USER MOD reduce.3.24.130724 H: found=0, std=0, add=1034, rem=0, adj=24 USER MOD reduce.3.24.130724 removed 1036 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 109 MET CE :methyl -129:sc= -0.448 (180deg=-2.91!) USER MOD Set 1.2: A 124 MET CE :methyl -156:sc= -1.09 (180deg=-3.3!) USER MOD Set 1.3: A 144 MET CE :methyl 145:sc= -1.08 (180deg=-2.04!) USER MOD Set 2.1: A 58 ASN : amide:sc= -1.36 K(o=-1.8,f=-4.4!) USER MOD Set 2.2: A 59 ASN : amide:sc= -0.468 K(o=-1.8,f=-2.4) USER MOD Set 3.1: A 36 MET CE :methyl -150:sc= -1.81 (180deg=-4.51!) USER MOD Set 3.2: A 75 GLN : amide:sc= -0.929 K(o=-2.7,f=-1.8) USER MOD Set 4.1: A 5 THR OG1 : rot 75:sc= 0.516 USER MOD Set 4.2: A 8 GLN : amide:sc= -5.34! C(o=-4.8!,f=-10!) USER MOD Single : A 13 LYS NZ :NH3+ -175:sc= 0 (180deg=-0.0162) USER MOD Single : A 18 GLN : amide:sc= -1.81! K(o=-1.8!,f=-1.1) USER MOD Single : A 21 LYS NZ :NH3+ 169:sc= -0.0122 (180deg=-0.141) USER MOD Single : A 24 THR OG1 : rot 5:sc= 0.876! USER MOD Single : A 26 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 29 THR OG1 : rot -150:sc= -1.46 USER MOD Single : A 34 THR OG1 : rot 180:sc= 0 USER MOD Single : A 38 THR OG1 : rot 180:sc= 0 USER MOD Single : A 41 GLN : amide:sc= -3.38 K(o=-3.4,f=-14!) USER MOD Single : A 42 ASN : amide:sc= -4.22! K(o=-4.2!,f=-1.1) USER MOD Single : A 44 THR OG1 : rot 180:sc= -0.0297 USER MOD Single : A 49 GLN : amide:sc= -4.95! C(o=-4.9!,f=-2.5!) USER MOD Single : A 57 ASN : amide:sc= -0.125 X(o=-0.12,f=0) USER MOD Single : A 60 ASN : amide:sc= 0 K(o=0,f=-0.83) USER MOD Single : A 62 GLN : amide:sc= -3.31 K(o=-3.3,f=-2) USER MOD Single : A 64 ASN : amide:sc= -0.717 K(o=-0.72,f=-3.5!) USER MOD Single : A 66 THR OG1 : rot 180:sc= 0 USER MOD Single : A 69 CYS SG : rot -41:sc= 0.374 USER MOD Single : A 72 MET CE :methyl 143:sc= -2.39! (180deg=-5.37!) USER MOD Single : A 74 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 85 MET CE :methyl -142:sc= -6.16! (180deg=-10.3!) USER MOD Single : A 90 LYS NZ :NH3+ -167:sc= -0.0194 (180deg=-0.207) USER MOD Single : A 101 SER OG : rot 180:sc= -1.37 USER MOD Single : A 111 ASN : amide:sc= -1.21! K(o=-1.2!,f=-0.14) USER MOD Single : A 115 LYS NZ :NH3+ 168:sc= -0.0346 (180deg=-0.216) USER MOD Single : A 117 THR OG1 : rot -170:sc= -0.553 USER MOD Single : A 135 MET CE :methyl 149:sc= -0.292 (180deg=-1.03) USER MOD Single : A 137 ASN : amide:sc= -3.08! C(o=-3.1!,f=-12!) USER MOD Single : A 138 TYR OH : rot 180:sc= -0.258 USER MOD Single : A 146 SER OG : rot -116:sc= 1.27 USER MOD Single : A 147 GLN : amide:sc= -1.72 K(o=-1.7,f=-0.35) USER MOD Single : A 148 LYS NZ :NH3+ -172:sc= -1.37! (180deg=-1.52!) USER MOD ----------------------------------------------------------------- ATOM 46 N LEU A 4 6.668 -6.736 9.964 1.00 0.37 N ATOM 47 CA LEU A 4 6.007 -7.438 8.866 1.00 0.29 C ATOM 48 C LEU A 4 5.622 -8.851 9.290 1.00 0.32 C ATOM 49 O LEU A 4 5.643 -9.178 10.477 1.00 0.36 O ATOM 50 CB LEU A 4 6.911 -7.500 7.630 1.00 0.22 C ATOM 51 CG LEU A 4 7.322 -6.151 7.039 1.00 0.25 C ATOM 52 CD1 LEU A 4 8.667 -5.710 7.593 1.00 0.37 C ATOM 53 CD2 LEU A 4 7.370 -6.228 5.524 1.00 0.27 C ATOM 0 HA LEU A 4 5.105 -6.882 8.611 1.00 0.29 H new ATOM 0 HB2 LEU A 4 7.814 -8.052 7.891 1.00 0.22 H new ATOM 0 HB3 LEU A 4 6.399 -8.073 6.857 1.00 0.22 H new ATOM 0 HG LEU A 4 6.575 -5.410 7.324 1.00 0.25 H new ATOM 0 HD11 LEU A 4 8.941 -4.748 7.160 1.00 0.37 H new ATOM 0 HD12 LEU A 4 8.600 -5.614 8.677 1.00 0.37 H new ATOM 0 HD13 LEU A 4 9.425 -6.451 7.340 1.00 0.37 H new ATOM 0 HD21 LEU A 4 7.664 -5.259 5.120 1.00 0.27 H new ATOM 0 HD22 LEU A 4 8.095 -6.983 5.221 1.00 0.27 H new ATOM 0 HD23 LEU A 4 6.385 -6.497 5.142 1.00 0.27 H new ATOM 65 N THR A 5 5.270 -9.687 8.317 1.00 0.32 N ATOM 66 CA THR A 5 4.875 -11.061 8.604 1.00 0.37 C ATOM 67 C THR A 5 6.065 -12.005 8.504 1.00 0.37 C ATOM 68 O THR A 5 6.622 -12.429 9.518 1.00 0.39 O ATOM 69 CB THR A 5 3.771 -11.538 7.640 1.00 0.42 C ATOM 70 OG1 THR A 5 2.646 -10.654 7.707 1.00 0.91 O ATOM 71 CG2 THR A 5 3.327 -12.953 7.979 1.00 0.91 C ATOM 0 H THR A 5 5.250 -9.438 7.328 1.00 0.32 H new ATOM 0 HA THR A 5 4.489 -11.076 9.623 1.00 0.37 H new ATOM 0 HB THR A 5 4.179 -11.534 6.629 1.00 0.42 H new ATOM 0 HG1 THR A 5 2.855 -9.822 7.234 1.00 0.91 H new ATOM 0 HG21 THR A 5 2.548 -13.266 7.284 1.00 0.91 H new ATOM 0 HG22 THR A 5 4.177 -13.630 7.899 1.00 0.91 H new ATOM 0 HG23 THR A 5 2.937 -12.978 8.997 1.00 0.91 H new ATOM 79 N GLU A 6 6.457 -12.308 7.268 1.00 0.35 N ATOM 80 CA GLU A 6 7.578 -13.203 6.996 1.00 0.35 C ATOM 81 C GLU A 6 7.693 -13.449 5.501 1.00 0.34 C ATOM 82 O GLU A 6 8.790 -13.428 4.947 1.00 0.32 O ATOM 83 CB GLU A 6 7.414 -14.532 7.734 1.00 0.40 C ATOM 84 CG GLU A 6 8.607 -15.463 7.588 1.00 0.94 C ATOM 85 CD GLU A 6 8.359 -16.830 8.194 1.00 1.48 C ATOM 86 OE1 GLU A 6 7.859 -17.719 7.472 1.00 1.55 O ATOM 87 OE2 GLU A 6 8.667 -17.015 9.391 1.00 2.21 O ATOM 0 H GLU A 6 6.007 -11.941 6.429 1.00 0.35 H new ATOM 0 HA GLU A 6 8.490 -12.726 7.355 1.00 0.35 H new ATOM 0 HB2 GLU A 6 7.248 -14.332 8.792 1.00 0.40 H new ATOM 0 HB3 GLU A 6 6.523 -15.037 7.362 1.00 0.40 H new ATOM 0 HG2 GLU A 6 8.847 -15.577 6.531 1.00 0.94 H new ATOM 0 HG3 GLU A 6 9.476 -15.011 8.065 1.00 0.94 H new ATOM 94 N GLU A 7 6.560 -13.698 4.852 1.00 0.38 N ATOM 95 CA GLU A 7 6.555 -13.912 3.414 1.00 0.40 C ATOM 96 C GLU A 7 7.044 -12.646 2.726 1.00 0.35 C ATOM 97 O GLU A 7 7.928 -12.687 1.869 1.00 0.33 O ATOM 98 CB GLU A 7 5.155 -14.290 2.922 1.00 0.46 C ATOM 99 CG GLU A 7 4.061 -13.341 3.383 1.00 0.49 C ATOM 100 CD GLU A 7 2.679 -13.800 2.960 1.00 0.56 C ATOM 101 OE1 GLU A 7 2.319 -13.595 1.781 1.00 0.60 O ATOM 102 OE2 GLU A 7 1.955 -14.363 3.808 1.00 0.62 O ATOM 0 H GLU A 7 5.643 -13.756 5.296 1.00 0.38 H new ATOM 0 HA GLU A 7 7.221 -14.740 3.170 1.00 0.40 H new ATOM 0 HB2 GLU A 7 5.160 -14.321 1.832 1.00 0.46 H new ATOM 0 HB3 GLU A 7 4.919 -15.296 3.268 1.00 0.46 H new ATOM 0 HG2 GLU A 7 4.095 -13.253 4.469 1.00 0.49 H new ATOM 0 HG3 GLU A 7 4.251 -12.348 2.976 1.00 0.49 H new ATOM 109 N GLN A 8 6.463 -11.516 3.122 1.00 0.33 N ATOM 110 CA GLN A 8 6.851 -10.228 2.581 1.00 0.30 C ATOM 111 C GLN A 8 8.300 -9.950 2.936 1.00 0.24 C ATOM 112 O GLN A 8 9.043 -9.339 2.166 1.00 0.22 O ATOM 113 CB GLN A 8 5.958 -9.133 3.151 1.00 0.32 C ATOM 114 CG GLN A 8 5.753 -9.251 4.650 1.00 0.32 C ATOM 115 CD GLN A 8 4.696 -8.294 5.180 1.00 0.36 C ATOM 116 OE1 GLN A 8 4.019 -8.587 6.165 1.00 0.85 O ATOM 117 NE2 GLN A 8 4.541 -7.146 4.526 1.00 0.57 N ATOM 0 H GLN A 8 5.719 -11.473 3.819 1.00 0.33 H new ATOM 0 HA GLN A 8 6.739 -10.243 1.497 1.00 0.30 H new ATOM 0 HB2 GLN A 8 6.397 -8.161 2.926 1.00 0.32 H new ATOM 0 HB3 GLN A 8 4.989 -9.168 2.654 1.00 0.32 H new ATOM 0 HG2 GLN A 8 5.464 -10.274 4.893 1.00 0.32 H new ATOM 0 HG3 GLN A 8 6.698 -9.058 5.157 1.00 0.32 H new ATOM 0 HE21 GLN A 8 5.122 -6.940 3.713 1.00 0.57 H new ATOM 0 HE22 GLN A 8 3.841 -6.472 4.837 1.00 0.57 H new ATOM 126 N ILE A 9 8.693 -10.424 4.117 1.00 0.22 N ATOM 127 CA ILE A 9 10.049 -10.248 4.594 1.00 0.18 C ATOM 128 C ILE A 9 11.004 -10.956 3.657 1.00 0.17 C ATOM 129 O ILE A 9 12.049 -10.425 3.288 1.00 0.15 O ATOM 130 CB ILE A 9 10.225 -10.784 6.028 1.00 0.20 C ATOM 131 CG1 ILE A 9 9.305 -10.021 6.986 1.00 0.21 C ATOM 132 CG2 ILE A 9 11.680 -10.665 6.464 1.00 0.21 C ATOM 133 CD1 ILE A 9 9.391 -10.487 8.423 1.00 0.24 C ATOM 0 H ILE A 9 8.084 -10.933 4.757 1.00 0.22 H new ATOM 0 HA ILE A 9 10.267 -9.180 4.614 1.00 0.18 H new ATOM 0 HB ILE A 9 9.951 -11.839 6.050 1.00 0.20 H new ATOM 0 HG12 ILE A 9 9.552 -8.960 6.943 1.00 0.21 H new ATOM 0 HG13 ILE A 9 8.275 -10.122 6.643 1.00 0.21 H new ATOM 0 HG21 ILE A 9 11.788 -11.048 7.479 1.00 0.21 H new ATOM 0 HG22 ILE A 9 12.311 -11.244 5.789 1.00 0.21 H new ATOM 0 HG23 ILE A 9 11.984 -9.619 6.437 1.00 0.21 H new ATOM 0 HD11 ILE A 9 8.710 -9.898 9.038 1.00 0.24 H new ATOM 0 HD12 ILE A 9 9.114 -11.540 8.481 1.00 0.24 H new ATOM 0 HD13 ILE A 9 10.411 -10.359 8.786 1.00 0.24 H new ATOM 145 N ALA A 10 10.618 -12.162 3.272 1.00 0.20 N ATOM 146 CA ALA A 10 11.407 -12.966 2.356 1.00 0.21 C ATOM 147 C ALA A 10 11.409 -12.330 0.975 1.00 0.20 C ATOM 148 O ALA A 10 12.273 -12.610 0.146 1.00 0.19 O ATOM 149 CB ALA A 10 10.847 -14.378 2.284 1.00 0.26 C ATOM 0 H ALA A 10 9.755 -12.608 3.584 1.00 0.20 H new ATOM 0 HA ALA A 10 12.433 -13.015 2.722 1.00 0.21 H new ATOM 0 HB1 ALA A 10 11.446 -14.972 1.594 1.00 0.26 H new ATOM 0 HB2 ALA A 10 10.877 -14.832 3.274 1.00 0.26 H new ATOM 0 HB3 ALA A 10 9.816 -14.343 1.932 1.00 0.26 H new ATOM 155 N GLU A 11 10.420 -11.471 0.741 1.00 0.20 N ATOM 156 CA GLU A 11 10.281 -10.785 -0.540 1.00 0.21 C ATOM 157 C GLU A 11 11.406 -9.787 -0.754 1.00 0.18 C ATOM 158 O GLU A 11 12.322 -10.048 -1.527 1.00 0.18 O ATOM 159 CB GLU A 11 8.948 -10.053 -0.630 1.00 0.25 C ATOM 160 CG GLU A 11 8.425 -9.910 -2.050 1.00 0.29 C ATOM 161 CD GLU A 11 8.056 -11.242 -2.674 1.00 0.94 C ATOM 162 OE1 GLU A 11 8.956 -11.906 -3.230 1.00 1.78 O ATOM 163 OE2 GLU A 11 6.867 -11.621 -2.606 1.00 0.84 O ATOM 0 H GLU A 11 9.701 -11.233 1.424 1.00 0.20 H new ATOM 0 HA GLU A 11 10.326 -11.549 -1.316 1.00 0.21 H new ATOM 0 HB2 GLU A 11 8.209 -10.587 -0.032 1.00 0.25 H new ATOM 0 HB3 GLU A 11 9.058 -9.061 -0.191 1.00 0.25 H new ATOM 0 HG2 GLU A 11 7.550 -9.260 -2.047 1.00 0.29 H new ATOM 0 HG3 GLU A 11 9.182 -9.423 -2.664 1.00 0.29 H new ATOM 170 N PHE A 12 11.344 -8.634 -0.078 1.00 0.17 N ATOM 171 CA PHE A 12 12.394 -7.636 -0.254 1.00 0.17 C ATOM 172 C PHE A 12 13.743 -8.251 0.058 1.00 0.14 C ATOM 173 O PHE A 12 14.775 -7.797 -0.436 1.00 0.15 O ATOM 174 CB PHE A 12 12.157 -6.368 0.571 1.00 0.20 C ATOM 175 CG PHE A 12 11.742 -6.582 1.994 1.00 0.18 C ATOM 176 CD1 PHE A 12 10.414 -6.801 2.321 1.00 0.24 C ATOM 177 CD2 PHE A 12 12.688 -6.602 3.001 1.00 0.21 C ATOM 178 CE1 PHE A 12 10.039 -7.028 3.632 1.00 0.26 C ATOM 179 CE2 PHE A 12 12.321 -6.832 4.308 1.00 0.23 C ATOM 180 CZ PHE A 12 10.952 -6.911 4.635 1.00 0.21 C ATOM 0 H PHE A 12 10.603 -8.378 0.574 1.00 0.17 H new ATOM 0 HA PHE A 12 12.375 -7.320 -1.297 1.00 0.17 H new ATOM 0 HB2 PHE A 12 13.073 -5.777 0.565 1.00 0.20 H new ATOM 0 HB3 PHE A 12 11.390 -5.773 0.075 1.00 0.20 H new ATOM 0 HD1 PHE A 12 9.664 -6.794 1.544 1.00 0.24 H new ATOM 0 HD2 PHE A 12 13.727 -6.435 2.760 1.00 0.21 H new ATOM 0 HE1 PHE A 12 9.019 -7.299 3.861 1.00 0.26 H new ATOM 0 HE2 PHE A 12 13.073 -6.951 5.074 1.00 0.23 H new ATOM 0 HZ PHE A 12 10.632 -6.879 5.666 1.00 0.21 H new ATOM 190 N LYS A 13 13.729 -9.284 0.890 1.00 0.12 N ATOM 191 CA LYS A 13 14.947 -10.000 1.217 1.00 0.12 C ATOM 192 C LYS A 13 15.501 -10.629 -0.050 1.00 0.13 C ATOM 193 O LYS A 13 16.670 -10.457 -0.382 1.00 0.16 O ATOM 194 CB LYS A 13 14.673 -11.082 2.264 1.00 0.14 C ATOM 195 CG LYS A 13 15.821 -12.066 2.439 1.00 0.24 C ATOM 196 CD LYS A 13 17.034 -11.398 3.066 1.00 1.07 C ATOM 197 CE LYS A 13 18.265 -12.286 2.982 1.00 1.30 C ATOM 198 NZ LYS A 13 18.079 -13.566 3.721 1.00 2.27 N ATOM 0 H LYS A 13 12.890 -9.641 1.347 1.00 0.12 H new ATOM 0 HA LYS A 13 15.674 -9.303 1.634 1.00 0.12 H new ATOM 0 HB2 LYS A 13 14.466 -10.605 3.222 1.00 0.14 H new ATOM 0 HB3 LYS A 13 13.775 -11.631 1.980 1.00 0.14 H new ATOM 0 HG2 LYS