.613 1.00 0.00 C ATOM 0 H LEU B 23 -15.404 -5.167 -4.465 1.00 0.00 H new ATOM 0 HA LEU B 23 -15.236 -2.547 -5.546 1.00 0.00 H new ATOM 0 HB2 LEU B 23 -13.871 -4.206 -3.900 1.00 0.00 H new ATOM 0 HB3 LEU B 23 -12.986 -4.517 -5.380 1.00 0.00 H new ATOM 0 HG LEU B 23 -12.264 -2.219 -5.509 1.00 0.00 H new ATOM 0 HD11 LEU B 23 -12.835 -0.604 -3.731 1.00 0.00 H new ATOM 0 HD12 LEU B 23 -14.292 -1.141 -4.601 1.00 0.00 H new ATOM 0 HD13 LEU B 23 -13.924 -1.802 -2.990 1.00 0.00 H new ATOM 0 HD21 LEU B 23 -10.956 -2.173 -3.395 1.00 0.00 H new ATOM 0 HD22 LEU B 23 -12.067 -3.370 -2.688 1.00 0.00 H new ATOM 0 HD23 LEU B 23 -11.029 -3.821 -4.062 1.00 0.00 H new ATOM 1542 N LEU B 24 -14.669 -5.049 -7.579 1.00 0.00 N ATOM 1543 CA LEU B 24 -14.634 -5.432 -8.987 1.00 0.00 C ATOM 1544 C LEU B 24 -15.916 -5.017 -9.695 1.00 0.00 C ATOM 1545 O LEU B 24 -15.887 -4.484 -10.809 1.00 0.00 O ATOM 1546 CB LEU B 24 -14.482 -6.921 -9.081 1.00 0.00 C ATOM 1547 CG LEU B 24 -13.138 -7.468 -8.796 1.00 0.00 C ATOM 1548 CD1 LEU B 24 -13.275 -8.936 -8.578 1.00 0.00 C ATOM 1549 CD2 LEU B 24 -12.219 -7.215 -9.963 1.00 0.00 C ATOM 0 H LEU B 24 -14.711 -5.841 -6.938 1.00 0.00 H new ATOM 0 HA LEU B 24 -13.794 -4.929 -9.467 1.00 0.00 H new ATOM 0 HB2 LEU B 24 -15.190 -7.380 -8.391 1.00 0.00 H new ATOM 0 HB3 LEU B 24 -14.770 -7.230 -10.086 1.00 0.00 H new ATOM 0 HG LEU B 24 -12.718 -6.987 -7.913 1.00 0.00 H new ATOM 0 HD11 LEU B 24 -12.296 -9.365 -8.365 1.00 0.00 H new ATOM 0 HD12 LEU B 24 -13.942 -9.118 -7.735 1.00 0.00 H new ATOM 0 HD13 LEU B 24 -13.688 -9.400 -9.474 1.00 0.00 H new ATOM 0 HD21 LEU B 24 -11.232 -7.621 -9.743 1.00 0.00 H new ATOM 0 HD22 LEU B 24 -12.621 -7.698 -10.854 1.00 0.00 H new ATOM 0 HD23 LEU B 24 -12.139 -6.142 -10.137 1.00 0.00 H new ATOM 1561 N TYR B 25 -17.035 -5.292 -9.052 1.00 0.00 N ATOM 1562 CA TYR B 25 -18.357 -4.944 -9.566 1.00 0.00 C ATOM 1563 C TYR B 25 -18.462 -3.430 -9.759 1.00 0.00 C ATOM 1564 O TYR B 25 -19.051 -2.949 -10.727 1.00 0.00 O ATOM 1565 CB TYR B 25 -19.427 -5.430 -8.570 1.00 0.00 C ATOM 1566 CG TYR B 25 -20.884 -5.176 -8.952 1.00 0.00 C ATOM 1567 CD1 TYR B 25 -21.477 -3.926 -8.770 1.00 0.00 C ATOM 1568 CD2 TYR B 25 -21.674 -6.202 -9.443 1.00 0.00 C ATOM 1569 CE1 TYR B 25 -22.804 -3.716 -9.068 1.00 0.00 C ATOM 1570 CE2 TYR B 25 -23.002 -5.995 -9.753 1.00 0.00 C ATOM 1571 CZ TYR B 25 -23.564 -4.752 -9.561 1.00 0.00 C ATOM 1572 OH TYR B 25 -24.910 -4.547 -9.845 1.00 0.00 O ATOM 0 H TYR B 25 -17.058 -5.767 -8.150 1.00 0.00 H new ATOM 0 HA TYR B 25 -18.514 -5.426 -10.531 1.00 0.00 H new ATOM 0 HB2 TYR B 25 -19.295 -6.502 -8.425 1.00 0.00 H new ATOM 0 HB3 TYR B 25 -19.239 -4.953 -7.608 1.00 0.00 H new ATOM 0 HD1 TYR B 25 -20.884 -3.108 -8.388 1.00 0.00 H new ATOM 0 HD2 TYR B 25 -21.243 -7.182 -9.586 1.00 0.00 H new ATOM 0 HE1 TYR B 25 -23.247 -2.743 -8.916 1.00 0.00 H new ATOM 0 HE2 TYR B 25 -23.599 -6.805 -10.145 1.00 0.00 H new ATOM 0 HH TYR B 25 -25.303 -5.378 -10.186 1.00 0.00 H new ATOM 1582 N LEU B 26 -17.896 -2.683 -8.842 1.00 0.00 N ATOM 1583 CA LEU B 26 -17.954 -1.242 -8.916 1.00 0.00 C ATOM 1584 C LEU B 26 -17.034 -0.753 -10.037 1.00 0.00 C ATOM 1585 O LEU B 26 -17.342 0.205 -10.712 1.00 0.00 O ATOM 1586 CB LEU B 26 -17.652 -0.591 -7.540 1.00 0.00 C ATOM 1587 CG LEU B 26 -18.230 0.839 -7.276 1.00 0.00 C ATOM 1588 CD1 LEU B 26 -17.585 1.913 -8.131 1.00 0.00 C ATOM 1589 CD2 LEU B 26 -19.728 0.852 -7.493 1.00 0.00 C ATOM 0 H LEU B 26 -17.390 -3.048 -8.035 1.00 0.00 H new ATOM 0 HA LEU B 26 -18.968 -0.928 -9.165 1.00 0.00 H new ATOM 0 HB2 LEU B 26 -18.030 -1.256 -6.763 1.00 0.00 H new ATOM 0 HB3 LEU B 26 -16.570 -0.544 -7.420 1.00 0.00 H new ATOM 0 HG LEU B 26 -17.999 1.073 -6.237 1.00 0.00 H new ATOM 0 HD11 LEU B 26 -18.031 2.880 -7.898 1.00 0.00 H new ATOM 0 HD12 LEU B 26 -16.515 1.948 -7.925 1.00 0.00 H new ATOM 0 HD13 LEU B 26 -17.744 1.684 -9.185 1.00 0.00 H new ATOM 0 HD21 LEU B 26 -20.114 1.854 -7.305 1.00 0.00 H new ATOM 0 HD22 LEU B 26 -19.949 0.565 -8.521 1.00 0.00 H new ATOM 0 HD23 LEU B 26 -20.201 0.147 -6.809 1.00 0.00 H new ATOM 1601 N ASP B 27 -15.930 -1.451 -10.240 1.00 0.00 N ATOM 1602 CA ASP B 27 -14.984 -1.127 -11.318 1.00 0.00 C ATOM 1603 C ASP B 27 -15.639 -1.251 -12.685 1.00 0.00 C ATOM 1604 O ASP B 27 -15.522 -0.357 -13.530 1.00 0.00 O ATOM 1605 CB ASP B 27 -13.765 -2.042 -11.254 1.00 0.00 C ATOM 1606 CG ASP B 27 -12.837 -1.849 -12.432 1.00 0.00 C ATOM 