A 13 15.497 -12.897 3.065 1.00 0.24 H new ATOM 0 HG3 LYS A 13 16.094 -12.484 1.470 1.00 0.24 H new ATOM 0 HD2 LYS A 13 17.231 -10.452 2.561 1.00 1.07 H new ATOM 0 HD3 LYS A 13 16.823 -11.164 4.110 1.00 1.07 H new ATOM 0 HE2 LYS A 13 18.488 -12.500 1.937 1.00 1.30 H new ATOM 0 HE3 LYS A 13 19.125 -11.754 3.389 1.00 1.30 H new ATOM 0 HZ1 LYS A 13 18.968 -14.105 3.711 1.00 2.27 H new ATOM 0 HZ2 LYS A 13 17.808 -13.363 4.704 1.00 2.27 H new ATOM 0 HZ3 LYS A 13 17.330 -14.125 3.264 1.00 2.27 H new ATOM 212 N ASP A 14 14.633 -11.343 -0.766 1.00 0.14 N ATOM 213 CA ASP A 14 15.017 -11.999 -2.007 1.00 0.16 C ATOM 214 C ASP A 14 15.366 -10.961 -3.067 1.00 0.16 C ATOM 215 O ASP A 14 16.263 -11.175 -3.881 1.00 0.17 O ATOM 216 CB ASP A 14 13.892 -12.920 -2.504 1.00 0.19 C ATOM 217 CG ASP A 14 12.875 -12.212 -3.383 1.00 0.20 C ATOM 218 OD1 ASP A 14 13.227 -11.847 -4.526 1.00 0.22 O ATOM 219 OD2 ASP A 14 11.724 -12.040 -2.938 1.00 0.22 O ATOM 0 H ASP A 14 13.657 -11.480 -0.503 1.00 0.14 H new ATOM 0 HA ASP A 14 15.899 -12.611 -1.816 1.00 0.16 H new ATOM 0 HB2 ASP A 14 14.330 -13.747 -3.062 1.00 0.19 H new ATOM 0 HB3 ASP A 14 13.380 -13.352 -1.644 1.00 0.19 H new ATOM 224 N ALA A 15 14.652 -9.834 -3.050 1.00 0.16 N ATOM 225 CA ALA A 15 14.897 -8.764 -4.009 1.00 0.17 C ATOM 226 C ALA A 15 16.271 -8.139 -3.780 1.00 0.16 C ATOM 227 O ALA A 15 16.953 -7.736 -4.720 1.00 0.20 O ATOM 228 CB ALA A 15 13.809 -7.705 -3.909 1.00 0.20 C ATOM 0 H ALA A 15 13.903 -9.642 -2.384 1.00 0.16 H new ATOM 0 HA ALA A 15 14.878 -9.190 -5.012 1.00 0.17 H new ATOM 0 HB1 ALA A 15 14.005 -6.912 -4.631 1.00 0.20 H new ATOM 0 HB2 ALA A 15 12.840 -8.157 -4.121 1.00 0.20 H new ATOM 0 HB3 ALA A 15 13.801 -7.286 -2.903 1.00 0.20 H new ATOM 234 N PHE A 16 16.650 -8.035 -2.516 1.00 0.14 N ATOM 235 CA PHE A 16 17.938 -7.468 -2.139 1.00 0.14 C ATOM 236 C PHE A 16 19.116 -8.284 -2.683 1.00 0.14 C ATOM 237 O PHE A 16 19.990 -7.755 -3.372 1.00 0.15 O ATOM 238 CB PHE A 16 18.030 -7.414 -0.615 1.00 0.15 C ATOM 239 CG PHE A 16 18.911 -6.314 -0.105 1.00 0.25 C ATOM 240 CD1 PHE A 16 20.272 -6.516 0.042 1.00 0.45 C ATOM 241 CD2 PHE A 16 18.380 -5.079 0.225 1.00 0.35 C ATOM 242 CE1 PHE A 16 21.089 -5.506 0.510 1.00 0.59 C ATOM 243 CE2 PHE A 16 19.190 -4.066 0.693 1.00 0.50 C ATOM 244 CZ PHE A 16 20.537 -4.272 0.841 1.00 0.59 C ATOM 0 H PHE A 16 16.079 -8.338 -1.727 1.00 0.14 H new ATOM 0 HA PHE A 16 18.000 -6.469 -2.572 1.00 0.14 H new ATOM 0 HB2 PHE A 16 17.029 -7.286 -0.203 1.00 0.15 H new ATOM 0 HB3 PHE A 16 18.406 -8.369 -0.248 1.00 0.15 H new ATOM 0 HD1 PHE A 16 20.700 -7.474 -0.212 1.00 0.45 H new ATOM 0 HD2 PHE A 16 17.320 -4.907 0.115 1.00 0.35 H new ATOM 0 HE1 PHE A 16 22.151 -5.673 0.619 1.00 0.59 H new ATOM 0 HE2 PHE A 16 18.762 -3.107 0.944 1.00 0.50 H new ATOM 0 HZ PHE A 16 21.168 -3.479 1.213 1.00 0.59 H new ATOM 254 N VAL A 17 19.121 -9.577 -2.363 1.00 0.16 N ATOM 255 CA VAL A 17 20.204 -10.485 -2.761 1.00 0.18 C ATOM 256 C VAL A 17 20.351 -10.592 -4.268 1.00 0.16 C ATOM 257 O VAL A 17 21.459 -10.574 -4.802 1.00 0.15 O ATOM 258 CB VAL A 17 19.989 -11.914 -2.190 1.00 0.22 C ATOM 259 CG1 VAL A 17 19.090 -11.877 -0.975 1.00 0.31 C ATOM 260 CG2 VAL A 17 19.406 -12.861 -3.233 1.00 0.28 C ATOM 0 H VAL A 17 18.381 -10.026 -1.824 1.00 0.16 H new ATOM 0 HA VAL A 17 21.114 -10.051 -2.347 1.00 0.18 H new ATOM 0 HB VAL A 17 20.970 -12.292 -1.900 1.00 0.22 H new ATOM 0 HG11 VAL A 17 18.954 -12.888 -0.592 1.00 0.31 H new ATOM 0 HG12 VAL A 17 19.546 -11.256 -0.204 1.00 0.31 H new ATOM 0 HG13 VAL A 17 18.122 -11.460 -1.251 1.00 0.31 H new ATOM 0 HG21 VAL A 17 19.272 -13.849 -2.793 1.00 0.28 H new ATOM 0 HG22 VAL A 17 18.442 -12.480 -3.572 1.00 0.28 H new ATOM 0 HG23 VAL A 17 20.087 -12.932 -4.081 1.00 0.28 H new ATOM 270 N GLN A 18 19.220 -10.687 -4.945 1.00 0.17 N ATOM 271 CA GLN A 18 19.201 -10.847 -6.381 1.00 0.18 C ATOM 272 C GLN A 18 19.867 -9.663 -7.069 1.00 0.15 C ATOM 273 O GLN A 18 20.195 -9.721 -8.254 1.00 0.18 O ATOM 274 CB GLN A 18 17.770 -11.029 -6.850 1.00 0.23 C ATOM 275 CG GLN A 18 16.885 -9.846 -6.546 1.00 0.19 C ATOM 276 CD GLN A 18 15.626 -9.839 -7.378 1.00 0.39 C ATOM 277 OE1 GLN A 18 15.580 -9.245 -8.456 1.00 1.02 O ATOM 278 NE2 GLN A 18 14.596 -10.508 -6.883 1.00 0.42 N ATOM 0 H GLN A 18 18.296 -10.655 -4.514 1.00 0.17 H new ATOM 0 HA GLN A 18 19.771 -11.736 -6.650 1.00 0.18 H new ATOM 0 HB2 GLN A 18 17.768 -11.208 -7.925 1.00 0.23 H new ATOM 0 HB3 GLN A 18 17.351 -11.918 -6.378 1.00 0.23 H new ATOM 0 HG2 GLN A 18 16.618 -9.857 -5.489 1.00 0.19 H new ATOM 0 HG3 GLN A 18 17.440 -8.925 -6.725 1.00 0.19 H new ATOM 0 HE21 GLN A 18 14.681 -10.985 -5.985 1.00 0.42 H new ATOM 0 HE22 GLN A 18 13.717 -10.546 -7.399 1.00 0.42 H new ATOM 287 N PHE A 19 20.062 -8.592 -6.312 1.00 0.12 N ATOM 288 CA PHE A 19 20.711 -7.396 -6.828 1.00 0.15 C ATOM 289 C PHE A 19 22.176 -7.350 -6.405 1.00 0.18 C ATOM 290 O PHE A 19 23.017 -6.794 -7.111 1.00 0.26 O ATOM 291 CB PHE A 19 19.976 -6.147 -6.341 1.00 0.16 C ATOM 292 CG PHE A 19 18.884 -5.694 -7.271 1.00 0.18 C ATOM 293 CD1 PHE A 19 17.999 -6.609 -7.821 1.00 0.26 C ATOM 294 CD2 PHE A 19 18.749 -4.356 -7.600 1.00 0.23 C ATOM 295 CE1 PHE A 19 16.999 -6.196 -8.680 1.00 0.28 C ATOM 296 CE2 PHE A 19 17.752 -3.937 -8.461 1.00 0.25 C ATOM 297 CZ PHE A 19 16.875 -4.859 -9.001 1.00 0.24 C ATOM 0 H PHE A 19 19.778 -8.528 -5.334 1.00 0.12 H new ATOM 0 HA PHE A 19 20.672 -7.425 -7.917 1.00 0.15 H new ATOM 0 HB2 PHE A 19 19.547 -6.347 -5.359 1.00 0.16 H new ATOM 0 HB3 PHE A 19 20.695 -5.337 -6.216 1.00 0.16 H new ATOM 0 HD1 PHE A 19 18.093 -7.656 -7.575 1.00 0.26 H new ATOM 0 HD2 PHE A 19 19.430 -3.631 -7.179 1.00 0.23 H new ATOM 0 HE1 PHE A 19 16.315 -6.918 -9.100 1.00 0.28 H new ATOM 0 HE2 PHE A 19 17.658 -2.891 -8.711 1.00 0.25 H new ATOM 0 HZ PHE A 19 16.094 -4.534 -9.673 1.00 0.24 H new ATOM 307 N ASP A 20 22.476 -7.938 -5.247 1.00 0.15 N ATOM 308 CA ASP A 20 23.844 -7.961 -4.738 1.00 0.19 C ATOM 309 C ASP A 20 24.584 -9.223 -5.180 1.00 0.27 C ATOM 310 O ASP A 20 25.253 -9.229 -6.213 1.00 0.37 O ATOM 311 CB ASP A 20 23.859 -7.871 -3.210 1.00 0.20 C ATOM 312 CG ASP A 20 25.238 -8.134 -2.642 1.00 0.29 C ATOM 313 OD1 ASP A 20 26.175 -7.383 -2.986 1.00 0.34 O ATOM 314 OD2 ASP A 20 25.379 -9.085 -1.846 1.00 0.40 O ATOM 0 H ASP A 20 21.793 -8.402 -4.648 1.00 0.15 H new ATOM 0 HA ASP A 20 24.356 -7.093 -5.154 1.00 0.19 H new ATOM 0 HB2 ASP A 20 23.522 -6.881 -2.901 1.00 0.20 H new ATOM 0 HB3 ASP A 20 23.153 -8.591 -2.797 1.00 0.20 H new ATOM 319 N LYS A 21 24.442 -10.294 -4.398 1.00 0.35 N ATOM 320 CA LYS A 21 25.113 -11.560 -4.684 1.00 0.45 C ATOM 321 C LYS A 21 26.607 -11.353 -4.937 1.00 0.46 C ATOM 322 O LYS A 21 27.271 -12.205 -5.527 1.00 0.84 O ATOM 323 CB LYS A 21 24.461 -12.259 -5.879 1.00 0.53 C ATOM 324 CG LYS A 21 23.188 -13.010 -5.520 1.00 0.61 C ATOM 325 CD LYS A 21 23.489 -14.262 -4.711 1.00 0.69 C ATOM 326 CE LYS A 21 22.214 -14.998 -4.329 1.00 0.83 C ATOM 327 NZ LYS A 21 21.496 -15.520 -5.524 1.00 1.65 N ATOM 0 H LYS A 21 23.865 -10.308 -3.557 1.00 0.35 H new ATOM 0 HA LYS A 21 25.006 -12.197 -3.806 1.00 0.45 H new ATOM 0 HB2 LYS A 21 24.233 -11.517 -6.644 1.00 0.53 H new ATOM 0 HB3 LYS A 21 25.175 -12.957 -6.316 1.00 0.53 H new ATOM 0 HG2 LYS A 21 22.528 -12.357 -4.949 1.00 0.61 H new ATOM 0 HG3 LYS A 21 22.656 -13.283 -6.431 1.00 0.61 H new ATOM 0 HD2 LYS A 21 24.133 -14.924 -5.289 1.00 0.69 H new ATOM 0 HD3 LYS A 21 24.038 -13.991 -3.809 1.00 0.69 H new ATOM 0 HE2 LYS A 21 22.458 -15.825 -3.662 1.00 0.83 H new ATOM 0 HE3 LYS A 21 21.558 -14.325 -3.776 1.00 0.83 H new ATOM 0 HZ1 LYS A 21 20.742 -16.168 -5.220 1.00 1.65 H new ATOM 0 HZ2 LYS A 21 21.079 -14.727 -6.052 1.00 1.65 H new ATOM 0 HZ3 LYS A 21 22.165 -16.030 -6.136 1.00 1.65 H new ATOM 341 N GLU A 22 27.128 -10.212 -4.489 1.00 0.42 N ATOM 342 CA GLU A 22 28.545 -9.901 -4.649 1.00 0.47 C ATOM 343 C GLU A 22 29.341 -10.402 -3.451 1.00 0.45 C ATOM 344 O GLU A 22 30.553 -10.608 -3.535 1.00 0.53 O ATOM 345 CB GLU A 22 28.746 -8.391 -4.797 1.00 0.46 C ATOM 346 CG GLU A 22 27.907 -7.769 -5.901 1.00 0.66 C ATOM 347 CD GLU A 22 28.219 -6.300 -6.115 1.00 1.52 C ATOM 348 OE1 GLU A 22 27.700 -5.464 -5.347 1.00 2.47 O ATOM 349 OE2 GLU A 22 28.982 -5.986 -7.054 1.00 1.49 O ATOM 0 H GLU A 22 26.589 -9.489 -4.013 1.00 0.42 H new ATOM 0 HA GLU A 22 28.902 -10.402 -5.549 1.00 0.47 H new ATOM 0 HB2 GLU A 22 28.503 -7.907 -3.851 1.00 0.46 H new ATOM 0 HB3 GLU A 22 29.799 -8.191 -4.996 1.00 0.46 H new ATOM 0 HG2 GLU A 22 28.077 -8.312 -6.831 1.00 0.66 H new ATOM 0 HG3 GLU A 22 26.851 -7.880 -5.656 1.00 0.66 H new ATOM 356 N GLY A 23 28.646 -10.595 -2.335 1.00 0.48 N ATOM 357 CA GLY A 23 29.289 -11.055 -1.119 1.00 0.51 C ATOM 358 C GLY A 23 29.089 -10.081 0.024 1.00 0.45 C ATOM 359 O GLY A 23 29.601 -10.283 1.125 1.00 0.72 O ATOM 0 H GLY A 23 27.641 -10.440 -2.252 1.00 0.48 H new ATOM 0 HA2 GLY A 23 28.887 -12.029 -0.841 1.00 0.51 H new ATOM 0 HA3 GLY A 23 30.355 -11.190 -1.300 1.00 0.51 H new ATOM 363 N THR A 24 28.339 -9.016 -0.248 1.00 0.33 N ATOM 364 CA THR A 24 28.056 -7.988 0.747 1.00 0.33 C ATOM 365 C THR A 24 26.624 -7.485 0.593 1.00 0.27 C ATOM 366 O THR A 24 26.269 -6.933 -0.443 1.00 0.25 O ATOM 367 CB THR A 24 29.022 -6.792 0.617 1.00 0.43 C ATOM 368 OG1 THR A 24 28.686 -6.012 -0.537 1.00 0.52 O ATOM 369 CG2 THR A 24 30.463 -7.266 0.500 1.00 0.44 C ATOM 0 H THR A 24 27.913 -8.843 -1.159 1.00 0.33 H new ATOM 0 HA THR A 24 28.190 -8.441 1.729 1.00 0.33 H new ATOM 0 HB THR A 24 28.925 -6.182 1.515 1.00 0.43 H new ATOM 0 HG1 THR A 24 27.865 -6.363 -0.941 1.00 0.52 H new ATOM 0 HG21 THR A 24 31.123 -6.404 0.410 1.00 0.44 H new ATOM 0 HG22 THR A 24 30.731 -7.837 1.389 1.00 0.44 H new ATOM 0 HG23 THR A 24 30.568 -7.897 -0.382 1.00 0.44 H new ATOM 377 N GLY A 25 25.807 -7.687 1.624 1.00 0.27 N ATOM 378 CA GLY A 25 24.419 -7.259 1.576 1.00 0.24 C ATOM 379 C GLY A 25 24.246 -5.754 1.584 1.00 0.20 C ATOM 380 O GLY A 25 23.688 -5.194 2.528 1.00 0.21 O ATOM 0 H GLY A 25 26.083 -8.141 2.495 1.00 0.27 H new ATOM 0 HA2 GLY A 25 23.954 -7.665 0.678 1.00 0.24 H new ATOM 0 HA3 GLY A 25 23.888 -7.682 2.429 1.00 0.24 H new ATOM 384 N LYS A 26 24.721 -5.099 0.535 1.00 0.16 N ATOM 385 CA LYS A 26 24.596 -3.656 0.408 1.00 0.14 C ATOM 386 C LYS A 26 24.478 -3.284 -1.063 1.00 0.14 C ATOM 387 O LYS A 26 25.405 -3.494 -1.844 1.00 0.17 O ATOM 388 CB LYS A 26 25.785 -2.925 1.043 1.00 0.17 C ATOM 389 CG LYS A 26 26.386 -3.638 2.244 1.00 0.37 C ATOM 390 CD LYS A 26 27.649 -2.947 2.732 1.00 0.50 C ATOM 391 CE LYS A 26 28.239 -3.654 3.941 1.00 0.56 C ATOM 392 NZ LYS A 26 29.514 -3.028 4.384 1.00 1.37 N ATOM 0 H LYS A 26 25.200 -5.549 -0.245 1.00 0.16 H new ATOM 0 HA LYS A 26 23.698 -3.345 0.941 1.00 0.14 H new ATOM 0 HB2 LYS A 26 26.560 -2.792 0.288 1.00 0.17 H new ATOM 0 HB3 LYS A 26 25.464 -1.929 1.349 1.00 0.17 H new ATOM 0 HG2 LYS A 26 25.654 -3.672 3.051 1.00 0.37 H new ATOM 0 HG3 LYS A 26 26.615 -4.670 1.978 1.00 0.37 H new ATOM 0 HD2 LYS A 26 28.385 -2.922 1.929 1.00 0.50 H new ATOM 0 HD3 LYS A 26 27.423 -1.912 2.989 1.00 0.50 H new ATOM 0 HE2 LYS A 26 27.520 -3.632 4.760 1.00 0.56 H new ATOM 0 HE3 LYS A 26 28.415 -4.702 3.698 1.00 0.56 H new ATOM 0 HZ1 LYS A 26 29.883 -3.540 5.211 1.00 1.37 H new ATOM 0 HZ2 LYS A 26 30.209 -3.071 3.611 1.00 1.37 H new ATOM 0 HZ3 LYS A 26 29.342 -2.035 4.640 1.00 1.37 H new ATOM 406 N ILE A 27 23.329 -2.742 -1.434 1.00 0.16 N ATOM 407 CA ILE A 27 23.079 -2.353 -2.822 1.00 0.19 C ATOM 408 C ILE A 27 23.251 -0.855 -3.030 1.00 0.19 C ATOM 409 O ILE A 27 23.116 -0.068 -2.099 1.00 0.22 O ATOM 410 CB ILE A 27 21.662 -2.748 -3.273 1.00 0.23 C ATOM 411 CG1 ILE A 27 20.648 -2.389 -2.188 1.00 0.28 C ATOM 412 CG2 ILE A 27 21.600 -4.232 -3.599 1.00 0.32 C ATOM 413 CD1 ILE A 27 19.277 -2.054 -2.730 1.00 0.34 C ATOM 0 H ILE A 27 22.553 -2.560 -0.798 1.00 0.16 H new ATOM 0 HA ILE A 27 23.816 -2.887 -3.422 1.00 0.19 H new ATOM 0 HB ILE A 27 21.414 -2.193 -4.178 1.00 0.23 H new ATOM 0 HG12 ILE A 27 20.561 -3.224 -1.493 1.00 0.28 H new ATOM 0 HG13 ILE A 27 21.023 -1.538 -1.619 1.00 0.28 H new ATOM 0 HG21 ILE A 27 20.590 -4.493 -3.916 1.00 0.32 H new ATOM 0 HG22 ILE A 27 22.302 -4.458 -4.402 1.00 0.32 H new ATOM 0 HG23 ILE A 27 21.863 -4.810 -2.713 1.00 0.32 H new ATOM 0 HD11 ILE A 27 18.609 -1.809 -1.904 1.00 0.34 H new ATOM 0 HD12 ILE A 27 19.351 -1.200 -3.403 1.00 0.34 H new ATOM 0 HD13 ILE A 27 18.882 -2.911 -3.275 1.00 0.34 H new ATOM 425 N ALA A 28 23.529 -0.467 -4.272 1.00 0.19 N ATOM 426 CA ALA A 28 23.718 0.935 -4.614 1.00 0.21 C ATOM 427 C ALA A 28 22.404 1.695 -4.500 1.00 0.20 C ATOM 428 O ALA A 28 21.385 1.288 -5.058 1.00 0.20 O ATOM 429 CB ALA A 28 24.292 1.067 -6.016 1.00 0.23 C ATOM 0 H ALA A 28 23.628 -1.108 -5.059 1.00 0.19 H new ATOM 0 HA ALA A 28 24.427 1.369 -3.909 1.00 0.21 H new ATOM 0 HB1 ALA A 28 24.427 2.122 -6.256 1.00 0.23 H new ATOM 0 HB2 ALA A 28 25.254 0.558 -6.065 1.00 0.23 H new ATOM 0 HB3 ALA A 28 23.606 0.617 -6.734 1.00 0.23 H new ATOM 435 N THR A 29 22.442 2.798 -3.761 1.00 0.21 N ATOM 436 CA THR A 29 21.266 3.630 -3.545 1.00 0.22 C ATOM 437 C THR A 29 20.635 4.082 -4.860 1.00 0.22 C ATOM 438 O THR A 29 19.421 4.277 -4.938 1.00 0.22 O ATOM 439 CB THR A 29 21.623 4.872 -2.710 1.00 0.26 C ATOM 440 OG1 THR A 29 22.514 5.717 -3.447 1.00 0.28 O ATOM 441 CG2 THR A 29 22.274 4.467 -1.397 1.00 0.28 C ATOM 0 H THR A 29 23.284 3.139 -3.297 1.00 0.21 H new ATOM 0 HA THR A 29 20.544 3.016 -3.007 1.00 0.22 H new ATOM 0 HB THR A 29 20.704 5.415 -2.492 1.00 0.26 H new ATOM 0 HG1 THR A 29 23.095 6.202 -2.824 1.00 0.28 H new ATOM 0 HG21 THR A 29 22.519 5.360 -0.822 1.00 0.28 H new ATOM 0 HG22 THR A 29 21.585 3.845 -0.826 1.00 0.28 H new ATOM 0 HG23 THR A 29 23.186 3.906 -1.601 1.00 0.28 H new ATOM 449 N ARG A 30 21.461 4.253 -5.889 1.00 0.23 N ATOM 450 CA ARG A 30 20.973 4.686 -7.196 1.00 0.25 C ATOM 451 C ARG A 30 20.104 3.613 -7.851 1.00 0.26 C ATOM 452 O ARG A 30 19.590 3.807 -8.953 1.00 0.43 O ATOM 453 CB ARG A 30 22.148 5.039 -8.112 1.00 0.29 C ATOM 454 CG ARG A 30 23.071 3.868 -8.409 1.00 1.36 C ATOM 455 CD ARG A 30 24.192 4.274 -9.353 1.00 1.46 C ATOM 456 NE ARG A 30 25.067 3.152 -9.679 1.00 1.85 N ATOM 457 CZ ARG A 30 26.115 3.245 -10.493 1.00 2.23 C ATOM 458 NH1 ARG A 30 26.418 4.405 -11.061 1.00 2.10 N ATOM 459 NH2 ARG A 30 26.861 2.177 -10.740 1.00 3.19 N ATOM 0 H ARG A 30 22.468 4.099 -5.844 1.00 0.23 H new ATOM 0 HA ARG A 30 20.358 5.573 -7.043 1.00 0.25 H new ATOM 0 HB2 ARG A 30 21.758 5.429 -9.052 1.00 0.29 H new ATOM 0 HB3 ARG A 30 22.728 5.838 -7.651 1.00 0.29 H new ATOM 0 HG2 ARG A 30 23.495 3.491 -7.478 1.00 1.36 H new ATOM 0 HG3 ARG A 30 22.498 3.053 -8.851 1.00 1.36 H new ATOM 0 HD2 ARG A 30 23.764 4.679 -10.270 1.00 1.46 H new ATOM 0 HD3 ARG A 30 24.779 5.071 -8.897 1.00 1.46 H new ATOM 0 HE ARG A 30 24.863 2.245 -9.259 1.00 1.85 H new ATOM 0 HH11 ARG A 30 25.847 5.229 -10.874 1.00 2.10 H new ATOM 0 HH12 ARG A 30 27.222 4.473 -11.685 1.00 2.10 H new ATOM 0 HH21 ARG A 30 26.631 1.283 -10.306 1.00 3.19 H new ATOM 0 HH22 ARG A 30 27.664 2.249 -11.364 1.00 3.19 H new ATOM 473 N GLU A 31 19.945 2.483 -7.168 1.00 0.17 N ATOM 474 CA GLU A 31 19.138 1.381 -7.681 1.00 0.18 C ATOM 475 C GLU A 31 18.181 0.875 -6.605 1.00 0.16 C ATOM 476 O GLU A 31 17.753 -0.279 -6.625 1.00 0.18 O ATOM 477 CB GLU A 31 20.046 0.245 -8.161 1.00 0.20 C ATOM 478 CG GLU A 31 19.369 -0.714 -9.128 1.00 0.26 C ATOM 479 CD GLU A 31 20.355 -1.642 -9.810 1.00 0.29 C ATOM 480 OE1 GLU A 31 20.673 -2.700 -9.228 1.00 0.28 O ATOM 481 OE2 GLU A 31 20.808 -1.313 -10.925 1.00 0.44 O ATOM 0 H GLU A 31 20.366 2.307 -6.256 1.00 0.17 H new ATOM 0 HA GLU A 31 18.549 1.742 -8.524 1.00 0.18 H new ATOM 0 HB2 GLU A 31 20.924 0.674 -8.644 1.00 0.20 H new ATOM 0 HB3 GLU A 31 20.400 -0.316 -7.296 1.00 0.20 H new ATOM 0 HG2 GLU A 31 18.630 -1.307 -8.589 1.00 0.26 H new ATOM 0 HG3 GLU A 31 18.830 -0.143 -9.884 1.00 0.26 H new ATOM 488 N LEU A 32 17.851 1.758 -5.669 1.00 0.17 N ATOM 489 CA LEU A 32 16.952 1.424 -4.569 1.00 0.19 C ATOM 490 C LEU A 32 15.492 1.445 -5.016 1.00 0.18 C ATOM 491 O LEU A 32 14.700 0.573 -4.644 1.00 0.17 O ATOM 492 CB LEU A 32 17.153 2.413 -3.420 1.00 0.24 C ATOM 493 CG LEU A 32 16.319 2.133 -2.173 1.00 0.29 C ATOM 494 CD1 LEU A 32 16.769 0.837 -1.521 1.00 0.39 C ATOM 495 CD2 LEU A 32 16.415 3.290 -1.191 1.00 0.38 C ATOM 0 H LEU A 32 18.195 2.718 -5.650 1.00 0.17 H new ATOM 0 HA LEU A 32 17.189 0.414 -4.234 1.00 0.19 H new ATOM 0 HB2 LEU A 32 18.207 2.413 -3.141 1.00 0.24 H new ATOM 0 HB3 LEU A 32 16.918 3.415 -3.778 1.00 0.24 H new ATOM 0 HG LEU A 32 15.276 2.028 -2.470 1.00 0.29 H new ATOM 0 HD11 LEU A 32 16.166 0.648 -0.632 1.00 0.39 H new ATOM 0 HD12 LEU A 32 16.646 0.014 -2.225 1.00 0.39 H new ATOM 0 HD13 LEU A 32 17.818 0.918 -1.237 1.00 0.39 H new ATOM 0 HD21 LEU A 32 15.813 3.070 -0.309 1.00 0.38 H new ATOM 0 HD22 LEU A 32 17.455 3.431 -0.895 1.00 0.38 H new ATOM 0 HD23 LEU A 32 16.046 4.200 -1.664 1.00 0.38 H new ATOM 507 N GLY A 33 15.144 2.458 -5.806 1.00 0.22 N ATOM 508 CA GLY A 33 13.785 2.595 -6.295 1.00 0.23 C ATOM 509 C GLY A 33 13.231 1.305 -6.867 1.00 0.20 C ATOM 510 O GLY A 33 12.066 0.976 -6.652 1.00 0.19 O ATOM 0 H GLY A 33 15.784 3.189 -6.117 1.00 0.22 H new ATOM 0 HA2 GLY A 33 13.143 2.930 -5.480 1.00 0.23 H new ATOM 0 HA3 GLY A 33 13.757 3.369 -7.062 1.00 0.23 H new ATOM 514 N THR A 34 14.070 0.569 -7.588 1.00 0.19 N ATOM 515 CA THR A 34 13.656 -0.685 -8.206 1.00 0.18 C ATOM 516 C THR A 34 13.060 -1.653 -7.187 1.00 0.16 C ATOM 517 O THR A 34 11.989 -2.216 -7.414 1.00 0.17 O ATOM 518 CB THR A 34 14.831 -1.373 -8.924 1.00 0.21 C ATOM 519 OG1 THR A 34 15.454 -0.457 -9.834 1.00 0.26 O ATOM 520 CG2 THR A 34 14.353 -2.601 -9.685 1.00 0.23 C ATOM 0 H THR A 34 15.044 0.820 -7.759 1.00 0.19 H new ATOM 0 HA THR A 34 12.889 -0.427 -8.936 1.00 0.18 H new ATOM 0 HB THR A 34 15.555 -1.687 -8.172 1.00 0.21 H new ATOM 0 HG1 THR A 34 16.201 -0.902 -10.285 1.00 0.26 H new ATOM 0 HG21 THR A 34 15.200 -3.072 -10.185 1.00 0.23 H new ATOM 0 HG22 THR A 34 13.904 -3.309 -8.988 1.00 0.23 H new ATOM 0 HG23 THR A 34 13.613 -2.303 -10.428 1.00 0.23 H new ATOM 528 N LEU A 35 13.753 -1.850 -6.067 1.00 0.13 N ATOM 529 CA LEU A 35 13.272 -2.764 -5.035 1.00 0.12 C ATOM 530 C LEU A 35 11.950 -2.304 -4.443 1.00 0.14 C ATOM 531 O LEU A 35 10.959 -3.028 -4.498 1.00 0.15 O ATOM 532 CB LEU A 35 14.310 -2.922 -3.920 1.00 0.13 C ATOM 533 CG LEU A 35 15.299 -4.076 -4.109 1.00 0.14 C ATOM 534 CD1 LEU A 35 15.881 -4.069 -5.511 1.00 0.18 C ATOM 535 CD2 LEU A 35 16.405 -3.999 -3.069 1.00 0.20 C ATOM 0 H LEU A 35 14.640 -1.394 -5.853 1.00 0.13 H new ATOM 0 HA LEU A 35 13.111 -3.729 -5.515 1.00 0.12 H new ATOM 0 HB2 LEU A 35 14.873 -1.992 -3.835 1.00 0.13 H new ATOM 0 HB3 LEU A 35 13.786 -3.065 -2.975 1.00 0.13 H new ATOM 0 HG LEU A 35 14.760 -5.014 -3.975 1.00 0.14 H new ATOM 0 HD11 LEU A 35 16.580 -4.898 -5.619 1.00 0.18 H new ATOM 0 HD12 LEU A 35 15.077 -4.175 -6.239 1.00 0.18 H new ATOM 0 HD13 LEU A 35 16.404 -3.129 -5.683 1.00 0.18 H new ATOM 0 HD21 LEU A 35 17.100 -4.825 -3.216 1.00 0.20 H new ATOM 0 HD22 LEU A 35 16.938 -3.054 -3.174 1.00 0.20 H new ATOM 0 HD23 LEU A 35 15.971 -4.063 -2.071 1.00 0.20 H new ATOM 547 N MET A 36 11.919 -1.093 -3.901 1.00 0.17 N ATOM 548 CA MET A 36 10.691 -0.586 -3.300 1.00 0.21 C ATOM 549 C MET A 36 9.531 -0.664 -4.288 1.00 0.23 C ATOM 550 O MET A 36 8.383 -0.858 -3.891 1.00 0.26 O ATOM 551 CB MET A 36 10.871 0.840 -2.774 1.00 0.25 C ATOM 552 CG MET A 36 11.850 1.686 -3.568 1.00 0.21 C ATOM 553 SD MET A 36 12.751 2.856 -2.529 1.00 0.30 S ATOM 554 CE MET A 36 11.431 3.498 -1.499 1.00 0.73 C ATOM 0 H MET A 36 12.713 -0.454 -3.865 1.00 0.17 H new ATOM 0 HA MET A 36 10.453 -1.221 -2.447 1.00 0.21 H new ATOM 0 HB2 MET A 36 9.901 1.337 -2.770 1.00 0.25 H new ATOM 0 HB3 MET A 36 11.209 0.792 -1.739 1.00 0.25 H new ATOM 0 HG2 MET A 36 12.560 1.034 -4.076 1.00 0.21 H new ATOM 0 HG3 MET A 36 11.310 2.232 -4.341 1.00 0.21 H new ATOM 0 HE1 MET A 36 11.659 4.525 -1.213 1.00 0.73 H new ATOM 0 HE2 MET A 36 10.493 3.476 -2.054 1.00 0.73 H new ATOM 0 HE3 MET A 36 11.337 2.884 -0.603 1.00 0.73 H new ATOM 564 N ARG A 37 9.835 -0.526 -5.577 1.00 0.23 N ATOM 565 CA ARG A 37 8.810 -0.606 -6.609 1.00 0.27 C ATOM 566 C ARG A 37 8.246 -2.019 -6.685 1.00 0.25 C ATOM 567 O ARG A 37 7.036 -2.217 -6.585 1.00 0.28 O ATOM 568 CB ARG A 37 9.374 -0.193 -7.969 1.00 0.31 C ATOM 569 CG ARG A 37 9.520 1.311 -8.133 1.00 0.37 C ATOM 570 CD ARG A 37 10.138 1.667 -9.473 1.00 0.43 C ATOM 571 NE ARG A 37 10.388 3.100 -9.598 1.00 0.53 N ATOM 572 CZ ARG A 37 10.640 3.708 -10.753 1.00 0.71 C ATOM 573 NH1 ARG A 37 10.666 3.009 -11.880 1.00 0.94 N ATOM 574 NH2 ARG A 37 10.866 5.013 -10.781 1.00 0.79 N ATOM 0 H ARG A 37 10.778 -0.359 -5.928 1.00 0.23 H new ATOM 0 HA ARG A 37 8.007 0.083 -6.345 1.00 0.27 H new ATOM 0 HB2 ARG A 37 10.348 -0.662 -8.107 1.00 0.31 H new ATOM 0 HB3 ARG A 37 8.722 -0.575 -8.755 1.00 0.31 H new ATOM 0 HG2 ARG A 37 8.542 1.784 -8.045 1.00 0.37 H new ATOM 0 HG3 ARG A 37 10.140 1.707 -7.329 1.00 0.37 H new ATOM 0 HD2 ARG A 37 11.075 1.124 -9.596 1.00 0.43 H new ATOM 0 HD3 ARG A 37 9.475 1.344 -10.275 1.00 0.43 H new ATOM 0 HE ARG A 37 10.368 3.667 -8.750 1.00 0.53 H new ATOM 0 HH11 ARG A 37 10.493 2.004 -11.861 1.00 0.94 H new ATOM 0 HH12 ARG A 37 10.859 3.476 -12.766 1.00 0.94 H new ATOM 0 HH21 ARG A 37 10.847 5.553 -9.916 1.00 0.79 H new ATOM 0 HH22 ARG A 37 11.059 5.478 -11.668 1.00 0.79 H new ATOM 588 N THR A 38 9.126 -3.003 -6.885 1.00 0.24 N ATOM 589 CA THR A 38 8.701 -4.397 -6.944 1.00 0.29 C ATOM 590 C THR A 38 8.086 -4.817 -5.610 1.00 0.26 C ATOM 591 O THR A 38 7.419 -5.846 -5.512 1.00 0.32 O ATOM 592 CB THR A 38 9.870 -5.342 -7.314 1.00 0.38 C ATOM 593 OG1 THR A 38 9.354 -6.558 -7.865 1.00 1.07 O ATOM 594 CG2 THR A 38 10.743 -5.670 -6.113 1.00 0.67 C ATOM 0 H THR A 38 10.128 -2.859 -7.008 1.00 0.24 H new ATOM 0 HA THR A 38 7.950 -4.479 -7.730 1.00 0.29 H new ATOM 0 HB THR A 38 10.487 -4.824 -8.048 1.00 0.38 H new ATOM 0 HG1 THR A 38 10.097 -7.152 -8.099 1.00 1.07 H new ATOM 0 HG21 THR A 38 11.550 -6.335 -6.420 1.00 0.67 H new ATOM 0 HG22 THR A 38 11.166 -4.750 -5.708 1.00 0.67 H new ATOM 0 HG23 THR A 38 10.140 -6.160 -5.348 1.00 0.67 H new ATOM 602 N LEU A 39 8.324 -3.997 -4.586 1.00 0.21 N ATOM 603 CA LEU A 39 7.785 -4.238 -3.250 1.00 0.26 C ATOM 604 C LEU A 39 6.353 -3.720 -3.149 1.00 0.33 C ATOM 605 O LEU A 39 5.687 -3.901 -2.129 1.00 0.83 O ATOM 606 CB LEU A 39 8.657 -3.570 -2.178 1.00 0.24 C ATOM 607 CG LEU A 39 9.750 -4.441 -1.548 1.00 0.25 C ATOM 608 CD1 LEU A 39 10.572 -5.172 -2.596 1.00 0.29 C ATOM 609 CD2 LEU A 39 10.645 -3.579 -0.673 1.00 0.41 C ATOM 0 H LEU A 39 8.892 -3.153 -4.659 1.00 0.21 H new ATOM 0 HA LEU A 39 7.786 -5.314 -3.078 1.00 0.26 H new ATOM 0 HB2 LEU A 39 9.131 -2.694 -2.621 1.00 0.24 H new ATOM 0 HB3 LEU A 39 8.005 -3.211 -1.382 1.00 0.24 H new ATOM 0 HG LEU A 39 9.265 -5.202 -0.937 1.00 0.25 H new ATOM 0 HD11 LEU A 39 11.334 -5.777 -2.104 1.00 0.29 H new ATOM 0 HD12 LEU A 39 9.920 -5.818 -3.184 1.00 0.29 H new ATOM 0 HD13 LEU A 39 11.052 -4.447 -3.253 1.00 0.29 H new ATOM 0 HD21 LEU A 39 11.422 -4.199 -0.225 1.00 0.41 H new ATOM 0 HD22 LEU A 39 11.107 -2.801 -1.280 1.00 0.41 H new ATOM 0 HD23 LEU A 39 10.049 -3.119 0.115 1.00 0.41 H new ATOM 621 N GLY A 40 5.887 -3.079 -4.217 1.00 0.48 N ATOM 622 CA GLY A 40 4.530 -2.556 -4.244 1.00 0.54 C ATOM 623 C GLY A 40 4.407 -1.096 -3.838 1.00 0.44 C ATOM 624 O GLY A 40 3.306 -0.625 -3.549 1.00 0.56 O ATOM 0 H GLY A 40 6.426 -2.912 -5.067 1.00 0.48 H new ATOM 0 HA2 GLY A 40 4.129 -2.675 -5.250 1.00 0.54 H new ATOM 0 HA3 GLY A 40 3.909 -3.158 -3.580 1.00 0.54 H new ATOM 628 N GLN A 41 5.524 -0.374 -3.814 1.00 0.41 N ATOM 629 CA GLN A 41 5.507 1.045 -3.454 1.00 0.37 C ATOM 630 C GLN A 41 6.520 1.829 -4.283 1.00 0.29 C ATOM 631 O GLN A 41 7.725 1.606 -4.179 1.00 0.35 O ATOM 632 CB GLN A 41 5.806 1.241 -1.963 1.00 0.47 C ATOM 633 CG GLN A 41 5.135 0.222 -1.060 1.00 0.66 C ATOM 634 CD GLN A 41 5.975 -1.025 -0.882 1.00 0.90 C ATOM 635 OE1 GLN A 41 6.806 -1.349 -1.727 1.00 1.79 O ATOM 636 NE2 GLN A 41 5.760 -1.735 0.217 1.00 0.85 N ATOM 0 H GLN A 41 6.448 -0.743 -4.038 1.00 0.41 H new ATOM 0 HA GLN A 41 4.506 1.422 -3.665 1.00 0.37 H new ATOM 0 HB2 GLN A 41 6.884 1.193 -1.810 1.00 0.47 H new ATOM 0 HB3 GLN A 41 5.486 2.240 -1.667 1.00 0.47 H new ATOM 0 HG2 GLN A 41 4.945 0.672 -0.086 1.00 0.66 H new ATOM 0 HG3 GLN A 41 4.167 -0.051 -1.480 1.00 0.66 H new ATOM 0 HE21 GLN A 41 5.060 -1.429 0.893 1.00 0.85 H new ATOM 0 HE22 GLN A 41 6.295 -2.587 0.387 1.00 0.85 H new ATOM 645 N ASN A 42 6.027 2.753 -5.102 1.00 0.34 N ATOM 646 CA ASN A 42 6.900 3.565 -5.940 1.00 0.29 C ATOM 647 C ASN A 42 7.245 4.878 -5.236 1.00 0.31 C ATOM 648 O ASN A 42 6.373 5.720 -5.022 1.00 0.36 O ATOM 649 CB ASN A 42 6.230 3.854 -7.287 1.00 0.34 C ATOM 650 CG ASN A 42 6.137 2.626 -8.175 1.00 0.43 C ATOM 651 OD1 ASN A 42 6.187 2.731 -9.401 1.00 1.03 O ATOM 652 ND2 ASN A 42 5.998 1.454 -7.565 1.00 0.96 N ATOM 0 H ASN A 42 5.033 2.957 -5.203 1.00 0.34 H new ATOM 0 HA ASN A 42 7.820 3.009 -6.117 1.00 0.29 H new ATOM 0 HB2 ASN A 42 5.228 4.247 -7.112 1.00 0.34 H new ATOM 0 HB3 ASN A 42 6.791 4.631 -7.807 1.00 0.34 H new ATOM 0 HD21 ASN A 42 5.928 0.598 -8.115 1.00 0.96 H new ATOM 0 HD22 ASN A 42 5.961 1.410 -6.547 1.00 0.96 H new ATOM 659 N PRO A 43 8.526 5.072 -4.864 1.00 0.30 N ATOM 660 CA PRO A 43 8.979 6.292 -4.183 1.00 0.35 C ATOM 661 C PRO A 43 9.072 7.494 -5.113 1.00 0.34 C ATOM 662 O PRO A 43 9.037 7.355 -6.336 1.00 0.52 O ATOM 663 CB PRO A 43 10.371 5.914 -3.686 1.00 0.40 C ATOM 664 CG PRO A 43 10.847 4.904 -4.668 1.00 0.35 C ATOM 665 CD PRO A 43 9.632 4.109 -5.049 1.00 0.27 C ATOM 0 HA PRO A 43 8.283 6.594 -3.400 1.00 0.35 H new ATOM 0 HB2 PRO A 43 11.031 6.781 -3.654 1.00 0.40 H new ATOM 0 HB3 PRO A 43 10.336 5.503 -2.677 1.00 0.40 H new ATOM 0 HG2 PRO A 43 11.291 5.384 -5.540 1.00 0.35 H new ATOM 0 HG3 PRO A 43 11.614 4.264 -4.232 1.00 0.35 H new ATOM 0 HD2 PRO A 43 9.689 3.755 -6.078 1.00 0.27 H new ATOM 0 HD3 PRO A 43 9.511 3.230 -4.416 1.00 0.27 H new ATOM 673 N THR A 44 9.191 8.677 -4.517 1.00 0.38 N ATOM 674 CA THR A 44 9.305 9.913 -5.278 1.00 0.38 C ATOM 675 C THR A 44 10.752 10.169 -5.681 1.00 0.34 C ATOM 676 O THR A 44 11.670 9.951 -4.892 1.00 0.33 O ATOM 677 CB THR A 44 8.791 11.117 -4.468 1.00 0.43 C ATOM 678 OG1 THR A 44 9.571 11.274 -3.277 1.00 0.43 O ATOM 679 CG2 THR A 44 7.327 10.937 -4.100 1.00 0.53 C ATOM 0 H THR A 44 9.211 8.804 -3.505 1.00 0.38 H new ATOM 0 HA THR A 44 8.692 9.798 -6.172 1.00 0.38 H new ATOM 0 HB THR A 44 8.886 12.010 -5.086 1.00 0.43 H new ATOM 0 HG1 THR A 44 9.239 12.043 -2.768 1.00 0.43 H new ATOM 0 HG21 THR A 44 6.987 11.800 -3.528 1.00 0.53 H new ATOM 0 HG22 THR A 44 6.732 10.846 -5.009 1.00 0.53 H new ATOM 0 HG23 THR A 44 7.211 10.035 -3.499 1.00 0.53 H new ATOM 687 N GLU A 45 10.953 10.625 -6.911 1.00 0.36 N ATOM 688 CA GLU A 45 12.294 10.911 -7.410 1.00 0.37 C ATOM 689 C GLU A 45 13.084 11.754 -6.412 1.00 0.33 C ATOM 690 O GLU A 45 14.286 11.560 -6.232 1.00 0.30 O ATOM 691 CB GLU A 45 12.208 11.641 -8.753 1.00 0.43 C ATOM 692 CG GLU A 45 13.561 11.892 -9.398 1.00 0.48 C ATOM 693 CD GLU A 45 13.454 12.673 -10.693 1.00 0.58 C ATOM 694 OE1 GLU A 45 13.171 12.053 -11.739 1.00 0.66 O ATOM 695 OE2 GLU A 45 13.652 13.906 -10.660 1.00 0.63 O ATOM 0 H GLU A 45 10.206 10.805 -7.582 1.00 0.36 H new ATOM 0 HA GLU A 45 12.815 9.963 -7.545 1.00 0.37 H new ATOM 0 HB2 GLU A 45 11.592 11.056 -9.436 1.00 0.43 H new ATOM 0 HB3 GLU A 45 11.702 12.595 -8.606 1.00 0.43 H new ATOM 0 HG2 GLU A 45 14.196 12.438 -8.700 1.00 0.48 H new ATOM 0 HG3 GLU A 45 14.049 10.937 -9.593 1.00 0.48 H new ATOM 702 N ALA A 46 12.390 12.680 -5.759 1.00 0.35 N ATOM 703 CA ALA A 46 13.010 13.573 -4.785 1.00 0.35 C ATOM 704 C ALA A 46 13.595 12.822 -3.588 1.00 0.32 C ATOM 705 O ALA A 46 14.751 13.032 -3.221 1.00 0.33 O ATOM 706 CB ALA A 46 11.995 14.600 -4.306 1.00 0.40 C ATOM 0 H ALA A 46 11.390 12.833 -5.888 1.00 0.35 H new ATOM 0 HA ALA A 46 13.838 14.072 -5.287 1.00 0.35 H new ATOM 0 HB1 ALA A 46 12.464 15.263 -3.579 1.00 0.40 H new ATOM 0 HB2 ALA A 46 11.640 15.184 -5.155 1.00 0.40 H new ATOM 0 HB3 ALA A 46 11.152 14.089 -3.840 1.00 0.40 H new ATOM 712 N GLU A 47 12.797 11.951 -2.978 1.00 0.30 N ATOM 713 CA GLU A 47 13.256 11.204 -1.812 1.00 0.30 C ATOM 714 C GLU A 47 14.430 10.297 -2.165 1.00 0.26 C ATOM 715 O GLU A 47 15.283 10.015 -1.324 1.00 0.26 O ATOM 716 CB GLU A 47 12.115 10.380 -1.199 1.00 0.33 C ATOM 717 CG GLU A 47 11.729 9.151 -2.005 1.00 0.37 C ATOM 718 CD GLU A 47 10.779 8.239 -1.253 1.00 0.88 C ATOM 719 OE1 GLU A 47 11.264 7.382 -0.486 1.00 1.15 O ATOM 720 OE2 GLU A 47 9.552 8.385 -1.430 1.00 1.43 O ATOM 0 H GLU A 47 11.840 11.747 -3.267 1.00 0.30 H new ATOM 0 HA GLU A 47 13.593 11.930 -1.072 1.00 0.30 H new ATOM 0 HB2 GLU A 47 12.407 10.066 -0.197 1.00 0.33 H new ATOM 0 HB3 GLU A 47 11.239 11.019 -1.090 1.00 0.33 H new ATOM 0 HG2 GLU A 47 11.263 9.465 -2.939 1.00 0.37 H new ATOM 0 HG3 GLU A 47 12.629 8.595 -2.268 1.00 0.37 H new ATOM 727 N LEU A 48 14.471 9.843 -3.411 1.00 0.24 N ATOM 728 CA LEU A 48 15.541 8.969 -3.867 1.00 0.22 C ATOM 729 C LEU A 48 16.893 9.674 -3.834 1.00 0.20 C ATOM 730 O LEU A 48 17.828 9.209 -3.187 1.00 0.19 O ATOM 731 CB LEU A 48 15.253 8.491 -5.291 1.00 0.25 C ATOM 732 CG LEU A 48 13.994 7.640 -5.450 1.00 0.27 C ATOM 733 CD1 LEU A 48 13.654 7.470 -6.921 1.00 0.31 C ATOM 734 CD2 LEU A 48 14.180 6.284 -4.782 1.00 0.29 C ATOM 0 H LEU A 48 13.775 10.066 -4.123 1.00 0.24 H new ATOM 0 HA LEU A 48 15.583 8.116 -3.190 1.00 0.22 H new ATOM 0 HB2 LEU A 48 15.167 9.363 -5.939 1.00 0.25 H new ATOM 0 HB3 LEU A 48 16.108 7.915 -5.644 1.00 0.25 H new ATOM 0 HG LEU A 48 13.165 8.151 -4.961 1.00 0.27 H new ATOM 0 HD11 LEU A 48 12.755 6.862 -7.019 1.00 0.31 H new ATOM 0 HD12 LEU A 48 13.481 8.448 -7.370 1.00 0.31 H new ATOM 0 HD13 LEU A 48 14.482 6.978 -7.431 1.00 0.31 H new ATOM 0 HD21 LEU A 48 13.274 5.691 -4.905 1.00 0.29 H new ATOM 0 HD22 LEU A 48 15.020 5.764 -5.243 1.00 0.29 H new ATOM 0 HD23 LEU A 48 14.380 6.426 -3.720 1.00 0.29 H new ATOM 746 N GLN A 49 16.986 10.806 -4.524 1.00 0.23 N ATOM 747 CA GLN A 49 18.235 11.557 -4.594 1.00 0.25 C ATOM 748 C GLN A 49 18.747 11.975 -3.217 1.00 0.25 C ATOM 749 O GLN A 49 19.956 11.971 -2.981 1.00 0.26 O ATOM 750 CB GLN A 49 18.064 12.786 -5.488 1.00 0.31 C ATOM 751 CG GLN A 49 17.143 13.847 -4.912 1.00 0.36 C ATOM 752 CD GLN A 49 16.180 14.403 -5.944 1.00 0.36 C ATOM 753 OE1 GLN A 49 15.775 15.563 -5.871 1.00 0.40 O ATOM 754 NE2 GLN A 49 15.807 13.572 -6.912 1.00 0.33 N ATOM 0 H GLN A 49 16.213 11.223 -5.042 1.00 0.23 H new ATOM 0 HA GLN A 49 18.983 10.892 -5.025 1.00 0.25 H new ATOM 0 HB2 GLN A 49 19.043 13.229 -5.669 1.00 0.31 H new ATOM 0 HB3 GLN A 49 17.674 12.468 -6.455 1.00 0.31 H new ATOM 0 HG2 GLN A 49 16.577 13.421 -4.084 1.00 0.36 H new ATOM 0 HG3 GLN A 49 17.742 14.661 -4.503 1.00 0.36 H new ATOM 0 HE21 GLN A 49 16.168 12.618 -6.933 1.00 0.33 H new ATOM 0 HE22 GLN A 49 15.159 13.888 -7.634 1.00 0.33 H new ATOM 763 N ASP A 50 17.844 12.337 -2.308 1.00 0.25 N ATOM 764 CA ASP A 50 18.265 12.761 -0.973 1.00 0.29 C ATOM 765 C ASP A 50 18.930 11.611 -0.217 1.00 0.27 C ATOM 766 O ASP A 50 20.030 11.767 0.309 1.00 0.30 O ATOM 767 CB ASP A 50 17.087 13.336 -0.170 1.00 0.33 C ATOM 768 CG ASP A 50 16.350 12.298 0.656 1.00 0.33 C ATOM 769 OD1 ASP A 50 16.903 11.852 1.684 1.00 0.35 O ATOM 770 OD2 ASP A 50 15.213 11.945 0.288 1.00 0.33 O ATOM 0 H ASP A 50 16.836 12.346 -2.465 1.00 0.25 H new ATOM 0 HA ASP A 50 19.001 13.555 -1.097 1.00 0.29 H new ATOM 0 HB2 ASP A 50 17.457 14.119 0.492 1.00 0.33 H new ATOM 0 HB3 ASP A 50 16.384 13.806 -0.858 1.00 0.33 H new ATOM 775 N LEU A 51 18.263 10.456 -0.167 1.00 0.25 N ATOM 776 CA LEU A 51 18.809 9.294 0.527 1.00 0.27 C ATOM 777 C LEU A 51 20.037 8.752 -0.195 1.00 0.24 C ATOM 778 O LEU A 51 20.877 8.082 0.405 1.00 0.27 O ATOM 779 CB LEU A 51 17.742 8.201 0.674 1.00 0.30 C ATOM 780 CG LEU A 51 17.136 7.679 -0.630 1.00 0.29 C ATOM 781 CD1 LEU A 51 18.037 6.626 -1.254 1.00 0.30 C ATOM 782 CD2 LEU A 51 15.748 7.112 -0.377 1.00 0.35 C ATOM 0 H LEU A 51 17.350 10.303 -0.596 1.00 0.25 H new ATOM 0 HA LEU A 51 19.117 9.611 1.523 1.00 0.27 H new ATOM 0 HB2 LEU A 51 18.183 7.360 1.210 1.00 0.30 H new ATOM 0 HB3 LEU A 51 16.936 8.589 1.297 1.00 0.30 H new ATOM 0 HG LEU A 51 17.049 8.511 -1.329 1.00 0.29 H new ATOM 0 HD11 LEU A 51 17.589 6.267 -2.181 1.00 0.30 H new ATOM 0 HD12 LEU A 51 19.013 7.062 -1.468 1.00 0.30 H new ATOM 0 HD13 LEU A 51 18.156 5.793 -0.562 1.00 0.30 H new ATOM 0 HD21 LEU A 51 15.329 6.744 -1.314 1.00 0.35 H new ATOM 0 HD22 LEU A 51 15.815 6.292 0.338 1.00 0.35 H new ATOM 0 HD23 LEU A 51 15.104 7.893 0.027 1.00 0.35 H new ATOM 794 N ILE A 52 20.134 9.044 -1.490 1.00 0.20 N ATOM 795 CA ILE A 52 21.267 8.594 -2.289 1.00 0.21 C ATOM 796 C ILE A 52 22.526 9.379 -1.928 1.00 0.25 C ATOM 797 O ILE A 52 23.547 8.798 -1.561 1.00 0.29 O ATOM 798 CB ILE A 52 20.981 8.727 -3.804 1.00 0.23 C ATOM 799 CG1 ILE A 52 20.011 7.633 -4.256 1.00 0.25 C ATOM 800 CG2 ILE A 52 22.274 8.658 -4.609 1.00 0.28 C ATOM 801 CD1 ILE A 52 19.494 7.823 -5.666 1.00 0.31 C ATOM 0 H ILE A 52 19.443 9.589 -2.006 1.00 0.20 H new ATOM 0 HA ILE A 52 21.427 7.540 -2.063 1.00 0.21 H new ATOM 0 HB ILE A 52 20.522 9.699 -3.983 1.00 0.23 H new ATOM 0 HG12 ILE A 52 20.510 6.666 -4.189 1.00 0.25 H new ATOM 0 HG13 ILE A 52 19.165 7.603 -3.569 1.00 0.25 H new ATOM 0 HG21 ILE A 52 22.047 8.754 -5.671 1.00 