1607 OD1 ASP B 27 -12.337 -0.735 -12.637 1.00 0.00 O ATOM 1608 OD2 ASP B 27 -12.562 -2.839 -13.156 1.00 0.00 O ATOM 0 H ASP B 27 -15.657 -2.254 -9.673 1.00 0.00 H new ATOM 0 HA ASP B 27 -14.669 -0.093 -11.176 1.00 0.00 H new ATOM 0 HB2 ASP B 27 -13.219 -1.851 -10.330 1.00 0.00 H new ATOM 0 HB3 ASP B 27 -14.095 -3.080 -11.221 1.00 0.00 H new ATOM 1613 N GLU B 28 -16.362 -2.344 -12.881 1.00 0.00 N ATOM 1614 CA GLU B 28 -17.027 -2.594 -14.152 1.00 0.00 C ATOM 1615 C GLU B 28 -18.239 -1.682 -14.346 1.00 0.00 C ATOM 1616 O GLU B 28 -18.553 -1.287 -15.468 1.00 0.00 O ATOM 1617 CB GLU B 28 -17.438 -4.065 -14.298 1.00 0.00 C ATOM 1618 CG GLU B 28 -18.394 -4.561 -13.234 1.00 0.00 C ATOM 1619 CD GLU B 28 -18.907 -5.945 -13.494 1.00 0.00 C ATOM 1620 OE1 GLU B 28 -19.943 -6.080 -14.177 1.00 0.00 O ATOM 1621 OE2 GLU B 28 -18.297 -6.921 -13.020 1.00 0.00 O ATOM 0 H GLU B 28 -16.503 -3.070 -12.179 1.00 0.00 H new ATOM 0 HA GLU B 28 -16.302 -2.365 -14.933 1.00 0.00 H new ATOM 0 HB2 GLU B 28 -17.899 -4.204 -15.276 1.00 0.00 H new ATOM 0 HB3 GLU B 28 -16.540 -4.683 -14.278 1.00 0.00 H new ATOM 0 HG2 GLU B 28 -17.891 -4.544 -12.267 1.00 0.00 H new ATOM 0 HG3 GLU B 28 -19.238 -3.875 -13.166 1.00 0.00 H new ATOM 1628 N SER B 29 -18.913 -1.349 -13.263 1.00 0.00 N ATOM 1629 CA SER B 29 -20.074 -0.515 -13.353 1.00 0.00 C ATOM 1630 C SER B 29 -19.681 0.953 -13.492 1.00 0.00 C ATOM 1631 O SER B 29 -20.246 1.690 -14.312 1.00 0.00 O ATOM 1632 CB SER B 29 -20.994 -0.737 -12.150 1.00 0.00 C ATOM 1633 OG SER B 29 -20.291 -0.586 -10.932 1.00 0.00 O ATOM 0 H SER B 29 -18.670 -1.647 -12.318 1.00 0.00 H new ATOM 0 HA SER B 29 -20.627 -0.793 -14.250 1.00 0.00 H new ATOM 0 HB2 SER B 29 -21.821 -0.028 -12.186 1.00 0.00 H new ATOM 0 HB3 SER B 29 -21.428 -1.735 -12.201 1.00 0.00 H new ATOM 0 HG SER B 29 -19.973 -1.461 -10.627 1.00 0.00 H new ATOM 1639 N ASN B 30 -18.683 1.345 -12.706 1.00 0.00 N ATOM 1640 CA ASN B 30 -18.164 2.708 -12.622 1.00 0.00 C ATOM 1641 C ASN B 30 -19.299 3.649 -12.208 1.00 0.00 C ATOM 1642 O ASN B 30 -19.422 4.789 -12.667 1.00 0.00 O ATOM 1643 CB ASN B 30 -17.465 3.132 -13.938 1.00 0.00 C ATOM 1644 CG ASN B 30 -16.679 4.424 -13.783 1.00 0.00 C ATOM 1645 OD1 ASN B 30 -16.250 4.764 -12.688 1.00 0.00 O ATOM 1646 ND2 ASN B 30 -16.452 5.125 -14.872 1.00 0.00 N ATOM 0 H ASN B 30 -18.195 0.699 -12.086 1.00 0.00 H new ATOM 0 HA ASN B 30 -17.389 2.762 -11.857 1.00 0.00 H new ATOM 0 HB2 ASN B 30 -16.793 2.337 -14.262 1.00 0.00 H new ATOM 0 HB3 ASN B 30 -18.213 3.256 -14.721 1.00 0.00 H new ATOM 0 HD21 ASN B 30 -15.902 5.983 -14.821 1.00 0.00 H new ATOM 0 HD22 ASN B 30 -16.825 4.811 -15.768 1.00 0.00 H new ATOM 1653 N ALA B 31 -20.091 3.148 -11.256 1.00 0.00 N ATOM 1654 CA ALA B 31 -21.286 3.818 -10.722 1.00 0.00 C ATOM 1655 C ALA B 31 -20.983 5.158 -10.066 1.00 0.00 C ATOM 1656 O ALA B 31 -21.844 6.016 -9.963 1.00 0.00 O ATOM 1657 CB ALA B 31 -22.002 2.903 -9.742 1.00 0.00 C ATOM 0 H ALA B 31 -19.916 2.241 -10.822 1.00 0.00 H new ATOM 0 HA ALA B 31 -21.932 4.030 -11.574 1.00 0.00 H new ATOM 0 HB1 ALA B 31 -22.886 3.408 -9.352 1.00 0.00 H new ATOM 0 HB2 ALA B 31 -22.303 1.988 -10.252 1.00 0.00 H new ATOM 0 HB3 ALA B 31 -21.332 2.656 -8.918 1.00 0.00 H new ATOM 1663 N LEU B 32 -19.773 5.322 -9.622 1.00 0.00 N ATOM 1664 CA LEU B 32 -19.367 6.541 -8.953 1.00 0.00 C ATOM 1665 C LEU B 32 -18.605 7.450 -9.895 1.00 0.00 C ATOM 1666 O LEU B 32 -18.239 8.569 -9.524 1.00 0.00 O ATOM 1667 CB LEU B 32 -18.495 6.189 -7.763 1.00 0.00 C ATOM 1668 CG LEU B 32 -19.171 5.380 -6.662 1.00 0.00 C ATOM 1669 CD1 LEU B 32 -18.129 4.854 -5.718 1.00 0.00 C ATOM 1670 CD2 LEU B 32 -20.170 6.242 -5.905 1.00 0.00 C ATOM 0 H LEU B 32 -19.035 4.623 -9.708 1.00 0.00 H new ATOM 0 HA LEU B 32 -20.259 7.070 -8.618 1.00 0.00 H new ATOM 0 HB2 LEU B 32 -17.632 5.628 -8.122 1.00 0.00 H new ATOM 0 HB3 LEU B 32 -18.116 7.114 -7.328 1.00 0.00 H new ATOM 0 HG LEU B 32 -19.708 4.546 -7.113 1.00 0.00 H new ATOM 0 HD11 LEU B 32 -18.611 4.275 -4.930 1.00 0.00 H new ATOM 0 HD12 LEU B 32 -17.433 4.216 -6.263 1.00 0.00 H new ATOM 0 HD13 LEU B 32 -17.585 5.688 -5.275 1.00 0.00 H new ATOM 0 HD21 LEU B 32 -20.643 5.649 -5.123 1.00 0.00 H new ATOM 0 HD22 LEU B 32 -19.652 7.089 -5.455 1.00 0.00 H new ATOM 0 HD23 LEU B 32 -20.931 6.607 -6.594 1.00 0.00 H new ATOM 1682 N GLY B 33 -18.372 6.966 -11.111 1.00 0.00 N ATOM 1683 CA GLY B 33 -17.589 7.702 -12.083 1.00 0.00 C ATOM 1684 C GLY B 33 -16.192 7.948 -11.581 1.00 0.00 C ATOM 1685 O GLY B 33 -15.666 9.059 -11.682 1.00 0.00 O ATOM 0 H GLY B 33 -18.717 6.065 -11.442 1.00 0.00 H new ATOM 0 HA2 GLY B 33 -17.549 7.145 -13.019 1.00 0.00 H new ATOM 0 HA3 GLY B 33 -18.074 8.654 -12.299 1.00 0.00 H new ATOM 1689 N LYS B 34 -15.596 6.923 -11.015 1.00 0.00 N ATOM 1690 CA LYS B 34 -14.298 7.032 -10.413 1.00 0.00 C ATOM 1691 C LYS B 34 -13.490 5.824 -10.725 1.00 0.00 C ATOM 1692 O LYS B 34 -13.966 4.696 -10.603 1.00 0.00 O ATOM 1693 CB LYS B 34 -14.382 7.136 -8.889 1.00 0.00 C ATOM 1694 CG LYS B 34 -15.186 8.304 -8.349 1.00 0.00 C ATOM 1695 CD LYS B 34 -14.572 9.635 -8.724 1.00 0.00 C ATOM 1696 CE LYS B 34 -15.441 10.784 -8.271 1.00 0.00 C ATOM 1697 NZ LYS B 34 -16.759 10.812 -8.949 1.00 0.00 N ATOM 0 H LYS B 34 -16.004 5.990 -10.962 1.00 0.00 H new ATOM 0 HA LYS B 34 -13.840 7.935 -10.817 1.00 0.00 H new ATOM 0 HB2 LYS B 34 -14.815 6.213 -8.504 1.00 0.00 H new ATOM 0 HB3 LYS B 34 -13.369 7.202 -8.492 1.00 0.00 H new ATOM 0 HG2 LYS B 34 -16.204 8.253 -8.735 1.00 0.00 H new ATOM 0 HG3 LYS B 34 -15.252 8.228 -7.264 1.00 0.00 H new ATOM 0 HD2 LYS B 34 -13.584 9.723 -8.272 1.00 0.00 H new ATOM 0 HD3 LYS B 34 -14.434 9.684 -9.804 1.00 0.00 H new ATOM 0 HE2 LYS B 34 -15.593 10.715 -7.194 1.00 0.00 H new ATOM 0 HE3 LYS B 34 -14.921 11.723 -8.460 1.00 0.00 H new ATOM 0 HZ1 LYS B 34 -17.299 11.640 -8.624 1.00 0.00 H new ATOM 0 HZ2 LYS B 34 -16.619 10.872 -9.978 1.00 0.00 H new ATOM 0 HZ3 LYS B 34 -17.285 9.944 -8.721 1.00 0.00 H new ATOM 1711 N LYS B 35 -12.277 6.040 -11.079 1.00 0.00 N ATOM 1712 CA LYS B 35 -11.369 4.959 -11.273 1.00 0.00 C ATOM 1713 C LYS B 35 -10.577 4.796 -10.017 1.00 0.00 C ATOM 1714 O LYS B 35 -9.496 5.363 -9.846 1.00 0.00 O ATOM 1715 CB LYS B 35 -10.496 5.117 -12.522 1.00 0.00 C ATOM 1716 CG LYS B 35 -11.265 4.951 -13.835 1.00 0.00 C ATOM 1717 CD LYS B 35 -11.863 3.537 -13.984 1.00 0.00 C ATOM 1718 CE LYS B 35 -10.775 2.463 -14.024 1.00 0.00 C ATOM 1719 NZ LYS B 35 -11.313 1.098 -14.181 1.00 0.00 N ATOM 0 H LYS B 35 -11.881 6.966 -11.243 1.00 0.00 H new ATOM 0 HA LYS B 35 -11.931 4.046 -11.469 1.00 0.00 H new ATOM 0 HB2 LYS B 35 -10.030 6.102 -12.506 1.00 0.00 H new ATOM 0 HB3 LYS B 35 -9.691 4.383 -12.487 1.00 0.00 H new ATOM 0 HG2 LYS B 35 -12.066 5.689 -13.881 1.00 0.00 H new ATOM 0 HG3 LYS B 35 -10.598 5.152 -14.673 1.00 0.00 H new ATOM 0 HD2 LYS B 35 -12.539 3.339 -13.153 1.00 0.00 H new ATOM 0 HD3 LYS B 35 -12.457 3.487 -14.897 1.00 0.00 H new ATOM 0 HE2 LYS B 35 -10.094 2.675 -14.848 1.00 0.00 H new ATOM 0 HE3 LYS B 35 -10.190 2.513 -13.106 1.00 0.00 H new ATOM 0 HZ1 LYS B 35 -10.556 0.462 -14.503 1.00 0.00 H new ATOM 0 HZ2 LYS B 35 -11.682 0.763 -13.268 1.00 0.00 H new ATOM 0 HZ3 LYS B 35 -12.081 1.106 -14.883 1.00 0.00 H new ATOM 1733 N PHE B 36 -11.207 4.121 -9.101 1.00 0.00 N ATOM 1734 CA PHE B 36 -10.686 3.883 -7.788 1.00 0.00 C ATOM 1735 C PHE B 36 -9.626 2.811 -7.817 1.00 0.00 C ATOM 1736 O PHE B 36 -8.540 3.014 -7.323 1.00 0.00 O ATOM 1737 CB PHE B 36 -11.837 3.525 -6.802 1.00 0.00 C ATOM 1738 CG PHE B 36 -12.658 2.328 -7.215 1.00 0.00 C ATOM 1739 CD1 PHE B 36 -13.586 2.438 -8.228 1.00 0.00 C ATOM 1740 CD2 PHE B 36 -12.470 1.089 -6.619 1.00 0.00 C ATOM 1741 CE1 PHE B 36 -14.304 1.355 -8.636 1.00 0.00 C ATOM 1742 CE2 PHE B 36 -13.192 0.006 -7.039 1.00 0.00 C ATOM 1743 CZ PHE B 36 -14.106 0.141 -8.044 1.00 0.00 C ATOM 0 H PHE B 36 -12.127 3.708 -9.253 1.00 0.00 H new ATOM 0 HA PHE B 36 -10.214 4.798 -7.431 1.00 0.00 H new ATOM 0 HB2 PHE B 36 -11.410 3.336 -5.817 1.00 0.00 H new ATOM 0 HB3 PHE B 36 -12.497 4.387 -6.704 1.00 0.00 H new ATOM 0 HD1 PHE B 36 -13.746 3.394 -8.704 1.00 0.00 H new ATOM 0 HD2 PHE B 36 -11.751 0.980 -5.821 1.00 0.00 H new ATOM 0 HE1 PHE B 36 -15.031 1.457 -9.429 1.00 0.00 H new ATOM 0 HE2 PHE B 36 -13.039 -0.957 -6.575 1.00 0.00 H new ATOM 0 HZ PHE B 36 -14.675 -0.716 -8.372 1.00 0.00 H new ATOM 1753 N ILE B 37 -9.932 1.696 -8.440 1.00 0.00 N ATOM 1754 CA ILE B 37 -9.021 0.603 -8.477 1.00 0.00 C ATOM 1755 C ILE B 37 -7.992 0.883 -9.581 1.00 0.00 C ATOM 1756 O ILE B 37 -8.285 0.871 -10.786 1.00 0.00 O ATOM 1757 CB ILE B 37 -9.802 -0.793 -8.595 1.00 0.00 C ATOM 1758 CG1 ILE B 37 -8.936 -2.055 -8.420 1.00 0.00 C ATOM 1759 CG2 ILE B 37 -10.590 -0.920 -9.853 1.00 0.00 C ATOM 1760 CD1 ILE B 37 -7.927 -2.312 -9.513 1.00 0.00 C ATOM 0 H ILE B 37 -10.813 1.533 -8.927 1.00 0.00 H new ATOM 0 HA ILE B 37 -8.466 0.506 -7.544 1.00 0.00 H new ATOM 0 HB ILE B 37 -10.478 -0.749 -7.741 1.00 0.00 H new ATOM 0 HG12 ILE B 37 -8.405 -1.981 -7.471 1.00 0.00 H new ATOM 0 HG13 ILE B 37 -9.596 -2.920 -8.349 1.00 0.00 H new ATOM 0 HG21 ILE B 37 -11.094 -1.886 -9.871 1.00 0.00 H new ATOM 0 HG22 ILE B 37 -11.332 -0.123 -9.900 1.00 0.00 H new ATOM 0 HG23 ILE B 37 -9.921 -0.844 -10.710 1.00 0.00 H new ATOM 0 HD11 ILE B 37 -7.373 -3.224 -9.290 1.00 0.00 H new ATOM 0 HD12 ILE B 37 -8.444 -2.426 -10.466 1.00 0.00 H new ATOM 0 HD13 ILE B 37 -7.235 -1.472 -9.574 1.00 0.00 H new ATOM 1772 N ILE B 38 -6.828 1.249 -9.140 1.00 0.00 N ATOM 1773 CA ILE B 38 -5.732 1.543 -10.008 1.00 0.00 C ATOM 1774 C ILE B 38 -5.064 0.262 -10.447 1.00 0.00 C ATOM 1775 O ILE B 38 -4.862 0.026 -11.647 1.00 0.00 O ATOM 1776 CB ILE B 38 -4.724 2.483 -9.320 1.00 0.00 C ATOM 1777 CG1 ILE B 38 -5.330 3.891 -9.155 1.00 0.00 C ATOM 1778 CG2 ILE B 38 -3.407 2.509 -10.072 1.00 0.00 C ATOM 1779 CD1 ILE B 38 -4.437 4.883 -8.435 1.00 0.00 C ATOM 0 H ILE B 38 -6.610 1.353 -8.149 1.00 0.00 H new ATOM 0 HA ILE B 38 -6.113 2.056 -10.891 1.00 0.00 H new ATOM 0 HB ILE B 38 -4.510 2.100 -8.322 1.00 0.00 H new ATOM 0 HG12 ILE B 38 -5.569 4.287 -10.142 1.00 0.00 H new ATOM 0 HG13 ILE B 38 -6.270 3.806 -8.610 1.00 0.00 H new ATOM 0 HG21 ILE B 38 -2.712 3.180 -9.566 1.00 0.00 H new ATOM 0 HG22 ILE B 38 -2.985 1.504 -10.101 1.00 0.00 H new ATOM 0 HG23 ILE B 38 -3.576 2.861 -11.090 1.00 0.00 H new ATOM 0 HD11 ILE B 38 -4.944 5.845 -8.365 1.00 0.00 H new ATOM 0 HD12 ILE B 38 -4.218 4.515 -7.433 1.00 0.00 H new ATOM 0 HD13 ILE B 38 -3.506 5.003 -8.989 1.00 0.00 H new ATOM 1791 N GLN B 39 -4.735 -0.557 -9.495 1.00 0.00 N ATOM 1792 CA GLN B 39 -4.171 -1.827 -9.782 1.00 0.00 C ATOM 1793 C GLN B 39 -4.566 -2.787 -8.712 1.00 0.00 C ATOM 1794 O GLN B 39 -4.942 -2.358 -7.602 1.00 0.00 O ATOM 1795 CB GLN B 39 -2.638 -1.818 -9.923 1.00 0.00 C ATOM 1796 CG GLN B 39 -1.859 -1.512 -8.656 1.00 0.00 C ATOM 1797 CD GLN B 39 -0.443 -2.078 -8.723 1.00 0.00 C ATOM 1798 OE1 GLN B 39 0.473 -1.419 -9.151 1.00 0.00 O ATOM 1799 NE2 GLN B 39 -0.287 -3.340 -8.354 1.00 0.00 N ATOM 0 H GLN B 39 -4.852 -0.358 -8.501 1.00 0.00 H new ATOM 0 HA GLN B 39 -4.562 -2.128 -10.754 1.00 0.00 H new ATOM 0 HB2 GLN B 39 -2.321 -2.792 -10.296 1.00 0.00 H new ATOM 0 HB3 GLN B 39 -2.366 -1.083 -10.680 1.00 0.00 H new ATOM 0 HG2 GLN B 39 -1.815 -0.433 -8.506 1.00 0.00 H new ATOM 0 HG3 GLN B 39 -2.380 -1.932 -7.796 1.00 0.00 H new ATOM 0 HE21 GLN B 39 -1.082 -3.869 -7.996 1.00 0.00 H new ATOM 0 HE22 GLN B 39 0.629 -3.783 -8.427 1.00 0.00 H new ATOM 1808 N ASP B 40 -4.544 -4.050 -9.033 1.00 0.00 N ATOM 1809 CA ASP B 40 -4.769 -5.068 -8.052 1.00 0.00 C ATOM 1810 C ASP B 40 -3.417 -5.488 -7.514 1.00 0.00 C ATOM 1811 O ASP B 40 -2.424 -5.510 -8.261 1.00 0.00 O ATOM 1812 CB ASP B 40 -5.512 -6.286 -8.617 1.00 0.00 C ATOM 1813 CG ASP B 40 -6.959 -6.000 -8.929 1.00 0.00 C ATOM 1814 OD1 ASP B 40 -7.757 -5.843 -7.992 1.00 0.00 O ATOM 1815 OD2 ASP B 40 -7.332 -5.957 -10.130 1.00 0.00 O ATOM 0 H ASP B 40 -4.371 -4.399 -9.976 1.00 0.00 H new ATOM 0 HA ASP B 40 -5.406 -4.663 -7.266 1.00 0.00 H new ATOM 0 HB2 ASP B 40 -5.010 -6.622 -9.524 1.00 0.00 H new ATOM 0 HB3 ASP B 40 -5.456 -7.104 -7.899 1.00 0.00 H new ATOM 1820 N ILE B 41 -3.348 -5.746 -6.250 1.00 0.00 N ATOM 1821 CA ILE B 41 -2.120 -6.110 -5.584 1.00 0.00 C ATOM 1822 C ILE B 41 -2.301 -7.367 -4.774 1.00 0.00 C ATOM 1823 O ILE B 41 -3.057 -7.412 -3.839 1.00 0.00 O ATOM 1824 CB ILE B 41 -1.494 -4.979 -4.666 1.00 0.00 C ATOM 1825 CG1 ILE B 41 -2.498 -3.932 -4.190 1.00 0.00 C ATOM 1826 CG2 ILE B 41 -0.324 -4.298 -5.310 1.00 0.00 C ATOM 1827 CD1 ILE B 41 -2.933 -2.950 -5.230 1.00 0.00 C ATOM 0 H ILE B 41 -4.156 -5.712 -5.629 1.00 0.00 H new ATOM 0 HA ILE B 41 -1.408 -6.272 -6.394 1.00 0.00 H new ATOM 0 HB ILE B 41 -1.150 -5.519 -3.784 1.00 0.00 H new ATOM 0 HG12 ILE B 41 -3.380 -4.445 -3.806 1.00 0.00 H new ATOM 0 HG13 ILE B 41 -2.060 -3.384 -3.356 1.00 0.00 H new ATOM 0 HG21 ILE B 41 0.066 -3.533 -4.639 1.00 0.00 H new ATOM 0 HG22 ILE B 41 0.455 -5.031 -5.516 1.00 0.00 H new ATOM 0 HG23 ILE B 41 -0.642 -3.834 -6.244 1.00 0.00 H new ATOM 0 HD11 ILE B 41 -3.645 -2.249 -4.794 1.00 0.00 H new ATOM 0 HD12 ILE B 41 -2.066 -2.403 -5.599 1.00 0.00 H new ATOM 0 HD13 ILE B 41 -3.406 -3.481 -6.056 1.00 0.00 H new ATOM 1839 N ASP B 