0.28 H new ATOM 0 HG22 ILE A 52 22.936 9.469 -4.305 1.00 0.28 H new ATOM 0 HG23 ILE A 52 22.765 7.702 -4.428 1.00 0.28 H new ATOM 0 HD11 ILE A 52 18.813 7.010 -5.916 1.00 0.31 H new ATOM 0 HD12 ILE A 52 18.965 8.774 -5.735 1.00 0.31 H new ATOM 0 HD13 ILE A 52 20.331 7.822 -6.364 1.00 0.31 H new ATOM 813 N ALA A 53 22.440 10.701 -2.030 1.00 0.29 N ATOM 814 CA ALA A 53 23.567 11.570 -1.710 1.00 0.36 C ATOM 815 C ALA A 53 23.962 11.393 -0.253 1.00 0.38 C ATOM 816 O ALA A 53 25.142 11.321 0.090 1.00 0.45 O ATOM 817 CB ALA A 53 23.206 13.021 -1.986 1.00 0.40 C ATOM 0 H ALA A 53 21.600 11.195 -2.332 1.00 0.29 H new ATOM 0 HA ALA A 53 24.414 11.297 -2.340 1.00 0.36 H new ATOM 0 HB1 ALA A 53 24.055 13.660 -1.743 1.00 0.40 H new ATOM 0 HB2 ALA A 53 22.953 13.139 -3.040 1.00 0.40 H new ATOM 0 HB3 ALA A 53 22.351 13.306 -1.373 1.00 0.40 H new ATOM 823 N GLU A 54 22.942 11.329 0.593 1.00 0.40 N ATOM 824 CA GLU A 54 23.121 11.148 2.023 1.00 0.47 C ATOM 825 C GLU A 54 23.917 9.880 2.331 1.00 0.40 C ATOM 826 O GLU A 54 24.911 9.925 3.057 1.00 0.45 O ATOM 827 CB GLU A 54 21.745 11.108 2.693 1.00 0.59 C ATOM 828 CG GLU A 54 21.673 10.208 3.908 1.00 0.69 C ATOM 829 CD GLU A 54 20.470 10.500 4.783 1.00 1.02 C ATOM 830 OE1 GLU A 54 19.397 9.910 4.532 1.00 1.47 O ATOM 831 OE2 GLU A 54 20.600 11.318 5.718 1.00 1.27 O ATOM 0 H GLU A 54 21.967 11.402 0.304 1.00 0.40 H new ATOM 0 HA GLU A 54 23.695 11.986 2.419 1.00 0.47 H new ATOM 0 HB2 GLU A 54 21.467 12.120 2.987 1.00 0.59 H new ATOM 0 HB3 GLU A 54 21.007 10.774 1.963 1.00 0.59 H new ATOM 0 HG2 GLU A 54 21.637 9.168 3.583 1.00 0.69 H new ATOM 0 HG3 GLU A 54 22.583 10.326 4.497 1.00 0.69 H new ATOM 838 N ALA A 55 23.475 8.754 1.780 1.00 0.33 N ATOM 839 CA ALA A 55 24.154 7.481 2.003 1.00 0.31 C ATOM 840 C ALA A 55 25.583 7.521 1.468 1.00 0.33 C ATOM 841 O ALA A 55 26.480 6.887 2.022 1.00 0.41 O ATOM 842 CB ALA A 55 23.374 6.345 1.357 1.00 0.37 C ATOM 0 H ALA A 55 22.653 8.696 1.178 1.00 0.33 H new ATOM 0 HA ALA A 55 24.202 7.305 3.078 1.00 0.31 H new ATOM 0 HB1 ALA A 55 23.892 5.402 1.532 1.00 0.37 H new ATOM 0 HB2 ALA A 55 22.376 6.296 1.792 1.00 0.37 H new ATOM 0 HB3 ALA A 55 23.295 6.522 0.284 1.00 0.37 H new ATOM 848 N GLU A 56 25.785 8.270 0.387 1.00 0.34 N ATOM 849 CA GLU A 56 27.106 8.395 -0.223 1.00 0.44 C ATOM 850 C GLU A 56 28.064 9.162 0.684 1.00 0.52 C ATOM 851 O GLU A 56 29.277 9.148 0.472 1.00 0.65 O ATOM 852 CB GLU A 56 27.000 9.098 -1.579 1.00 0.50 C ATOM 853 CG GLU A 56 26.393 8.231 -2.668 1.00 0.61 C ATOM 854 CD GLU A 56 26.279 8.955 -3.995 1.00 1.09 C ATOM 855 OE1 GLU A 56 25.240 9.609 -4.227 1.00 1.88 O ATOM 856 OE2 GLU A 56 27.227 8.868 -4.803 1.00 1.31 O ATOM 0 H GLU A 56 25.051 8.799 -0.084 1.00 0.34 H new ATOM 0 HA GLU A 56 27.503 7.390 -0.368 1.00 0.44 H new ATOM 0 HB2 GLU A 56 26.397 9.999 -1.465 1.00 0.50 H new ATOM 0 HB3 GLU A 56 27.994 9.417 -1.892 1.00 0.50 H new ATOM 0 HG2 GLU A 56 27.003 7.337 -2.798 1.00 0.61 H new ATOM 0 HG3 GLU A 56 25.404 7.899 -2.353 1.00 0.61 H new ATOM 863 N ASN A 57 27.515 9.831 1.692 1.00 0.54 N ATOM 864 CA ASN A 57 28.327 10.606 2.625 1.00 0.68 C ATOM 865 C ASN A 57 28.927 9.709 3.703 1.00 0.70 C ATOM 866 O ASN A 57 30.141 9.506 3.748 1.00 0.98 O ATOM 867 CB ASN A 57 27.488 11.710 3.271 1.00 0.79 C ATOM 868 CG ASN A 57 28.299 12.564 4.226 1.00 0.96 C ATOM 869 OD1 ASN A 57 28.887 13.570 3.830 1.00 1.37 O ATOM 870 ND2 ASN A 57 28.333 12.167 5.493 1.00 1.66 N ATOM 0 H ASN A 57 26.514 9.853 1.884 1.00 0.54 H new ATOM 0 HA ASN A 57 29.143 11.062 2.063 1.00 0.68 H new ATOM 0 HB2 ASN A 57 27.063 12.343 2.492 1.00 0.79 H new ATOM 0 HB3 ASN A 57 26.653 11.261 3.808 1.00 0.79 H new ATOM 0 HD21 ASN A 57 28.862 12.703 6.181 1.00 1.66 H new ATOM 0 HD22 ASN A 57 27.830 11.326 5.778 1.00 1.66 H new ATOM 877 N ASN A 58 28.072 9.177 4.570 1.00 0.64 N ATOM 878 CA ASN A 58 28.522 8.302 5.647 1.00 0.70 C ATOM 879 C ASN A 58 29.072 6.991 5.093 1.00 0.63 C ATOM 880 O ASN A 58 30.035 6.438 5.624 1.00 0.89 O ATOM 881 CB ASN A 58 27.376 8.022 6.621 1.00 0.79 C ATOM 882 CG ASN A 58 26.113 7.570 5.914 1.00 1.13 C ATOM 883 OD1 ASN A 58 25.902 6.377 5.699 1.00 2.14 O ATOM 884 ND2 ASN A 58 25.266 8.525 5.550 1.00 1.12 N ATOM 0 H ASN A 58 27.065 9.336 4.548 1.00 0.64 H new ATOM 0 HA ASN A 58 29.324 8.811 6.182 1.00 0.70 H new ATOM 0 HB2 ASN A 58 27.686 7.255 7.331 1.00 0.79 H new ATOM 0 HB3 ASN A 58 27.164 8.923 7.197 1.00 0.79 H new ATOM 0 HD21 ASN A 58 24.399 8.282 5.071 1.00 1.12 H new ATOM 0 HD22 ASN A 58 25.482 9.502 5.749 1.00 1.12 H new ATOM 891 N ASN A 59 28.455 6.499 4.022 1.00 0.54 N ATOM 892 CA ASN A 59 28.888 5.255 3.396 1.00 0.72 C ATOM 893 C ASN A 59 29.507 5.523 2.028 1.00 0.82 C ATOM 894 O ASN A 59 29.546 6.665 1.570 1.00 1.69 O ATOM 895 CB ASN A 59 27.708 4.291 3.252 1.00 0.81 C ATOM 896 CG ASN A 59 27.058 3.968 4.583 1.00 0.88 C ATOM 897 OD1 ASN A 59 27.713 3.975 5.625 1.00 1.09 O ATOM 898 ND2 ASN A 59 25.760 3.684 4.555 1.00 0.93 N ATOM 0 H ASN A 59 27.655 6.943 3.571 1.00 0.54 H new ATOM 0 HA ASN A 59 29.643 4.800 4.037 1.00 0.72 H new ATOM 0 HB2 ASN A 59 26.965 4.728 2.585 1.00 0.81 H new ATOM 0 HB3 ASN A 59 28.052 3.368 2.785 1.00 0.81 H new ATOM 0 HD21 ASN A 59 25.268 3.460 5.420 1.00 0.93 H new ATOM 0 HD22 ASN A 59 25.256 3.690 3.668 1.00 0.93 H new ATOM 905 N ASN A 60 29.988 4.468 1.380 1.00 0.78 N ATOM 906 CA ASN A 60 30.603 4.597 0.064 1.00 0.73 C ATOM 907 C ASN A 60 29.569 5.005 -0.981 1.00 0.61 C ATOM 908 O ASN A 60 29.752 5.990 -1.697 1.00 0.68 O ATOM 909 CB ASN A 60 31.271 3.283 -0.344 1.00 0.76 C ATOM 910 CG ASN A 60 32.462 2.942 0.531 1.00 1.00 C ATOM 911 OD1 ASN A 60 33.148 3.830 1.039 1.00 1.32 O ATOM 912 ND2 ASN A 60 32.714 1.652 0.713 1.00 1.74 N ATOM 0 H ASN A 60 29.964 3.515 1.744 1.00 0.78 H new ATOM 0 HA ASN A 60 31.363 5.377 0.121 1.00 0.73 H new ATOM 0 HB2 ASN A 60 30.541 2.475 -0.289 1.00 0.76 H new ATOM 0 HB3 ASN A 60 31.595 3.351 -1.383 1.00 0.76 H new ATOM 0 HD21 ASN A 60 33.502 1.363 1.293 1.00 1.74 H new ATOM 0 HD22 ASN A 60 32.120 0.949 0.273 1.00 1.74 H new ATOM 919 N GLY A 61 28.482 4.244 -1.062 1.00 0.53 N ATOM 920 CA GLY A 61 27.436 4.542 -2.023 1.00 0.47 C ATOM 921 C GLY A 61 26.387 3.451 -2.088 1.00 0.41 C ATOM 922 O GLY A 61 25.657 3.338 -3.073 1.00 0.56 O ATOM 0 H GLY A 61 28.307 3.426 -0.479 1.00 0.53 H new ATOM 0 HA2 GLY A 61 26.960 5.486 -1.757 1.00 0.47 H new ATOM 0 HA3 GLY A 61 27.880 4.676 -3.010 1.00 0.47 H new ATOM 926 N GLN A 62 26.315 2.645 -1.034 1.00 0.28 N ATOM 927 CA GLN A 62 25.351 1.555 -0.966 1.00 0.22 C ATOM 928 C GLN A 62 24.722 1.463 0.419 1.00 0.19 C ATOM 929 O GLN A 62 25.309 1.898 1.411 1.00 0.22 O ATOM 930 CB GLN A 62 26.022 0.230 -1.329 1.00 0.22 C ATOM 931 CG GLN A 62 27.448 0.122 -0.853 1.00 0.31 C ATOM 932 CD GLN A 62 28.025 -1.272 -1.015 1.00 1.15 C ATOM 933 OE1 GLN A 62 28.895 -1.687 -0.250 1.00 1.44 O ATOM 934 NE2 GLN A 62 27.539 -2.005 -2.012 1.00 1.87 N ATOM 0 H GLN A 62 26.915 2.727 -0.213 1.00 0.28 H new ATOM 0 HA GLN A 62 24.559 1.761 -1.686 1.00 0.22 H new ATOM 0 HB2 GLN A 62 25.443 -0.589 -0.902 1.00 0.22 H new ATOM 0 HB3 GLN A 62 25.999 0.106 -2.412 1.00 0.22 H new ATOM 0 HG2 GLN A 62 28.064 0.831 -1.406 1.00 0.31 H new ATOM 0 HG3 GLN A 62 27.497 0.409 0.197 1.00 0.31 H new ATOM 0 HE21 GLN A 62 26.818 -1.621 -2.623 1.00 1.87 H new ATOM 0 HE22 GLN A 62 27.887 -2.951 -2.166 1.00 1.87 H new ATOM 943 N LEU A 63 23.523 0.892 0.477 1.00 0.19 N ATOM 944 CA LEU A 63 22.800 0.743 1.733 1.00 0.19 C ATOM 945 C LEU A 63 22.686 -0.724 2.132 1.00 0.18 C ATOM 946 O LEU A 63 22.715 -1.614 1.283 1.00 0.19 O ATOM 947 CB LEU A 63 21.407 1.373 1.622 1.00 0.23 C ATOM 948 CG LEU A 63 20.617 1.020 0.359 1.00 0.25 C ATOM 949 CD1 LEU A 63 19.982 -0.356 0.485 1.00 0.28 C ATOM 950 CD2 LEU A 63 19.554 2.072 0.091 1.00 0.39 C ATOM 0 H LEU A 63 23.030 0.523 -0.337 1.00 0.19 H new ATOM 0 HA LEU A 63 23.362 1.261 2.510 1.00 0.19 H new ATOM 0 HB2 LEU A 63 20.822 1.071 2.491 1.00 0.23 H new ATOM 0 HB3 LEU A 63 21.514 2.457 1.671 1.00 0.23 H new ATOM 0 HG LEU A 63 21.309 0.999 -0.483 1.00 0.25 H new ATOM 0 HD11 LEU A 63 19.426 -0.585 -0.424 1.00 0.28 H new ATOM 0 HD12 LEU A 63 20.761 -1.104 0.632 1.00 0.28 H new ATOM 0 HD13 LEU A 63 19.303 -0.367 1.338 1.00 0.28 H new ATOM 0 HD21 LEU A 63 19.000 1.808 -0.810 1.00 0.39 H new ATOM 0 HD22 LEU A 63 18.869 2.121 0.937 1.00 0.39 H new ATOM 0 HD23 LEU A 63 20.030 3.043 -0.047 1.00 0.39 H new ATOM 962 N ASN A 64 22.538 -0.958 3.433 1.00 0.18 N ATOM 963 CA ASN A 64 22.423 -2.309 3.977 1.00 0.18 C ATOM 964 C ASN A 64 20.960 -2.723 4.097 1.00 0.17 C ATOM 965 O ASN A 64 20.069 -1.878 4.172 1.00 0.17 O ATOM 966 CB ASN A 64 23.103 -2.400 5.345 1.00 0.20 C ATOM 967 CG ASN A 64 24.516 -1.855 5.329 1.00 0.26 C ATOM 968 OD1 ASN A 64 25.473 -2.586 5.076 1.00 0.74 O ATOM 969 ND2 ASN A 64 24.655 -0.563 5.602 1.00 0.61 N ATOM 0 H ASN A 64 22.495 -0.221 4.137 1.00 0.18 H new ATOM 0 HA ASN A 64 22.923 -2.990 3.289 1.00 0.18 H new ATOM 0 HB2 ASN A 64 22.513 -1.849 6.077 1.00 0.20 H new ATOM 0 HB3 ASN A 64 23.122 -3.441 5.669 1.00 0.20 H new ATOM 0 HD21 ASN A 64 25.583 -0.140 5.607 1.00 0.61 H new ATOM 0 HD22 ASN A 64 23.834 0.006 5.806 1.00 0.61 H new ATOM 976 N PHE A 65 20.723 -4.031 4.107 1.00 0.17 N ATOM 977 CA PHE A 65 19.369 -4.569 4.199 1.00 0.17 C ATOM 978 C PHE A 65 18.582 -3.979 5.369 1.00 0.19 C ATOM 979 O PHE A 65 17.364 -3.846 5.286 1.00 0.18 O ATOM 980 CB PHE A 65 19.406 -6.095 4.322 1.00 0.19 C ATOM 981 CG PHE A 65 18.037 -6.709 4.410 1.00 0.18 C ATOM 982 CD1 PHE A 65 17.303 -6.966 3.263 1.00 0.20 C ATOM 983 CD2 PHE A 65 17.476 -7.012 5.642 1.00 0.19 C ATOM 984 CE1 PHE A 65 16.040 -7.516 3.343 1.00 0.21 C ATOM 985 CE2 PHE A 65 16.210 -7.560 5.726 1.00 0.19 C ATOM 986 CZ PHE A 65 15.491 -7.811 4.575 1.00 0.19 C ATOM 0 H PHE A 65 21.454 -4.741 4.052 1.00 0.17 H new ATOM 0 HA PHE A 65 18.856 -4.285 3.280 1.00 0.17 H new ATOM 0 HB2 PHE A 65 19.930 -6.511 3.462 1.00 0.19 H new ATOM 0 HB3 PHE A 65 19.979 -6.369 5.208 1.00 0.19 H new ATOM 0 HD1 PHE A 65 17.724 -6.733 2.296 1.00 0.20 H new ATOM 0 HD2 PHE A 65 18.035 -6.818 6.546 1.00 0.19 H new ATOM 0 HE1 PHE A 65 15.480 -7.716 2.441 1.00 0.21 H new ATOM 0 HE2 PHE A 65 15.784 -7.791 6.691 1.00 0.19 H new ATOM 0 HZ PHE A 65 14.501 -8.237 4.638 1.00 0.19 H new ATOM 996 N THR A 66 19.263 -3.631 6.459 1.00 0.23 N ATOM 997 CA THR A 66 18.571 -3.078 7.624 1.00 0.25 C ATOM 998 C THR A 66 17.950 -1.720 7.329 1.00 0.24 C ATOM 999 O THR A 66 16.754 -1.524 7.535 1.00 0.24 O ATOM 1000 CB THR A 66 19.492 -2.934 8.846 1.00 0.30 C ATOM 1001 OG1 THR A 66 20.063 -4.204 9.187 1.00 0.33 O ATOM 1002 CG2 THR A 66 18.705 -2.385 10.032 1.00 0.32 C ATOM 0 H THR A 66 20.274 -3.719 6.561 1.00 0.23 H new ATOM 0 HA THR A 66 17.785 -3.797 7.854 1.00 0.25 H new ATOM 0 HB THR A 66 20.295 -2.240 8.599 1.00 0.30 H new ATOM 0 HG1 THR A 66 20.649 -4.101 9.966 1.00 0.33 H new ATOM 0 HG21 THR A 66 19.366 -2.286 10.893 1.00 0.32 H new ATOM 0 HG22 THR A 66 18.295 -1.408 9.776 1.00 0.32 H new ATOM 0 HG23 THR A 66 17.891 -3.068 10.276 1.00 0.32 H new ATOM 1010 N GLU A 67 18.759 -0.775 6.861 1.00 0.25 N ATOM 1011 CA GLU A 67 18.242 0.553 6.566 1.00 0.26 C ATOM 1012 C GLU A 67 17.151 0.474 