42 -1.662 -8.384 -5.212 1.00 0.00 N ATOM 1840 CA ASP B 42 -1.600 -9.678 -4.561 1.00 0.00 C ATOM 1841 C ASP B 42 -2.924 -10.271 -4.178 1.00 0.00 C ATOM 1842 O ASP B 42 -3.267 -10.458 -2.999 1.00 0.00 O ATOM 1843 CB ASP B 42 -0.469 -9.871 -3.540 1.00 0.00 C ATOM 1844 CG ASP B 42 -0.391 -8.862 -2.385 1.00 0.00 C ATOM 1845 OD1 ASP B 42 0.005 -7.695 -2.617 1.00 0.00 O ATOM 1846 OD2 ASP B 42 -0.662 -9.246 -1.222 1.00 0.00 O ATOM 0 H ASP B 42 -1.131 -8.356 -6.082 1.00 0.00 H new ATOM 0 HA ASP B 42 -1.273 -10.322 -5.377 1.00 0.00 H new ATOM 0 HB2 ASP B 42 -0.566 -10.869 -3.112 1.00 0.00 H new ATOM 0 HB3 ASP B 42 0.479 -9.845 -4.077 1.00 0.00 H new ATOM 1851 N ASP B 43 -3.705 -10.396 -5.233 1.00 0.00 N ATOM 1852 CA ASP B 43 -5.036 -11.051 -5.358 1.00 0.00 C ATOM 1853 C ASP B 43 -6.163 -10.442 -4.524 1.00 0.00 C ATOM 1854 O ASP B 43 -7.335 -10.556 -4.886 1.00 0.00 O ATOM 1855 CB ASP B 43 -4.990 -12.598 -5.208 1.00 0.00 C ATOM 1856 CG ASP B 43 -4.635 -13.106 -3.825 1.00 0.00 C ATOM 1857 OD1 ASP B 43 -5.482 -13.047 -2.919 1.00 0.00 O ATOM 1858 OD2 ASP B 43 -3.517 -13.612 -3.624 1.00 0.00 O ATOM 0 H ASP B 43 -3.411 -10.007 -6.129 1.00 0.00 H new ATOM 0 HA ASP B 43 -5.301 -10.828 -6.391 1.00 0.00 H new ATOM 0 HB2 ASP B 43 -5.963 -13.002 -5.486 1.00 0.00 H new ATOM 0 HB3 ASP B 43 -4.265 -12.994 -5.919 1.00 0.00 H new ATOM 1863 N THR B 44 -5.832 -9.793 -3.461 1.00 0.00 N ATOM 1864 CA THR B 44 -6.849 -9.245 -2.574 1.00 0.00 C ATOM 1865 C THR B 44 -6.668 -7.743 -2.335 1.00 0.00 C ATOM 1866 O THR B 44 -7.633 -7.033 -2.024 1.00 0.00 O ATOM 1867 CB THR B 44 -6.860 -9.993 -1.211 1.00 0.00 C ATOM 1868 OG1 THR B 44 -7.017 -11.406 -1.458 1.00 0.00 O ATOM 1869 CG2 THR B 44 -8.025 -9.508 -0.324 1.00 0.00 C ATOM 0 H THR B 44 -4.870 -9.619 -3.169 1.00 0.00 H new ATOM 0 HA THR B 44 -7.806 -9.391 -3.075 1.00 0.00 H new ATOM 0 HB THR B 44 -5.922 -9.792 -0.694 1.00 0.00 H new ATOM 0 HG1 THR B 44 -6.234 -11.743 -1.941 1.00 0.00 H new ATOM 0 HG21 THR B 44 -8.010 -10.047 0.623 1.00 0.00 H new ATOM 0 HG22 THR B 44 -7.918 -8.440 -0.135 1.00 0.00 H new ATOM 0 HG23 THR B 44 -8.971 -9.694 -0.832 1.00 0.00 H new ATOM 1877 N HIS B 45 -5.475 -7.229 -2.528 1.00 0.00 N ATOM 1878 CA HIS B 45 -5.261 -5.850 -2.181 1.00 0.00 C ATOM 1879 C HIS B 45 -5.629 -4.993 -3.354 1.00 0.00 C ATOM 1880 O HIS B 45 -5.434 -5.383 -4.491 1.00 0.00 O ATOM 1881 CB HIS B 45 -3.811 -5.585 -1.708 1.00 0.00 C ATOM 1882 CG HIS B 45 -3.410 -6.365 -0.499 1.00 0.00 C ATOM 1883 ND1 HIS B 45 -3.300 -5.815 0.745 1.00 0.00 N ATOM 1884 CD2 HIS B 45 -3.145 -7.682 -0.345 1.00 0.00 C ATOM 1885 CE1 HIS B 45 -3.004 -6.768 1.612 1.00 0.00 C ATOM 1886 NE2 HIS B 45 -2.903 -7.899 0.978 1.00 0.00 N ATOM 0 H HIS B 45 -4.669 -7.724 -2.908 1.00 0.00 H new ATOM 0 HA HIS B 45 -5.900 -5.596 -1.335 1.00 0.00 H new ATOM 0 HB2 HIS B 45 -3.126 -5.821 -2.523 1.00 0.00 H new ATOM 0 HB3 HIS B 45 -3.699 -4.522 -1.495 1.00 0.00 H new ATOM 0 HD2 HIS B 45 -3.128 -8.426 -1.128 1.00 0.00 H new ATOM 0 HE1 HIS B 45 -2.868 -6.630 2.674 1.00 0.00 H new ATOM 0 HE2 HIS B 45 -2.680 -8.800 1.401 1.00 0.00 H new ATOM 1895 N VAL B 46 -6.206 -3.879 -3.091 1.00 0.00 N ATOM 1896 CA VAL B 46 -6.583 -2.952 -4.124 1.00 0.00 C ATOM 1897 C VAL B 46 -6.001 -1.602 -3.820 1.00 0.00 C ATOM 1898 O VAL B 46 -5.922 -1.203 -2.658 1.00 0.00 O ATOM 1899 CB VAL B 46 -8.142 -2.899 -4.332 1.00 0.00 C ATOM 1900 CG1 VAL B 46 -8.600 -1.558 -4.919 1.00 0.00 C ATOM 1901 CG2 VAL B 46 -8.582 -4.046 -5.259 1.00 0.00 C ATOM 0 H VAL B 46 -6.438 -3.570 -2.147 1.00 0.00 H new ATOM 0 HA VAL B 46 -6.173 -3.299 -5.073 1.00 0.00 H new ATOM 0 HB VAL B 46 -8.608 -3.008 -3.353 1.00 0.00 H new ATOM 0 HG11 VAL B 46 -9.683 -1.567 -5.045 1.00 0.00 H new ATOM 0 HG12 VAL B 46 -8.320 -0.750 -4.243 1.00 0.00 H new ATOM 0 HG13 VAL B 46 -8.123 -1.403 -5.887 1.00 0.00 H new ATOM 0 HG21 VAL B 46 -9.662 -4.006 -5.400 1.00 0.00 H new ATOM 0 HG22 VAL B 46 -8.086 -3.945 -6.224 1.00 0.00 H new ATOM 0 HG23 VAL B 46 -8.310 -5.001 -4.810 1.00 0.00 H new ATOM 1911 N PHE B 47 -5.515 -0.943 -4.838 1.00 0.00 N ATOM 1912 CA PHE B 47 -4.961 0.352 -4.666 1.00 0.00 C ATOM 1913 C PHE B 47 -5.913 1.373 -5.225 1.00 0.00 C ATOM 1914 O PHE B 47 -6.348 1.258 -6.379 1.00 0.00 O ATOM 1915 CB PHE B 47 -3.607 0.462 -5.354 1.00 0.00 C ATOM 1916 CG PHE B 47 -2.884 1.680 -4.988 1.00 0.00 C ATOM 1917 CD1 PHE B 47 -2.339 1.792 -3.728 1.00 0.00 C ATOM 1918 CD2 PHE B 47 -2.765 2.719 -5.867 1.00 0.00 C ATOM 1919 CE1 PHE B 47 -1.678 2.921 -3.352 1.00 0.00 C ATOM 1920 CE2 PHE B 47 -2.111 3.859 -5.491 1.00 0.00 C ATOM 1921 CZ PHE B 47 -1.565 3.953 -4.234 1.00 0.00 C ATOM 0 H PHE B 47 -5.497 -1.293 -5.796 1.00 0.00 H new ATOM 0 HA PHE B 47 -4.810 0.534 -3.602 1.00 0.00 H new ATOM 0 HB2 PHE B 47 -3.001 -0.407 -5.095 1.00 0.00 H new ATOM 0 HB3 PHE B 47 -3.750 0.440 -6.434 1.00 0.00 H new ATOM 0 HD1 PHE B 47 -2.437 0.974 -3.030 1.00 0.00 H new ATOM 0 HD2 PHE B 47 -3.187 2.640 -6.858 1.00 0.00 H new ATOM 0 HE1 PHE B 47 -1.248 2.998 -2.364 1.00 0.00 H new ATOM 0 HE2 PHE B 47 -2.024 4.685 -6.181 1.00 0.00 H new ATOM 0 HZ PHE B 47 -1.042 4.852 -3.943 1.00 0.00 H new ATOM 1931 N VAL B 48 -6.227 2.336 -4.421 1.00 0.00 N ATOM 1932 CA VAL B 48 -7.113 3.409 -4.771 1.00 0.00 C ATOM 1933 C VAL B 48 -6.418 4.719 -4.438 1.00 0.00 C ATOM 1934 O VAL B 48 -5.560 4.746 -3.577 1.00 0.00 O ATOM 1935 CB VAL B 48 -8.494 3.250 -4.032 1.00 0.00 C ATOM 1936 CG1 VAL B 48 -8.316 3.042 -2.547 1.00 0.00 C ATOM 1937 CG2 VAL B 48 -9.418 4.430 -4.280 1.00 0.00 C ATOM 0 H VAL B 48 -5.864 2.404 -3.470 1.00 0.00 H new ATOM 0 HA VAL B 48 -7.339 3.394 -5.837 1.00 0.00 H new ATOM 0 HB VAL B 48 -8.960 2.359 -4.454 1.00 0.00 H new ATOM 0 HG11 VAL B 48 -9.293 2.937 -2.075 1.00 0.00 H new ATOM 0 HG12 VAL B 48 -7.730 2.139 -2.374 1.00 0.00 H new ATOM 0 HG13 VAL B 48 -7.797 3.899 -2.119 1.00 0.00 H new ATOM 0 HG21 VAL B 48 -10.358 4.274 -3.750 1.00 0.00 H new ATOM 0 HG22 VAL B 48 -8.946 5.344 -3.920 1.00 0.00 H new ATOM 0 HG23 VAL B 48 -9.615 4.520 -5.348 1.00 0.00 H new ATOM 1947 N ILE B 49 -6.731 5.782 -5.129 1.00 0.00 N ATOM 1948 CA ILE B 49 -6.043 7.027 -4.860 1.00 0.00 C ATOM 1949 C ILE B 49 -6.753 7.780 -3.718 1.00 0.00 C ATOM 1950 O ILE B 49 -7.971 7.612 -3.507 1.00 0.00 O ATOM 1951 CB ILE B 49 -5.846 7.888 -6.135 1.00 0.00 C ATOM 1952 CG1 ILE B 49 -4.689 8.890 -5.955 1.00 0.00 C ATOM 1953 CG2 ILE B 49 -7.134 8.583 -6.560 1.00 0.00 C ATOM 1954 CD1 ILE B 49 -4.424 9.771 -7.166 1.00 0.00 C ATOM 0 H ILE B 49 -7.437 5.819 -5.864 1.00 0.00 H new ATOM 0 HA ILE B 49 -5.031 6.797 -4.526 1.00 0.00 H new ATOM 0 HB ILE B 49 -5.574 7.211 -6.945 1.00 0.00 H new ATOM 0 HG12 ILE B 49 -4.907 9.528 -5.098 1.00 0.00 H new ATOM 0 HG13 ILE B 49 -3.780 8.337 -5.718 1.00 0.00 H new ATOM 0 HG21 ILE B 49 -6.949 9.175 -7.457 1.00 0.00 H new ATOM 0 HG22 ILE B 49 -7.899 7.835 -6.770 1.00 0.00 H new ATOM 0 HG23 ILE B 49 -7.476 9.237 -5.758 1.00 0.00 H new ATOM 0 HD11 ILE B 49 -3.595 10.445 -6.951 1.00 0.00 H new ATOM 0 HD12 ILE B 49 -4.171 9.146 -8.022 1.00 0.00 H new ATOM 0 HD13 ILE B 49 -5.316 10.355 -7.393 1.00 0.00 H new ATOM 1966 N ALA B 50 -6.000 8.603 -3.015 1.00 0.00 N ATOM 1967 CA ALA B 50 -6.418 9.197 -1.755 1.00 0.00 C ATOM 1968 C ALA B 50 -7.720 10.010 -1.765 1.00 0.00 C ATOM 1969 O ALA B 50 -8.572 9.806 -0.900 1.00 0.00 O ATOM 1970 CB ALA B 50 -5.290 9.992 -1.128 1.00 0.00 C ATOM 0 H ALA B 50 -5.064 8.884 -3.306 1.00 0.00 H new ATOM 0 HA ALA B 50 -6.664 8.332 -1.140 1.00 0.00 H new ATOM 0 HB1 ALA B 50 -5.629 10.425 -0.187 1.00 0.00 H new ATOM 0 HB2 ALA B 50 -4.442 9.334 -0.939 1.00 0.00 H new ATOM 0 HB3 ALA B 50 -4.986 10.790 -1.806 1.00 0.00 H new ATOM 1976 N GLU B 51 -7.892 10.908 -2.705 1.00 0.00 N ATOM 1977 CA GLU B 51 -9.054 11.798 -2.663 1.00 0.00 C ATOM 1978 C GLU B 51 -10.371 11.126 -3.006 1.00 0.00 C ATOM 1979 O GLU B 51 -11.401 11.433 -2.402 1.00 0.00 O ATOM 1980 CB GLU B 51 -8.848 13.026 -3.520 1.00 0.00 C ATOM 1981 CG GLU B 51 -7.759 13.942 -3.013 1.00 0.00 C ATOM 1982 CD GLU B 51 -8.083 14.495 -1.653 1.00 0.00 C ATOM 1983 OE1 GLU B 51 -9.036 15.276 -1.535 1.00 0.00 O ATOM 1984 OE2 GLU B 51 -7.397 14.157 -0.677 1.00 0.00 O ATOM 0 H GLU B 51 -7.264 11.050 -3.496 1.00 0.00 H new ATOM 0 HA GLU B 51 -9.133 12.101 -1.619 1.00 0.00 H new ATOM 0 HB2 GLU B 51 -8.605 12.713 -4.535 1.00 0.00 H new ATOM 0 HB3 GLU B 51 -9.784 13.583 -3.573 1.00 0.00 H new ATOM 0 HG2 GLU B 51 -6.817 13.396 -2.968 1.00 0.00 H new ATOM 0 HG3 GLU B 51 -7.619 14.764 -3.715 1.00 0.00 H new ATOM 1991 N LEU B 52 -10.364 10.206 -3.935 1.00 0.00 N ATOM 1992 CA LEU B 52 -11.616 9.602 -4.333 1.00 0.00 C ATOM 1993 C LEU B 52 -11.971 8.356 -3.539 1.00 0.00 C ATOM 1994 O LEU B 52 -13.034 7.788 -3.722 1.00 0.00 O ATOM 1995 CB LEU B 52 -11.746 9.428 -5.868 1.00 0.00 C ATOM 1996 CG LEU B 52 -10.647 8.661 -6.608 1.00 0.00 C ATOM 1997 CD1 LEU B 52 -10.682 