5.508 1.00 0.23 C ATOM 1013 O GLU A 67 16.123 1.141 5.621 1.00 0.23 O ATOM 1014 CB GLU A 67 19.362 1.507 6.138 1.00 0.29 C ATOM 1015 CG GLU A 67 20.271 0.967 5.048 1.00 0.27 C ATOM 1016 CD GLU A 67 21.468 1.864 4.803 1.00 0.45 C ATOM 1017 OE1 GLU A 67 21.288 2.942 4.201 1.00 0.66 O ATOM 1018 OE2 GLU A 67 22.586 1.486 5.211 1.00 0.61 O ATOM 0 H GLU A 67 19.755 -0.901 6.681 1.00 0.25 H new ATOM 0 HA GLU A 67 17.805 0.957 7.479 1.00 0.26 H new ATOM 0 HB2 GLU A 67 18.915 2.439 5.791 1.00 0.29 H new ATOM 0 HB3 GLU A 67 19.968 1.750 7.011 1.00 0.29 H new ATOM 0 HG2 GLU A 67 20.616 -0.029 5.326 1.00 0.27 H new ATOM 0 HG3 GLU A 67 19.703 0.861 4.123 1.00 0.27 H new ATOM 1025 N PHE A 68 17.369 -0.342 4.478 1.00 0.22 N ATOM 1026 CA PHE A 68 16.372 -0.502 3.429 1.00 0.20 C ATOM 1027 C PHE A 68 15.075 -1.069 3.992 1.00 0.18 C ATOM 1028 O PHE A 68 14.006 -0.489 3.818 1.00 0.19 O ATOM 1029 CB PHE A 68 16.874 -1.430 2.323 1.00 0.19 C ATOM 1030 CG PHE A 68 15.792 -1.776 1.338 1.00 0.18 C ATOM 1031 CD1 PHE A 68 15.038 -0.789 0.723 1.00 0.25 C ATOM 1032 CD2 PHE A 68 15.549 -3.100 1.013 1.00 0.17 C ATOM 1033 CE1 PHE A 68 14.060 -1.122 -0.195 1.00 0.27 C ATOM 1034 CE2 PHE A 68 14.574 -3.438 0.101 1.00 0.18 C ATOM 1035 CZ PHE A 68 13.763 -2.380 -0.455 1.00 0.23 C ATOM 0 H PHE A 68 18.217 -0.895 4.351 1.00 0.22 H new ATOM 0 HA PHE A 68 16.188 0.488 3.012 1.00 0.20 H new ATOM 0 HB2 PHE A 68 17.702 -0.953 1.798 1.00 0.19 H new ATOM 0 HB3 PHE A 68 17.264 -2.345 2.768 1.00 0.19 H new ATOM 0 HD1 PHE A 68 15.216 0.249 0.963 1.00 0.25 H new ATOM 0 HD2 PHE A 68 16.133 -3.879 1.481 1.00 0.17 H new ATOM 0 HE1 PHE A 68 13.528 -0.336 -0.710 1.00 0.27 H new ATOM 0 HE2 PHE A 68 14.420 -4.466 -0.191 1.00 0.18 H new ATOM 0 HZ PHE A 68 12.916 -2.619 -1.082 1.00 0.23 H new ATOM 1045 N CYS A 69 15.176 -2.225 4.642 1.00 0.18 N ATOM 1046 CA CYS A 69 14.012 -2.874 5.236 1.00 0.19 C ATOM 1047 C CYS A 69 13.252 -1.880 6.098 1.00 0.20 C ATOM 1048 O CYS A 69 12.021 -1.896 6.153 1.00 0.20 O ATOM 1049 CB CYS A 69 14.429 -4.092 6.068 1.00 0.21 C ATOM 1050 SG CYS A 69 14.954 -3.708 7.755 1.00 0.26 S ATOM 0 H CYS A 69 16.052 -2.731 4.771 1.00 0.18 H new ATOM 0 HA CYS A 69 13.362 -3.222 4.433 1.00 0.19 H new ATOM 0 HB2 CYS A 69 13.592 -4.789 6.112 1.00 0.21 H new ATOM 0 HB3 CYS A 69 15.244 -4.604 5.556 1.00 0.21 H new ATOM 0 HG CYS A 69 15.686 -2.634 7.748 1.00 0.26 H new ATOM 1056 N GLY A 70 14.001 -1.014 6.770 1.00 0.22 N ATOM 1057 CA GLY A 70 13.393 0.000 7.600 1.00 0.25 C ATOM 1058 C GLY A 70 12.619 0.993 6.757 1.00 0.25 C ATOM 1059 O GLY A 70 11.582 1.513 7.171 1.00 0.27 O ATOM 0 H GLY A 70 15.021 -0.999 6.753 1.00 0.22 H new ATOM 0 HA2 GLY A 70 12.725 -0.468 8.323 1.00 0.25 H new ATOM 0 HA3 GLY A 70 14.163 0.521 8.168 1.00 0.25 H new ATOM 1063 N ILE A 71 13.142 1.244 5.559 1.00 0.25 N ATOM 1064 CA ILE A 71 12.537 2.174 4.613 1.00 0.27 C ATOM 1065 C ILE A 71 11.264 1.624 3.995 1.00 0.26 C ATOM 1066 O ILE A 71 10.213 2.245 4.090 1.00 0.29 O ATOM 1067 CB ILE A 71 13.524 2.532 3.491 1.00 0.28 C ATOM 1068 CG1 ILE A 71 14.605 3.441 4.064 1.00 0.30 C ATOM 1069 CG2 ILE A 71 12.803 3.200 2.324 1.00 0.30 C ATOM 1070 CD1 ILE A 71 15.619 3.916 3.042 1.00 0.33 C ATOM 0 H ILE A 71 13.998 0.807 5.218 1.00 0.25 H new ATOM 0 HA ILE A 71 12.282 3.068 5.182 1.00 0.27 H new ATOM 0 HB ILE A 71 13.984 1.623 3.104 1.00 0.28 H new ATOM 0 HG12 ILE A 71 14.130 4.310 4.520 1.00 0.30 H new ATOM 0 HG13 ILE A 71 15.128 2.910 4.859 1.00 0.30 H new ATOM 0 HG21 ILE A 71 13.523 3.444 1.543 1.00 0.30 H new ATOM 0 HG22 ILE A 71 12.050 2.520 1.924 1.00 0.30 H new ATOM 0 HG23 ILE A 71 12.320 4.114 2.670 1.00 0.30 H new ATOM 0 HD11 ILE A 71 16.354 4.557 3.529 1.00 0.33 H new ATOM 0 HD12 ILE A 71 16.123 3.055 2.603 1.00 0.33 H new ATOM 0 HD13 ILE A 71 15.110 4.477 2.258 1.00 0.33 H new ATOM 1082 N MET A 72 11.361 0.471 3.344 1.00 0.24 N ATOM 1083 CA MET A 72 10.193 -0.128 2.718 1.00 0.25 C ATOM 1084 C MET A 72 9.061 -0.211 3.729 1.00 0.27 C ATOM 1085 O MET A 72 7.889 -0.062 3.382 1.00 0.31 O ATOM 1086 CB MET A 72 10.528 -1.510 2.149 1.00 0.23 C ATOM 1087 CG MET A 72 11.129 -2.473 3.163 1.00 0.26 C ATOM 1088 SD MET A 72 9.902 -3.206 4.263 1.00 0.49 S ATOM 1089 CE MET A 72 8.713 -3.839 3.084 1.00 0.33 C ATOM 0 H MET A 72 12.225 -0.061 3.237 1.00 0.24 H new ATOM 0 HA MET A 72 9.874 0.499 1.885 1.00 0.25 H new ATOM 0 HB2 MET A 72 9.620 -1.952 1.739 1.00 0.23 H new ATOM 0 HB3 MET A 72 11.226 -1.390 1.320 1.00 0.23 H new ATOM 0 HG2 MET A 72 11.653 -3.268 2.633 1.00 0.26 H new ATOM 0 HG3 MET A 72 11.872 -1.944 3.760 1.00 0.26 H new ATOM 0 HE1 MET A 72 8.315 -4.788 3.443 1.00 0.33 H new ATOM 0 HE2 MET A 72 7.899 -3.124 2.969 1.00 0.33 H new ATOM 0 HE3 MET A 72 9.201 -3.991 2.121 1.00 0.33 H new ATOM 1099 N ALA A 73 9.427 -0.451 4.984 1.00 0.26 N ATOM 1100 CA ALA A 73 8.454 -0.527 6.058 1.00 0.29 C ATOM 1101 C ALA A 73 7.706 0.794 6.210 1.00 0.31 C ATOM 1102 O ALA A 73 6.475 0.819 6.194 1.00 0.36 O ATOM 1103 CB ALA A 73 9.143 -0.898 7.363 1.00 0.29 C ATOM 0 H ALA A 73 10.393 -0.596 5.278 1.00 0.26 H new ATOM 0 HA ALA A 73 7.728 -1.301 5.809 1.00 0.29 H new ATOM 0 HB1 ALA A 73 8.404 -0.952 8.162 1.00 0.29 H new ATOM 0 HB2 ALA A 73 9.631 -1.866 7.254 1.00 0.29 H new ATOM 0 HB3 ALA A 73 9.888 -0.141 7.609 1.00 0.29 H new ATOM 1109 N LYS A 74 8.450 1.894 6.358 1.00 0.31 N ATOM 1110 CA LYS A 74 7.826 3.205 6.513 1.00 0.35 C ATOM 1111 C LYS A 74 7.163 3.653 5.213 1.00 0.38 C ATOM 1112 O LYS A 74 6.272 4.501 5.217 1.00 0.44 O ATOM 1113 CB LYS A 74 8.858 4.244 6.961 1.00 0.38 C ATOM 1114 CG LYS A 74 10.010 4.432 5.988 1.00 0.43 C ATOM 1115 CD LYS A 74 10.908 5.591 6.397 1.00 0.48 C ATOM 1116 CE LYS A 74 11.601 5.325 7.725 1.00 1.38 C ATOM 1117 NZ LYS A 74 12.467 6.464 8.137 1.00 2.11 N ATOM 0 H LYS A 74 9.470 1.901 6.373 1.00 0.31 H new ATOM 0 HA LYS A 74 7.057 3.120 7.280 1.00 0.35 H new ATOM 0 HB2 LYS A 74 8.356 5.201 7.103 1.00 0.38 H new ATOM 0 HB3 LYS A 74 9.259 3.948 7.930 1.00 0.38 H new ATOM 0 HG2 LYS A 74 10.598 3.516 5.939 1.00 0.43 H new ATOM 0 HG3 LYS A 74 9.616 4.612 4.988 1.00 0.43 H new ATOM 0 HD2 LYS A 74 11.657 5.762 5.624 1.00 0.48 H new ATOM 0 HD3 LYS A 74 10.314 6.502 6.472 1.00 0.48 H new ATOM 0 HE2 LYS A 74 10.852 5.141 8.495 1.00 1.38 H new ATOM 0 HE3 LYS A 74 12.204 4.421 7.645 1.00 1.38 H new ATOM 0 HZ1 LYS A 74 12.921 6.244 9.046 1.00 2.11 H new ATOM 0 HZ2 LYS A 74 13.198 6.623 7.415 1.00 2.11 H new ATOM 0 HZ3 LYS A 74 11.888 7.322 8.238 1.00 2.11 H new ATOM 1131 N GLN A 75 7.608 3.073 4.104 1.00 0.36 N ATOM 1132 CA GLN A 75 7.074 3.406 2.790 1.00 0.42 C ATOM 1133 C GLN A 75 5.662 2.860 2.628 1.00 0.51 C ATOM 1134 O GLN A 75 4.892 3.340 1.796 1.00 0.63 O ATOM 1135 CB GLN A 75 7.983 2.847 1.694 1.00 0.43 C ATOM 1136 CG GLN A 75 7.811 3.532 0.348 1.00 0.69 C ATOM 1137 CD GLN A 75 8.074 5.024 0.420 1.00 0.90 C ATOM 1138 OE1 GLN A 75 7.160 5.817 0.642 1.00 1.48 O ATOM 1139 NE2 GLN A 75 9.330 5.414 0.235 1.00 0.80 N ATOM 0 H GLN A 75 8.342 2.365 4.090 1.00 0.36 H new ATOM 0 HA GLN A 75 7.036 4.492 2.700 1.00 0.42 H new ATOM 0 HB2 GLN A 75 9.021 2.944 2.011 1.00 0.43 H new ATOM 0 HB3 GLN A 75 7.784 1.782 1.578 1.00 0.43 H new ATOM 0 HG2 GLN A 75 8.490 3.081 -0.375 1.00 0.69 H new ATOM 0 HG3 GLN A 75 6.798 3.362 -0.016 1.00 0.69 H new ATOM 0 HE21 GLN A 75 10.057 4.722 0.053 1.00 0.80 H new ATOM 0 HE22 GLN A 75 9.567 6.405 0.275 1.00 0.80 H new ATOM 1289 N MET A 85 -4.857 -2.801 -2.327 1.00 12.20 N ATOM 1290 CA MET A 85 -5.090 -4.238 -2.398 1.00 13.28 C ATOM 1291 C MET A 85 -6.580 -4.546 -2.522 1.00 14.20 C ATOM 1292 O MET A 85 -7.002 -5.244 -3.444 1.00 15.28 O ATOM 1293 CB MET A 85 -4.503 -4.931 -1.165 1.00 13.04 C ATOM 1294 CG MET A 85 -4.824 -6.410 -1.098 1.00 14.20 C ATOM 1295 SD MET A 85 -4.282 -7.299 -2.566 1.00 15.12 S ATOM 1296 CE MET A 85 -5.600 -8.499 -2.728 1.00 16.29 C ATOM 0 HA MET A 85 -4.591 -4.620 -3.289 1.00 13.28 H new ATOM 0 HB2 MET A 85 -3.421 -4.801 -1.165 1.00 13.04 H new ATOM 0 HB3 MET A 85 -4.883 -4.443 -0.267 1.00 13.04 H new ATOM 0 HG2 MET A 85 -4.347 -6.843 -0.218 1.00 14.20 H new ATOM 0 HG3 MET A 85 -5.899 -6.540 -0.974 1.00 14.20 H new ATOM 0 HE1 MET A 85 -5.186 -9.453 -3.055 1.00 16.29 H new ATOM 0 HE2 MET A 85 -6.094 -8.629 -1.765 1.00 16.29 H new ATOM 0 HE3 MET A 85 -6.324 -8.147 -3.463 1.00 16.29 H new ATOM 1306 N ARG A 86 -7.371 -4.026 -1.588 1.00 13.88 N ATOM 1307 CA ARG A 86 -8.811 -4.240 -1.596 1.00 14.84 C ATOM 1308 C ARG A 86 -9.433 -3.688 -2.872 1.00 15.43 C ATOM 1309 O ARG A 86 -10.451 -4.192 -3.344 1.00 16.55 O ATOM 1310 CB ARG A 86 -9.449 -3.573 -0.378 1.00 14.45 C ATOM 1311 CG ARG A 86 -9.023 -4.183 0.949 1.00 14.20 C ATOM 1312 CD ARG A 86 -9.773 -3.561 2.117 1.00 14.13 C ATOM 1313 NE ARG A 86 -11.211 -3.814 2.044 1.00 14.82 N ATOM 1314 CZ ARG A 86 -12.065 -3.504 3.017 1.00 15.11 C ATOM 1315 NH1 ARG A 86 -11.626 -2.937 4.133 1.00 14.78 N ATOM 1316 NH2 ARG A 86 -13.357 -3.763 2.874 1.00 15.88 N ATOM 0 H ARG A 86 -7.036 -3.452 -0.814 1.00 13.88 H new ATOM 0 HA ARG A 86 -8.996 -5.313 -1.556 1.00 14.84 H new ATOM 0 HB2 ARG A 86 -9.192 -2.514 -0.379 1.00 14.45 H new ATOM 0 HB3 ARG A 86 -10.533 -3.638 -0.466 1.00 14.45 H new ATOM 0 HG2 ARG A 86 -9.204 -5.258 0.931 1.00 14.20 H new ATOM 0 HG3 ARG A 86 -7.951 -4.042 1.088 1.00 14.20 H new ATOM 0 HD2 ARG A 86 -9.382 -3.961 3.053 1.00 14.13 H new ATOM 0 HD3 ARG A 86 -9.595 -2.486 2.131 1.00 14.13 H new ATOM 0 HE ARG A 86 -11.581 -4.253 1.200 1.00 14.82 H new ATOM 0 HH11 ARG A 86 -10.632 -2.738 4.247 1.00 14.78 H new ATOM 0 HH12 ARG A 86 -12.282 -2.700 4.877 1.00 14.78 H new ATOM 0 HH21 ARG A 86 -13.698 -4.200 2.018 1.00 15.88 H new ATOM 0 HH22 ARG A 86 -14.010 -3.525 3.620 1.00 15.88 H new ATOM 1330 N GLU A 87 -8.812 -2.654 -3.428 1.00 14.77 N ATOM 1331 CA GLU A 87 -9.307 -2.037 -4.653 1.00 15.43 C ATOM 1332 C GLU A 87 -9.216 -3.012 -5.818 1.00 16.43 C ATOM 1333 O GLU A 87 -10.150 -3.138 -6.609 1.00 17.50 O ATOM 1334 CB GLU A 87 -8.523 -0.762 -4.971 1.00 14.60 C ATOM 1335 CG GLU A 87 -9.150 0.496 -4.396 1.00 15.22 C ATOM 1336 CD GLU A 87 -8.261 1.714 -4.553 1.00 14.94 C ATOM 1337 OE1 GLU A 87 -8.375 2.403 -5.589 1.00 15.08 O ATOM 1338 OE2 GLU A 87 -7.452 1.980 -3.639 1.00 14.72 O ATOM 0 H GLU A 87 -7.966 -2.226 -3.051 1.00 14.77 H new ATOM 0 HA GLU A 87 -10.353 -1.772 -4.500 1.00 15.43 H new ATOM 0 HB2 GLU A 87 -7.509 -0.863 -4.583 1.00 14.60 H new ATOM 0 HB3 GLU A 87 -8.442 -0.656 -6.053 1.00 14.60 H new ATOM 0 HG2 GLU A 87 -10.104 0.681 -4.890 1.00 15.22 H new ATOM 0 HG3 GLU A 87 -9.364 0.340 -3.339 1.00 15.22 H new ATOM 1345 N ALA A 88 -8.102 -3.733 -5.893 1.00 16.17 N ATOM 1346 CA ALA A 88 -7.892 -4.695 -6.963 1.00 17.18 C ATOM 1347 C ALA A 88 -8.802 -5.898 -6.772 1.00 18.20 C ATOM 1348 O ALA A 88 -9.421 -6.374 -7.725 1.00 19.32 O ATOM 1349 CB ALA A 88 -6.434 -5.121 -7.033 1.00 16.77 C ATOM 0 H ALA A 88 -7.333 -3.668 -5.226 1.00 16.17 H new ATOM 0 HA ALA A 88 -8.143 -4.219 -7.911 1.00 17.18 H new ATOM 0 HB1 ALA A 88 -6.304 -5.841 -7.841 1.00 16.77 H new ATOM 0 HB2 ALA A 88 -5.808 -4.248 -7.220 1.00 16.77 H new ATOM 0 HB3 ALA A 88 -6.143 -5.580 -6.088 1.00 16.77 H new ATOM 1355 N PHE A 89 -8.884 -6.388 -5.537 1.00 17.88 N ATOM 1356 CA PHE A 89 -9.746 -7.521 -5.235 1.00 18.88 C ATOM 1357 C PHE A 89 -11.166 -7.235 -5.714 1.00 19.75 C ATOM 1358 O PHE A 89 -11.829 -8.100 -6.285 1.00 20.90 O ATOM 1359 CB PHE A 89 -9.746 -7.816 -3.731 1.00 18.44 C ATOM 1360 CG PHE A 89 -10.773 -8.836 -3.333 1.00 19.53 C ATOM 1361 CD1 PHE A 89 -10.490 -10.186 -3.426 1.00 20.04 C ATOM 1362 CD2 PHE A 89 -12.023 -8.446 -2.880 1.00 20.12 C ATOM 1363 CE1 PHE A 89 -11.431 -11.131 -3.076 1.00 21.09 C ATOM 1364 CE2 PHE A 89 -12.970 -9.388 -2.528 1.00 21.19 C ATOM 1365 CZ PHE A 89 -12.672 -10.733 -2.628 1.00 21.66 C ATOM 0 H PHE A 89 -8.368 -6.020 -4.738 1.00 17.88 H new ATOM 0 HA PHE A 89 -9.362 -8.398 -5.756 1.00 18.88 H new ATOM 0 HB2 PHE A 89 -8.758 -8.169 -3.436 1.00 18.44 H new ATOM 0 HB3 PHE A 89 -9.930 -6.891 -3.185 1.00 18.44 H new ATOM 0 HD1 PHE A 89 -9.520 -10.504 -3.777 1.00 20.04 H new ATOM 0 HD2 PHE A 89 -12.259 -7.395 -2.801 1.00 20.12 H new ATOM 0 HE1 PHE A 89 -11.196 -12.182 -3.153 1.00 21.09 H new ATOM 0 HE2 PHE A 89 -13.941 -9.074 -2.175 1.00 21.19 H new ATOM 0 HZ PHE A 89 -13.411 -11.472 -2.355 1.00 21.66 H new ATOM 1375 N LYS A 90 -11.619 -6.007 -5.475 1.00 19.26 N ATOM 1376 CA LYS A 90 -12.955 -5.585 -5.884 1.00 20.11 C ATOM 1377 C LYS A 90 -13.102 -5.634 -7.400 1.00 20.94 C ATOM 1378 O LYS A 90 -14.172 -5.955 -7.918 1.00 22.05 O ATOM 1379 CB LYS A 90 -13.240 -4.166 -5.387 1.00 19.45 C ATOM 1380 CG LYS A 90 -13.407 -4.062 -3.880 1.00 18.94 C ATOM 1381 CD LYS A 90 -13.374 -2.614 -3.420 1.00 18.35 C ATOM 1382 CE LYS A 90 -13.615 -2.496 -1.924 1.00 17.84 C ATOM 1383 NZ LYS A 90 -14.982 -2.944 -1.545 1.00 18.07 N ATOM 0 H LYS A 90 -11.078 -5.285 -4.999 1.00 19.26 H new ATOM 0 HA LYS A 90 -13.674 -6.274 -5.441 1.00 20.11 H new ATOM 0 HB2 LYS A 90 -12.425 -3.512 -5.698 1.00 19.45 H new ATOM 0 HB3 LYS A 90 -14.146 -3.798 -5.869 1.00 19.45 H new ATOM 0 HG2 LYS A 90 -14.352 -4.518 -3.584 1.00 18.94 H new ATOM 0 HG3 LYS A 90 -12.614 -4.622 -3.384 1.00 18.94 H new ATOM 0 HD2 LYS A 90 -12.408 -2.175 -3.669 1.00 18.35 H new ATOM 0 HD3 LYS A 90 -14.132 -2.044 -3.957 1.00 18.35 H new ATOM 0 HE2 LYS A 90 -12.876 -3.093 -1.389 1.00 17.84 H new ATOM 0 HE3 LYS A 90 -13.473 -1.461 -1.614 1.00 17.84 H new ATOM 0 HZ1 LYS A 90 -15.186 -2.647 -0.569 1.00 18.07 H new ATOM 0 HZ2 LYS A 90 -15.678 -2.518 -2.190 1.00 18.07 H new ATOM 0 HZ3 LYS A 90 -15.038 -3.980 -1.611 1.00 18.07 H new ATOM 1397 N ILE A 91 -12.021 -5.313 -8.109 1.00 20.46 N ATOM 1398 CA ILE A 91 -12.040 -5.322 -9.570 1.00 21.30 C ATOM 1399 C ILE A 91 -12.322 -6.722 -10.114 1.00 22.45 C ATOM 1400 O ILE A 91 -13.072 -6.878 -11.077 1.00 23.52 O ATOM 1401 CB ILE A 91 -10.709 -4.809 -10.160 1.00 20.67 C ATOM 1402 CG1 ILE A 91 -10.374 -3.431 -9.588 1.00 19.54 C ATOM 1403 CG2 ILE A 91 -10.788 -4.758 -11.680 1.00 21.70 C ATOM 1404 CD1 ILE A 91 -9.010 -2.911 -9.991 1.00 18.86 C ATOM 0 H ILE A 91 -11.127 -5.045 -7.698 1.00 20.46 H new ATOM 0 HA ILE A 91 -12.843 -4.651 -9.874 1.00 21.30 H new ATOM 0 HB ILE A 91 -9.912 -5.499 -9.883 1.00 20.67 H new ATOM 0 HG12 ILE A 91 -11.133 -2.720 -9.913 1.00 19.54 H new ATOM 0 HG13 ILE A 91 -10.427 -3.478 -8.500 1.00 19.54 H new ATOM 0 HG21 ILE A 91 -9.842 -4.394 -12.081 1.00 21.70 H new ATOM 0 HG22 ILE A 91 -10.987 -5.757 -12.068 1.00 21.70 H new ATOM 0 HG23 ILE A 91 -11.592 -4.086 -11.980 1.00 21.70 H new ATOM 0 HD11 ILE A 91 -8.848 -1.930 -9.545 1.00 18.86 H new ATOM 0 HD12 ILE A 91 -8.240 -3.599 -9.642 1.00 18.86 H new ATOM 0 HD13 ILE A 91 -8.958 -2.829 -11.077 1.00 18.86 H new ATOM 1416 N PHE A 92 -11.719 -7.736 -9.498 1.00 22.30 N ATOM 1417 CA PHE A 92 -11.909 -9.116 -9.939 1.00 23.42 C ATOM 1418 C PHE A 92 -13.258 -9.669 -9.503 1.00 24.20 C ATOM 1419 O PHE A 92 -13.887 -10.426 -10.238 1.00 25.36 O ATOM 1420 CB PHE A 92 -10.810 -10.019 -9.388 1.00 23.12 C ATOM 1421 CG PHE A 92 -9.434 -9.655 -9.861 1.00 22.46 C ATOM 1422 CD1 PHE A 92 -9.005 -10.037 -11.121 1.00 22.24 C ATOM 1423 CD2 PHE A 92 -8.573 -8.932 -9.052 1.00 22.15 C ATOM 1424 CE1 PHE A 92 -7.744 -9.705 -11.570 1.00 21.74 C ATOM 1425 CE2 PHE A 92 -7.306 -8.597 -9.495 1.00 21.64 C ATOM 1426 CZ PHE A 92 -6.891 -8.983 -10.756 1.00 21.45 C ATOM 0 H PHE A 92 -11.098 -7.629 -8.696 1.00 22.30 H new ATOM 0 HA PHE A 92 -11.868 -9.103 -11.028 1.00 23.42 H new ATOM 0 HB2 PHE A 92 -10.832 -9.979 -8.299 1.00 23.12 H new ATOM 0 HB3 PHE A 92 -11.022 -11.049 -9.674 1.00 23.12 H new ATOM 0 HD1 PHE A 92 -9.667 -10.602 -11.761 1.00 22.24 H new ATOM 0 HD2 PHE A 92 -8.894 -8.627 -8.067 1.00 22.15 H new ATOM 0 HE1 PHE A 92 -7.423 -10.008 -12.556 1.00 21.74 H new ATOM 0 HE2 PHE A 92 -6.641 -8.034 -8.856 1.00 21.64 H new ATOM 0 HZ PHE A 92 -5.903 -8.721 -11.104 1.00 21.45 H new ATOM 1436 N ASP A 93 -13.701 -9.280 -8.313 1.00 23.63 N ATOM 1437 CA ASP A 93 -14.965 -9.766 -7.771 1.00 24.39 C ATOM 1438 C ASP A 93 -16.146 -9.288 -8.606 1.00 25.20 C ATOM 1439 O ASP A 93 -17.044 -10.068 -8.919 1.00 26.19 O ATOM 1440 CB ASP A 93 -15.130 -9.313 -6.318 1.00 23.63 C ATOM 1441 CG ASP A 93 -16.243 -10.051 -5.597 1.00 24.48 C ATOM 1442 OD1 ASP A 93 -17.347 -10.172 -6.169 1.00 24.88 O ATOM 1443 OD2 ASP A 93 -16.010 -10.505 -4.457 1.00 24.81 O ATOM 0 H ASP A 93 -13.204 -8.629 -7.705 1.00 23.63 H new ATOM 0 HA ASP A 93 -14.946 -10.855 -7.805 1.00 24.39 H new ATOM 0 HB2 ASP A 93 -14.192 -9.468 -5.785 1.00 23.63 H new ATOM 0 HB3 ASP A 93 -15.336 -8.243 -6.297 1.00 23.63 H new ATOM 1448 N ARG A 94 -16.142 -7.996 -8.931 1.00 24.82 N ATOM 1449 CA ARG A 94 -17.201 -7.372 -9.730 1.00 25.61 C ATOM 1450 C ARG A 94 -18.411 -7.030 -8.870 1.00 25.96 C ATOM 1451 O ARG A 94 -19.001 -5.957 -9.008 1.00 26.03 O ATOM 1452 CB ARG A 94 -17.638 -8.287 -10.880 1.00 26.84 C ATOM 1453 CG ARG A 94 -16.507 -8.671 -11.819 1.00 26.72 C ATOM 1454 CD ARG A 94 -16.911 -9.814 -12.734 1.00 27.97 C ATOM 1455 NE ARG A 94 -18.078 -9.480 -13.546 1.00 28.57 N ATOM 1456 CZ ARG A 94 -18.811 -10.383 -14.192 1.00 29.55 C ATOM 1457 NH1 ARG A 94 -18.499 -11.670 -14.117 1.00 30.03 N ATOM 1458 NH2 ARG A 94 -19.856 -9.999 -14.913 1.00 30.10 N ATOM 0 H ARG A 94 -15.405 -7.350 -8.649 1.00 24.82 H new ATOM 0 HA ARG A 94 -16.789 -6.452 -10.145 1.00 25.61 H new ATOM 0 HB2 ARG A 94 -18.077 -9.194 -10.464 1.00 26.84 H new ATOM 0 HB3 ARG A 94 -18.420 -7.788 -11.452 1.00 26.84 H new ATOM 0 HG2 ARG A 94 -16.220 -7.807 -12.418 1.00 26.72 H new ATOM 0 HG3 ARG A 94 -15.632 -8.960 -11.238 1.00 26.72 H new ATOM 0 HD2 ARG A 94 -16.076 -10.068 -13.387 1.00 27.97 H new ATOM 0 HD3 ARG A 94 -17.128 -10.698 -12.135 1.00 27.97 H new ATOM 0 HE ARG A 94 -18.346 -8.499 -13.622 1.00 28.57 H new ATOM 0 HH11 ARG A 94 -17.696 -11.969 -13.563 1.00 30.03 H new ATOM 0 HH12 ARG A 94 -19.062 -12.361 -14.613 1.00 30.03 H new ATOM 0 HH21 ARG A 94 -20.099 -9.010 -14.973 1.00 30.10 H new ATOM 0 HH22 ARG A 94 -20.417 -10.693 -15.408 1.00 30.10 H new ATOM 1472 N ASP A 95 -18.772 -7.950 -7.980 1.00 26.27 N ATOM 1473 CA ASP A 95 -19.921 -7.759 -7.102 1.00 26.74 C ATOM 1474 C ASP A 95 -19.515 -7.075 -5.803 1.00 25.70 C ATOM 1475 O ASP A 95 -20.056 -6.029 -5.442 1.00 25.63 O ATOM 1476 CB ASP A 95 -20.569 -9.106 -6.774 1.00 27.69 C ATOM 1477 CG ASP A 95 -20.364 -10.139 -7.863 1.00 28.38 C ATOM 1478 OD1 ASP A 95 -20.974 -9.994 -8.944 1.00 28.88 O ATOM 1479 OD2 ASP A 95 -19.592 -11.096 -7.632 1.00 28.47 O ATOM 0 H ASP A 95 -18.284 -8.836 -7.848 1.00 26.27 H new ATOM 0 HA ASP A 95 -20.634 -7.124 -7.628 1.00 26.74 H new ATOM 0 HB2 ASP A 95 -20.156 -9.484 -5.839 1.00 27.69 H new ATOM 0 HB3 ASP A 95 -21.637 -8.960 -6.615 1.00 27.69 H new ATOM 1484 N GLY A 96 -18.559 -7.678 -5.105 1.00 24.96 N ATOM 1485 CA GLY A 96 -18.102 -7.133 -3.842 1.00 24.00 C ATOM 1486 C GLY A 96 -18.681 -7.885 -2.660 1.00 24.47 C ATOM 1487 O GLY A 96 -18.906 -7.308 -1.597 1.00 24.19 O ATOM 0 H GLY A 96 -18.092 -8.537 -5.393 1.00 24.96 H new ATOM 0 HA2 GLY A 96 -17.014 -7.175 -3.801 1.00 24.00 H new ATOM 0 HA3 GLY A 96 -18.383 -6.082 -3.777 1.00 24.00 H new ATOM 1491 N ASP A 97 -18.919 -9.182 -2.850 1.00 25.28 N ATOM 1492 CA ASP A 97 -19.480 -10.020 -1.796 1.00 25.89 C ATOM 1493 C ASP A 97 -18.389 -10.474 -0.837 1.00 25.11 C ATOM 1494 O ASP A 97 -18.653 -11.182 0.135 1.00 25.54 O ATOM 1495 CB ASP A 97 -20.177 -11.243 -2.397 1.00 27.15 C ATOM 1496 CG ASP A 97 -20.813 -10.948 -3.742 1.00 27.81 C ATOM 1497 OD1 ASP A 97 -21.851 -10.254 -3.769 1.00 28.07 O ATOM 1498 OD2 ASP A 97 -20.272 -11.413 -4.767 1.00 28.13 O ATOM 0 H ASP A 97 -18.732 -9.673 -3.724 1.00 25.28 H new ATOM 0 HA ASP A 97 -20.212 -9.428 -1.247 1.00 25.89 H new ATOM 0 HB2 ASP A 97 -19.453 -12.050 -2.510 1.00 27.15 H new ATOM 0 HB3 ASP A 97 -20.943 -11.596 -1.706 1.00 27.15 H new ATOM 1503 N GLY A 98 -17.160 -10.055 -1.119 1.00 24.03 N ATOM 1504 CA GLY A 98 -16.039 -10.425 -0.280 1.00 23.27 C ATOM 1505 C GLY A 98 -15.257 -11.593 -0.846 1.00 23.53 C ATOM 1506 O GLY A 98 -14.185 -11.932 -0.343 1.00 22.95 O ATOM 0 H GLY A 98 -16.922 -9.465 -1.916 1.00 24.03 H new ATOM 0 HA2 GLY A 98 -15.375 -9.568 -0.166 1.00 23.27 H new ATOM 0 HA3 GLY A 98 -16.402 -10.682 0.715 1.00 23.27 H new ATOM 1510 N PHE A 99 -15.800 -12.219 -1.887 1.00 24.50 N ATOM 1511 CA PHE A 99 -15.141 -13.350 -2.531 1.00 24.94 C ATOM 1512 C PHE A 99 -15.338 -13.343 -4.047 1.00 25.47 C ATOM 1513 O PHE A 99 -16.447 -13.139 -4.551 1.00 26.19 O ATOM 1514 CB PHE A 99 -15.629 -14.671 -1.929 1.00 25.98 C ATOM 1515 CG PHE A 99 -17.010 -14.603 -1.348 1.00 26.68 C ATOM 1516 CD1 PHE A 99 -18.128 -14.711 -2.155 1.00 27.04 C ATOM 1517 CD2 PHE A 99 -17.184 -14.427 0.015 1.00 27.05 C ATOM 1518 CE1 PHE A 99 -19.399 -14.645 -1.612 1.00 27.76 C ATOM 1519 CE2 PHE A 99 -18.447 -14.362 0.564 1.00 27.77 C ATOM 1520 CZ PHE A 99 -19.558 -14.470 -0.250 1.00 28.11 C ATOM 0 H PHE A 99 -16.695 -11.961 -2.302 1.00 24.50 H new ATOM 0 HA PHE A 99 -14.072 -13.252 -2.344 1.00 24.94 H new ATOM 0 HB2 PHE A 99 -15.608 -15.440 -2.701 1.00 25.98 H new ATOM 0 HB3 PHE A 99 -14.933 -14.983 -1.150 1.00 25.98 H new ATOM 0 HD1 PHE A 99 -18.008 -14.848 -3.219 1.00 27.04 H new ATOM 0 HD2 PHE A 99 -16.319 -14.340 0.656 1.00 27.05 H new ATOM 0 HE1 PHE A 99 -20.265 -14.730 -2.251 1.00 27.76 H new ATOM 0 HE2 PHE A 99 -18.568 -14.227 1.629 1.00 27.77 H new ATOM 0 HZ PHE A 99 -20.549 -14.418 0.177 1.00 28.11 H new ATOM 1530 N ILE A 100 -14.236 -13.565 -4.764 1.00 25.18 N ATOM 1531 CA ILE A 100 -14.241 -13.601 -6.218 1.00 25.71 C ATOM 1532 C ILE A 100 -14.522 -15.009 -6.728 1.00 26.98 C ATOM 1533 O ILE A 100 -13.714 -15.919 -6.542 1.00 27.09 O ATOM 1534 CB ILE A 100 -12.882 -13.157 -6.794 1.00 24.88 C ATOM 1535 CG1 ILE A 100 -12.480 -11.787 -6.262 1.00 23.56 C ATOM 1536 CG2 ILE A 100 -12.925 -13.137 -8.312 1.00 25.54 C ATOM 1537 CD1 ILE A 100 -10.988 -11.552 -6.316 1.00 22.62 C ATOM 0 H ILE A 100 -13.318 -13.724 -4.349 1.00 25.18 H new ATOM 0 HA ILE A 100 -15.025 -12.917 -6.544 1.00 25.71 H new ATOM 0 HB ILE A 100 -12.133 -13.881 -6.473 1.00 24.88 H new ATOM 0 HG12 ILE A 100 -12.986 -11.015 -6.841 1.00 23.56 H new ATOM 0 HG13 ILE A 100 -12.822 -11.688 -5.232 1.00 23.56 H new ATOM 0 HG21 ILE A 100 -11.956 -12.821 -8.699 1.00 25.54 H new ATOM 0 HG22 ILE A 100 -13.156 -14.136 -8.683 1.00 25.54 H new ATOM 0 HG23 ILE A 100 -13.694 -12.440 -8.645 1.00 25.54 H new ATOM 0 HD11 ILE