7.178 -6.306 1.00 0.00 C ATOM 1998 CD2 LEU B 52 -10.747 8.902 -8.096 1.00 0.00 C ATOM 0 H LEU B 52 -9.534 9.864 -4.420 1.00 0.00 H new ATOM 0 HA LEU B 52 -12.386 10.325 -4.063 1.00 0.00 H new ATOM 0 HB2 LEU B 52 -12.693 8.926 -6.066 1.00 0.00 H new ATOM 0 HB3 LEU B 52 -11.813 10.422 -6.311 1.00 0.00 H new ATOM 0 HG LEU B 52 -9.690 9.039 -6.250 1.00 0.00 H new ATOM 0 HD11 LEU B 52 -9.884 6.676 -6.853 1.00 0.00 H new ATOM 0 HD12 LEU B 52 -10.542 7.021 -5.236 1.00 0.00 H new ATOM 0 HD13 LEU B 52 -11.645 6.767 -6.610 1.00 0.00 H new ATOM 0 HD21 LEU B 52 -9.959 8.350 -8.608 1.00 0.00 H new ATOM 0 HD22 LEU B 52 -11.719 8.564 -8.455 1.00 0.00 H new ATOM 0 HD23 LEU B 52 -10.635 9.967 -8.300 1.00 0.00 H new ATOM 2010 N VAL B 53 -11.103 7.938 -2.631 1.00 0.00 N ATOM 2011 CA VAL B 53 -11.447 6.811 -1.765 1.00 0.00 C ATOM 2012 C VAL B 53 -12.558 7.227 -0.821 1.00 0.00 C ATOM 2013 O VAL B 53 -13.338 6.411 -0.394 1.00 0.00 O ATOM 2014 CB VAL B 53 -10.254 6.151 -0.995 1.00 0.00 C ATOM 2015 CG1 VAL B 53 -9.696 7.059 0.064 1.00 0.00 C ATOM 2016 CG2 VAL B 53 -10.661 4.811 -0.387 1.00 0.00 C ATOM 0 H VAL B 53 -10.181 8.345 -2.473 1.00 0.00 H new ATOM 0 HA VAL B 53 -11.784 6.016 -2.431 1.00 0.00 H new ATOM 0 HB VAL B 53 -9.467 5.973 -1.728 1.00 0.00 H new ATOM 0 HG11 VAL B 53 -8.871 6.561 0.573 1.00 0.00 H new ATOM 0 HG12 VAL B 53 -9.336 7.978 -0.398 1.00 0.00 H new ATOM 0 HG13 VAL B 53 -10.476 7.298 0.787 1.00 0.00 H new ATOM 0 HG21 VAL B 53 -9.811 4.378 0.141 1.00 0.00 H new ATOM 0 HG22 VAL B 53 -11.483 4.963 0.312 1.00 0.00 H new ATOM 0 HG23 VAL B 53 -10.979 4.134 -1.179 1.00 0.00 H new ATOM 2026 N ASN B 54 -12.603 8.514 -0.503 1.00 0.00 N ATOM 2027 CA ASN B 54 -13.641 9.077 0.369 1.00 0.00 C ATOM 2028 C ASN B 54 -15.037 8.710 -0.138 1.00 0.00 C ATOM 2029 O ASN B 54 -15.911 8.344 0.653 1.00 0.00 O ATOM 2030 CB ASN B 54 -13.516 10.608 0.471 1.00 0.00 C ATOM 2031 CG ASN B 54 -12.197 11.067 1.055 1.00 0.00 C ATOM 2032 OD1 ASN B 54 -11.593 10.379 1.879 1.00 0.00 O ATOM 2033 ND2 ASN B 54 -11.739 12.220 0.645 1.00 0.00 N ATOM 0 H ASN B 54 -11.926 9.200 -0.838 1.00 0.00 H new ATOM 0 HA ASN B 54 -13.498 8.649 1.361 1.00 0.00 H new ATOM 0 HB2 ASN B 54 -13.636 11.042 -0.522 1.00 0.00 H new ATOM 0 HB3 ASN B 54 -14.330 10.991 1.086 1.00 0.00 H new ATOM 0 HD21 ASN B 54 -10.855 12.576 1.009 1.00 0.00 H new ATOM 0 HD22 ASN B 54 -12.265 12.764 -0.039 1.00 0.00 H new ATOM 2040 N VAL B 55 -15.228 8.730 -1.462 1.00 0.00 N ATOM 2041 CA VAL B 55 -16.531 8.393 -2.023 1.00 0.00 C ATOM 2042 C VAL B 55 -16.786 6.905 -1.884 1.00 0.00 C ATOM 2043 O VAL B 55 -17.898 6.458 -1.661 1.00 0.00 O ATOM 2044 CB VAL B 55 -16.755 8.885 -3.484 1.00 0.00 C ATOM 2045 CG1 VAL B 55 -16.464 10.356 -3.600 1.00 0.00 C ATOM 2046 CG2 VAL B 55 -15.960 8.113 -4.515 1.00 0.00 C ATOM 0 H VAL B 55 -14.512 8.971 -2.147 1.00 0.00 H new ATOM 0 HA VAL B 55 -17.268 8.944 -1.438 1.00 0.00 H new ATOM 0 HB VAL B 55 -17.807 8.699 -3.703 1.00 0.00 H new ATOM 0 HG11 VAL B 55 -16.627 10.679 -4.628 1.00 0.00 H new ATOM 0 HG12 VAL B 55 -17.126 10.911 -2.936 1.00 0.00 H new ATOM 0 HG13 VAL B 55 -15.428 10.545 -3.320 1.00 0.00 H new ATOM 0 HG21 VAL B 55 -16.167 8.512 -5.508 1.00 0.00 H new ATOM 0 HG22 VAL B 55 -14.896 8.209 -4.300 1.00 0.00 H new ATOM 0 HG23 VAL B 55 -16.244 7.061 -4.480 1.00 0.00 H new ATOM 2056 N LEU B 56 -15.732 6.161 -1.996 1.00 0.00 N ATOM 2057 CA LEU B 56 -15.749 4.730 -1.794 1.00 0.00 C ATOM 2058 C LEU B 56 -16.094 4.384 -0.357 1.00 0.00 C ATOM 2059 O LEU B 56 -16.790 3.420 -0.110 1.00 0.00 O ATOM 2060 CB LEU B 56 -14.406 4.101 -2.194 1.00 0.00 C ATOM 2061 CG LEU B 56 -14.251 3.658 -3.648 1.00 0.00 C ATOM 2062 CD1 LEU B 56 -15.168 2.504 -3.894 1.00 0.00 C ATOM 2063 CD2 LEU B 56 -14.582 4.773 -4.623 1.00 0.00 C ATOM 0 H LEU B 56 -14.812 6.530 -2.235 1.00 0.00 H new ATOM 0 HA LEU B 56 -16.525 4.315 -2.438 1.00 0.00 H new ATOM 0 HB2 LEU B 56 -13.617 4.820 -1.973 1.00 0.00 H new ATOM 0 HB3 LEU B 56 -14.235 3.234 -1.556 1.00 0.00 H new ATOM 0 HG LEU B 56 -13.210 3.377 -3.809 1.00 0.00 H new ATOM 0 HD11 LEU B 56 -15.070 2.175 -4.929 1.00 0.00 H new ATOM 0 HD12 LEU B 56 -14.907 1.683 -3.226 1.00 0.00 H new ATOM 0 HD13 LEU B 56 -16.197 2.811 -3.707 1.00 0.00 H new ATOM 0 HD21 LEU B 56 -14.458 4.412 -5.644 1.00 0.00 H new ATOM 0 HD22 LEU B 56 -15.613 5.092 -4.474 1.00 0.00 H new ATOM 0 HD23 LEU B 56 -13.913 5.616 -4.452 1.00 0.00 H new ATOM 2075 N GLN B 57 -15.617 5.194 0.582 1.00 0.00 N ATOM 2076 CA GLN B 57 -15.874 4.981 2.008 1.00 0.00 C ATOM 2077 C GLN B 57 -17.317 5.051 2.273 1.00 0.00 C ATOM 2078 O GLN B 57 -17.886 4.166 2.935 1.00 0.00 O ATOM 2079 CB GLN B 57 -15.167 6.034 2.856 1.00 0.00 C ATOM 2080 CG GLN B 57 -13.685 6.042 2.669 1.00 0.00 C ATOM 2081 CD GLN B 57 -13.045 4.756 3.081 1.00 0.00 C ATOM 2082 OE1 GLN B 57 -13.166 3.787 2.232 1.00 0.00 O flip ATOM 2083 NE2 GLN B 57 -12.575 4.601 4.201 1.00 0.00 N flip ATOM 0 H GLN B 57 -15.044 6.014 0.381 1.00 0.00 H new ATOM 0 HA GLN B 57 -15.491 3.996 2.273 1.00 0.00 H new ATOM 0 HB2 GLN B 57 -15.564 7.018 2.607 1.00 0.00 H new ATOM 0 HB3 GLN B 57 -15.393 5.856 3.907 1.00 0.00 H new ATOM 0 HG2 GLN B 57 -13.456 6.238 1.621 1.00 0.00 H new ATOM 0 HG3 GLN B 57 -13.254 6.859 3.248 1.00 0.00 H new ATOM 0 HE21 GLN B 57 -12.499 5.395 4.837 1.00 0.00 H new ATOM 0 HE22 GLN B 57 -12.259 3.678 4.498 1.00 0.00 H new ATOM 2092 N GLU B 58 -17.936 6.057 1.717 1.00 0.00 N ATOM 2093 CA GLU B 58 -19.319 6.199 1.908 1.00 0.00 C ATOM 2094 C GLU B 58 -20.094 5.178 1.129 1.00 0.00 C ATOM 2095 O GLU B 58 -21.042 4.642 1.628 1.00 0.00 O ATOM 2096 CB GLU B 58 -19.855 7.602 1.687 1.00 0.00 C ATOM 2097 CG GLU B 58 -19.453 8.231 0.381 1.00 0.00 C ATOM 2098 CD GLU B 58 -20.162 9.517 0.141 1.00 0.00 C ATOM 2099 OE1 GLU B 58 -21.273 9.489 -0.396 1.00 0.00 O ATOM 2100 OE2 GLU B 58 -19.625 10.587 0.481 1.00 0.00 O ATOM 0 H GLU B 58 -17.495 6.772 1.139 1.00 0.00 H new ATOM 0 HA GLU B 58 -19.473 6.010 2.970 1.00 0.00 H new ATOM 0 HB2 GLU B 58 -20.943 7.573 1.741 1.00 0.00 H new ATOM 0 HB3 GLU B 58 -19.513 8.240 2.502 1.00 0.00 H new ATOM 0 HG2 GLU B 58 -18.377 8.404 0.378 1.00 0.00 H new ATOM 0 HG3 GLU B 58 -19.667 7.541 -0.435 1.00 0.00 H new ATOM 2107 N ARG B 59 -19.659 4.882 -0.083 1.00 0.00 N ATOM 2108 CA ARG B 59 -20.361 3.917 -0.904 1.00 0.00 C ATOM 2109 C ARG B 59 -20.375 2.564 -0.217 1.00 0.00 C ATOM 2110 O ARG B 59 -21.400 1.937 -0.131 1.00 0.00 O ATOM 2111 CB ARG B 59 -19.735 3.835 -2.322 1.00 0.00 C ATOM 2112 CG ARG B 59 -20.469 2.950 -3.362 1.00 0.00 C ATOM 2113 CD ARG B 59 -20.254 1.442 -3.179 1.00 0.00 C ATOM 2114 NE ARG B 59 -20.912 0.681 -4.249 1.00 0.00 N ATOM 2115 CZ ARG B 59 -20.957 -0.657 -4.357 1.00 0.00 C ATOM 2116 NH1 ARG B 59 -20.434 -1.440 -3.418 1.00 0.00 N ATOM 2117 NH2 ARG B 59 -21.571 -1.210 -5.391 1.00 0.00 N ATOM 0 H ARG B 59 -18.831 5.292 -0.515 1.00 0.00 H new ATOM 0 HA ARG B 59 -21.393 4.244 -1.029 1.00 0.00 H new ATOM 0 HB2 ARG B 59 -19.670 4.846 -2.723 1.00 0.00 H new ATOM 0 HB3 ARG B 59 -18.715 3.465 -2.222 1.00 0.00 H new ATOM 0 HG2 ARG B 59 -21.537 3.161 -3.310 1.00 0.00 H new ATOM 0 HG3 ARG B 59 -20.136 3.233 -4.361 1.00 0.00 H new ATOM 0 HD2 ARG B 59 -19.187 1.221 -3.175 1.00 0.00 H new ATOM 0 HD3 ARG B 59 -20.648 1.130 -2.212 1.00 0.00 H new ATOM 0 HE ARG B 59 -21.379 1.219 -4.979 1.00 0.00 H new ATOM 0 HH11 ARG B 59 -19.989 -1.026 -2.599 1.00 0.00 H new ATOM 0 HH12 ARG B 59 -20.478 -2.454 -3.517 1.00 0.00 H new ATOM 0 HH21 ARG B 59 -22.007 -0.621 -6.100 1.00 0.00 H new ATOM 0 HH22 ARG B 59 -21.608 -2.226 -5.478 1.00 0.00 H new ATOM 2131 N VAL B 60 -19.247 2.165 0.325 1.00 0.00 N ATOM 2132 CA VAL B 60 -19.139 0.885 0.995 1.00 0.00 C ATOM 2133 C VAL B 60 -20.012 0.832 2.258 1.00 0.00 C ATOM 2134 O VAL B 60 -20.754 -0.133 2.472 1.00 0.00 O ATOM 2135 CB VAL B 60 -17.651 0.525 1.326 1.00 0.00 C ATOM 2136 CG1 VAL B 60 -17.560 -0.751 2.156 1.00 0.00 C ATOM 2137 CG2 VAL B 60 -16.865 0.336 0.036 1.00 0.00 C ATOM 0 H VAL B 60 -18.385 2.711 0.316 1.00 0.00 H new ATOM 0 HA VAL B 60 -19.512 0.132 0.301 1.00 0.00 H new ATOM 0 HB VAL B 60 -17.230 1.347 1.905 1.00 0.00 H new ATOM 0 HG11 VAL B 60 -16.514 -0.973 2.369 1.00 0.00 H new ATOM 0 HG12 VAL B 60 -18.100 -0.615 3.093 1.00 0.00 H new ATOM 0 HG13 VAL B 60 -18.001 -1.579 1.600 1.00 0.00 H new ATOM 0 HG21 VAL B 60 -15.831 0.086 0.273 1.00 0.00 H new ATOM 0 HG22 VAL B 60 -17.309 -0.472 -0.546 1.00 0.00 H new ATOM 0 HG23 VAL B 60 -16.891 1.258 -0.544 1.00 0.00 H new ATOM 2147 N GLY B 61 -19.964 1.879 3.048 1.00 0.00 N ATOM 2148 CA GLY B 61 -20.697 1.883 4.294 1.00 0.00 C ATOM 2149 C GLY B 61 -22.188 2.134 4.134 1.00 0.00 C ATOM 2150 O GLY B 61 -23.010 1.429 4.716 1.00 0.00 O ATOM 0 H GLY B 61 -19.433 2.728 2.855 1.00 0.00 H new ATOM 0 HA2 GLY B 61 -20.552 0.924 4.792 1.00 0.00 H new ATOM 0 HA3 GLY B 61 -20.278 2.648 4.947 1.00 0.00 H new