A 100 -10.761 -10.560 -5.924 1.00 22.62 H new ATOM 0 HD12 ILE A 100 -10.479 -12.305 -5.714 1.00 22.62 H new ATOM 0 HD13 ILE A 100 -10.646 -11.621 -7.349 1.00 22.62 H new ATOM 1549 N SER A 101 -15.663 -15.180 -7.375 1.00 27.98 N ATOM 1550 CA SER A 101 -16.029 -16.470 -7.939 1.00 29.24 C ATOM 1551 C SER A 101 -15.297 -16.677 -9.264 1.00 29.53 C ATOM 1552 O SER A 101 -14.938 -15.704 -9.921 1.00 29.01 O ATOM 1553 CB SER A 101 -17.542 -16.535 -8.146 1.00 30.23 C ATOM 1554 OG SER A 101 -17.905 -17.625 -8.975 1.00 31.40 O ATOM 0 H SER A 101 -16.352 -14.443 -7.523 1.00 27.98 H new ATOM 0 HA SER A 101 -15.739 -17.264 -7.250 1.00 29.24 H new ATOM 0 HB2 SER A 101 -18.039 -16.629 -7.180 1.00 30.23 H new ATOM 0 HB3 SER A 101 -17.890 -15.604 -8.594 1.00 30.23 H new ATOM 0 HG SER A 101 -18.878 -17.641 -9.087 1.00 31.40 H new ATOM 1560 N PRO A 102 -15.041 -17.938 -9.661 1.00 30.40 N ATOM 1561 CA PRO A 102 -14.348 -18.249 -10.913 1.00 30.84 C ATOM 1562 C PRO A 102 -14.719 -17.306 -12.059 1.00 31.00 C ATOM 1563 O PRO A 102 -13.845 -16.745 -12.712 1.00 30.80 O ATOM 1564 CB PRO A 102 -14.823 -19.670 -11.199 1.00 32.14 C ATOM 1565 CG PRO A 102 -14.963 -20.282 -9.847 1.00 32.10 C ATOM 1566 CD PRO A 102 -15.384 -19.168 -8.917 1.00 31.10 C ATOM 0 HA PRO A 102 -13.267 -18.141 -10.827 1.00 30.84 H new ATOM 0 HB2 PRO A 102 -15.770 -19.673 -11.739 1.00 32.14 H new ATOM 0 HB3 PRO A 102 -14.105 -20.215 -11.812 1.00 32.14 H new ATOM 0 HG2 PRO A 102 -15.705 -21.081 -9.857 1.00 32.10 H new ATOM 0 HG3 PRO A 102 -14.022 -20.725 -9.522 1.00 32.10 H new ATOM 0 HD2 PRO A 102 -16.450 -19.216 -8.693 1.00 31.10 H new ATOM 0 HD3 PRO A 102 -14.855 -19.220 -7.965 1.00 31.10 H new ATOM 1574 N ALA A 103 -16.015 -17.119 -12.286 1.00 31.44 N ATOM 1575 CA ALA A 103 -16.480 -16.242 -13.361 1.00 31.71 C ATOM 1576 C ALA A 103 -15.932 -14.823 -13.201 1.00 30.52 C ATOM 1577 O ALA A 103 -15.586 -14.171 -14.180 1.00 30.50 O ATOM 1578 CB ALA A 103 -18.001 -16.224 -13.403 1.00 32.55 C ATOM 0 H ALA A 103 -16.760 -17.559 -11.745 1.00 31.44 H new ATOM 0 HA ALA A 103 -16.104 -16.637 -14.305 1.00 31.71 H new ATOM 0 HB1 ALA A 103 -18.335 -15.568 -14.207 1.00 32.55 H new ATOM 0 HB2 ALA A 103 -18.372 -17.233 -13.580 1.00 32.55 H new ATOM 0 HB3 ALA A 103 -18.387 -15.858 -12.452 1.00 32.55 H new ATOM 1584 N GLU A 104 -15.857 -14.363 -11.959 1.00 29.57 N ATOM 1585 CA GLU A 104 -15.356 -13.025 -11.642 1.00 28.37 C ATOM 1586 C GLU A 104 -13.841 -12.933 -11.836 1.00 27.59 C ATOM 1587 O GLU A 104 -13.340 -12.011 -12.487 1.00 27.15 O ATOM 1588 CB GLU A 104 -15.733 -12.690 -10.201 1.00 27.67 C ATOM 1589 CG GLU A 104 -17.202 -12.934 -9.892 1.00 28.56 C ATOM 1590 CD GLU A 104 -17.500 -12.908 -8.407 1.00 28.05 C ATOM 1591 OE1 GLU A 104 -16.715 -12.293 -7.657 1.00 27.67 O ATOM 1592 OE2 GLU A 104 -18.518 -13.502 -7.993 1.00 28.09 O ATOM 0 H GLU A 104 -16.140 -14.903 -11.142 1.00 29.57 H new ATOM 0 HA GLU A 104 -15.810 -12.305 -12.323 1.00 28.37 H new ATOM 0 HB2 GLU A 104 -15.122 -13.288 -9.524 1.00 27.67 H new ATOM 0 HB3 GLU A 104 -15.496 -11.644 -10.004 1.00 27.67 H new ATOM 0 HG2 GLU A 104 -17.805 -12.176 -10.393 1.00 28.56 H new ATOM 0 HG3 GLU A 104 -17.499 -13.900 -10.301 1.00 28.56 H new ATOM 1599 N LEU A 105 -13.117 -13.909 -11.296 1.00 27.51 N ATOM 1600 CA LEU A 105 -11.661 -13.926 -11.391 1.00 26.86 C ATOM 1601 C LEU A 105 -11.191 -14.038 -12.839 1.00 27.51 C ATOM 1602 O LEU A 105 -10.435 -13.194 -13.318 1.00 26.94 O ATOM 1603 CB LEU A 105 -11.096 -15.089 -10.571 1.00 26.95 C ATOM 1604 CG LEU A 105 -9.574 -15.236 -10.606 1.00 26.49 C ATOM 1605 CD1 LEU A 105 -8.900 -14.006 -10.016 1.00 25.10 C ATOM 1606 CD2 LEU A 105 -9.148 -16.489 -9.857 1.00 26.84 C ATOM 0 H LEU A 105 -13.515 -14.699 -10.788 1.00 27.51 H new ATOM 0 HA LEU A 105 -11.292 -12.982 -10.991 1.00 26.86 H new ATOM 0 HB2 LEU A 105 -11.409 -14.966 -9.534 1.00 26.95 H new ATOM 0 HB3 LEU A 105 -11.542 -16.016 -10.931 1.00 26.95 H new ATOM 0 HG LEU A 105 -9.261 -15.329 -11.646 1.00 26.49 H new ATOM 0 HD11 LEU A 105 -7.818 -14.132 -10.051 1.00 25.10 H new ATOM 0 HD12 LEU A 105 -9.181 -13.125 -10.593 1.00 25.10 H new ATOM 0 HD13 LEU A 105 -9.217 -13.879 -8.981 1.00 25.10 H new ATOM 0 HD21 LEU A 105 -8.062 -16.581 -9.890 1.00 26.84 H new ATOM 0 HD22 LEU A 105 -9.475 -16.422 -8.819 1.00 26.84 H new ATOM 0 HD23 LEU A 105 -9.601 -17.364 -10.324 1.00 26.84 H new ATOM 1618 N ARG A 106 -11.649 -15.075 -13.529 1.00 28.76 N ATOM 1619 CA ARG A 106 -11.265 -15.308 -14.919 1.00 29.56 C ATOM 1620 C ARG A 106 -11.643 -14.139 -15.816 1.00 29.58 C ATOM 1621 O ARG A 106 -10.804 -13.567 -16.499 1.00 29.39 O ATOM 1622 CB ARG A 106 -11.950 -16.563 -15.455 1.00 30.94 C ATOM 1623 CG ARG A 106 -11.776 -17.784 -14.577 1.00 31.13 C ATOM 1624 CD ARG A 106 -12.475 -18.995 -15.172 1.00 32.40 C ATOM 1625 NE ARG A 106 -13.927 -18.839 -15.179 1.00 32.96 N ATOM 1626 CZ ARG A 106 -14.771 -19.797 -15.550 1.00 33.97 C ATOM 1627 NH1 ARG A 106 -14.309 -20.976 -15.944 1.00 34.53 N ATOM 1628 NH2 ARG A 106 -16.078 -19.576 -15.528 1.00 34.47 N ATOM 0 H ARG A 106 -12.289 -15.772 -13.148 1.00 28.76 H new ATOM 0 HA ARG A 106 -10.182 -15.428 -14.931 1.00 29.56 H new ATOM 0 HB2 ARG A 106 -13.015 -16.361 -15.572 1.00 30.94 H new ATOM 0 HB3 ARG A 106 -11.557 -16.783 -16.447 1.00 30.94 H new ATOM 0 HG2 ARG A 106 -10.714 -17.998 -14.454 1.00 31.13 H new ATOM 0 HG3 ARG A 106 -12.177 -17.581 -13.584 1.00 31.13 H new ATOM 0 HD2 ARG A 106 -12.122 -19.153 -16.191 1.00 32.40 H new ATOM 0 HD3 ARG A 106 -12.209 -19.884 -14.601 1.00 32.40 H new ATOM 0 HE ARG A 106 -14.316 -17.944 -14.882 1.00 32.96 H new ATOM 0 HH11 ARG A 106 -13.304 -21.150 -15.963 1.00 34.53 H new ATOM 0 HH12 ARG A 106 -14.959 -21.709 -16.228 1.00 34.53 H new ATOM 0 HH21 ARG A 106 -16.437 -18.670 -15.226 1.00 34.47 H new ATOM 0 HH22 ARG A 106 -16.725 -20.312 -15.813 1.00 34.47 H new ATOM 1642 N PHE A 107 -12.917 -13.796 -15.792 1.00 29.92 N ATOM 1643 CA PHE A 107 -13.456 -12.723 -16.629 1.00 30.13 C ATOM 1644 C PHE A 107 -12.637 -11.445 -16.544 1.00 29.04 C ATOM 1645 O PHE A 107 -12.503 -10.734 -17.534 1.00 29.31 O ATOM 1646 CB PHE A 107 -14.909 -12.423 -16.256 1.00 30.44 C ATOM 1647 CG PHE A 107 -15.512 -11.290 -17.039 1.00 30.81 C ATOM 1648 CD1 PHE A 107 -15.765 -11.425 -18.395 1.00 31.17 C ATOM 1649 CD2 PHE A 107 -15.825 -10.093 -16.418 1.00 30.89 C ATOM 1650 CE1 PHE A 107 -16.321 -10.385 -19.116 1.00 31.59 C ATOM 1651 CE2 PHE A 107 -16.381 -9.049 -17.134 1.00 31.32 C ATOM 1652 CZ PHE A 107 -16.629 -9.196 -18.484 1.00 31.68 C ATOM 0 H PHE A 107 -13.611 -14.247 -15.196 1.00 29.92 H new ATOM 0 HA PHE A 107 -13.405 -13.081 -17.657 1.00 30.13 H new ATOM 0 HB2 PHE A 107 -15.508 -13.320 -16.412 1.00 30.44 H new ATOM 0 HB3 PHE A 107 -14.961 -12.187 -15.193 1.00 30.44 H new ATOM 0 HD1 PHE A 107 -15.525 -12.353 -18.894 1.00 31.17 H new ATOM 0 HD2 PHE A 107 -15.633 -9.973 -15.362 1.00 30.89 H new ATOM 0 HE1 PHE A 107 -16.514 -10.502 -20.172 1.00 31.59 H new ATOM 0 HE2 PHE A 107 -16.621 -8.120 -16.638 1.00 31.32 H new ATOM 0 HZ PHE A 107 -17.063 -8.382 -19.046 1.00 31.68 H new ATOM 1662 N VAL A 108 -12.085 -11.149 -15.375 1.00 27.85 N ATOM 1663 CA VAL A 108 -11.311 -9.929 -15.215 1.00 26.77 C ATOM 1664 C VAL A 108 -9.858 -10.107 -15.651 1.00 26.50 C ATOM 1665 O VAL A 108 -9.333 -9.296 -16.414 1.00 26.41 O ATOM 1666 CB VAL A 108 -11.361 -9.418 -13.767 1.00 25.58 C ATOM 1667 CG1 VAL A 108 -10.433 -8.229 -13.593 1.00 24.43 C ATOM 1668 CG2 VAL A 108 -12.787 -9.051 -13.388 1.00 25.89 C ATOM 0 H VAL A 108 -12.157 -11.727 -14.538 1.00 27.85 H new ATOM 0 HA VAL A 108 -11.771 -9.186 -15.867 1.00 26.77 H new ATOM 0 HB VAL A 108 -11.023 -10.213 -13.102 1.00 25.58 H new ATOM 0 HG11 VAL A 108 -10.480 -7.879 -12.562 1.00 24.43 H new ATOM 0 HG12 VAL A 108 -9.411 -8.527 -13.829 1.00 24.43 H new ATOM 0 HG13 VAL A 108 -10.741 -7.426 -14.263 1.00 24.43 H new ATOM 0 HG21 VAL A 108 -12.809 -8.690 -12.360 1.00 25.89 H new ATOM 0 HG22 VAL A 108 -13.151 -8.269 -14.055 1.00 25.89 H new ATOM 0 HG23 VAL A 108 -13.425 -9.930 -13.478 1.00 25.89 H new ATOM 1678 N MET A 109 -9.209 -11.161 -15.172 1.00 26.48 N ATOM 1679 CA MET A 109 -7.816 -11.413 -15.526 1.00 26.33 C ATOM 1680 C MET A 109 -7.672 -11.698 -17.019 1.00 27.50 C ATOM 1681 O MET A 109 -6.604 -11.505 -17.599 1.00 27.46 O ATOM 1682 CB MET A 109 -7.261 -12.580 -14.710 1.00 26.26 C ATOM 1683 CG MET A 109 -8.004 -13.887 -14.920 1.00 27.48 C ATOM 1684 SD MET A 109 -7.621 -15.103 -13.644 1.00 27.39 S ATOM 1685 CE MET A 109 -5.851 -15.277 -13.857 1.00 26.90 C ATOM 0 H MET A 109 -9.620 -11.850 -14.542 1.00 26.48 H new ATOM 0 HA MET A 109 -7.242 -10.516 -15.294 1.00 26.33 H new ATOM 0 HB2 MET A 109 -6.212 -12.724 -14.968 1.00 26.26 H new ATOM 0 HB3 MET A 109 -7.296 -12.320 -13.652 1.00 26.26 H new ATOM 0 HG2 MET A 109 -9.077 -13.696 -14.926 1.00 27.48 H new ATOM 0 HG3 MET A 109 -7.747 -14.296 -15.897 1.00 27.48 H new ATOM 0 HE1 MET A 109 -5.597 -16.333 -13.945 1.00 26.90 H new ATOM 0 HE2 MET A 109 -5.540 -14.753 -14.761 1.00 26.90 H new ATOM 0 HE3 MET A 109 -5.337 -14.851 -12.995 1.00 26.90 H new ATOM 1695 N ILE A 110 -8.756 -12.156 -17.634 1.00 28.57 N ATOM 1696 CA ILE A 110 -8.761 -12.465 -19.058 1.00 29.77 C ATOM 1697 C ILE A 110 -9.122 -11.234 -19.881 1.00 29.90 C ATOM 1698 O ILE A 110 -8.609 -11.040 -20.985 1.00 30.43 O ATOM 1699 CB ILE A 110 -9.756 -13.598 -19.381 1.00 30.96 C ATOM 1700 CG1 ILE A 110 -9.358 -14.884 -18.647 1.00 31.00 C ATOM 1701 CG2 ILE A 110 -9.822 -13.841 -20.883 1.00 32.20 C ATOM 1702 CD1 ILE A 110 -10.437 -15.947 -18.652 1.00 32.05 C ATOM 0 H ILE A 110 -9.647 -12.322 -17.166 1.00 28.57 H new ATOM 0 HA ILE A 110 -7.754 -12.792 -19.319 1.00 29.77 H new ATOM 0 HB ILE A 110 -10.746 -13.295 -19.039 1.00 30.96 H new ATOM 0 HG12 ILE A 110 -8.458 -15.291 -19.107 1.00 31.00 H new ATOM 0 HG13 ILE A 110 -9.106 -14.640 -17.615 1.00 31.00 H new ATOM 0 HG21 ILE A 110 -10.529 -14.644 -21.091 1.00 32.20 H new ATOM 0 HG22 ILE A 110 -10.149 -12.930 -21.385 1.00 32.20 H new ATOM 0 HG23 ILE A 110 -8.835 -14.123 -21.250 1.00 32.20 H new ATOM 0 HD11 ILE A 110 -10.083 -16.827 -18.115 1.00 32.05 H new ATOM 0 HD12 ILE A 110 -11.332 -15.559 -18.165 1.00 32.05 H new ATOM 0 HD13 ILE A 110 -10.673 -16.221 -19.680 1.00 32.05 H new ATOM 1714 N ASN A 111 -10.008 -10.404 -19.337 1.00 29.51 N ATOM 1715 CA ASN A 111 -10.436 -9.190 -20.024 1.00 29.69 C ATOM 1716 C ASN A 111 -9.257 -8.243 -20.207 1.00 28.92 C ATOM 1717 O ASN A 111 -9.106 -7.622 -21.259 1.00 29.42 O ATOM 1718 CB ASN A 111 -11.553 -8.487 -19.247 1.00 29.42 C ATOM 1719 CG ASN A 111 -12.390 -7.582 -20.130 1.00 30.42 C ATOM 1720 OD1 ASN A 111 -12.773 -6.484 -19.727 1.00 30.38 O ATOM 1721 ND2 ASN A 111 -12.690 -8.047 -21.337 1.00 31.39 N ATOM 0 H ASN A 111 -10.442 -10.550 -18.426 1.00 29.51 H new ATOM 0 HA ASN A 111 -10.822 -9.474 -21.003 1.00 29.69 H new ATOM 0 HB2 ASN A 111 -12.197 -9.235 -18.784 1.00 29.42 H new ATOM 0 HB3 ASN A 111 -11.116 -7.899 -18.440 1.00 29.42 H new ATOM 0 HD21 ASN A 111 -13.260 -7.488 -21.972 1.00 31.39 H new ATOM 0 HD22 ASN A 111 -12.351 -8.963 -21.629 1.00 31.39 H new ATOM 1728 N LEU A 112 -8.422 -8.137 -19.176 1.00 27.75 N ATOM 1729 CA LEU A 112 -7.248 -7.272 -19.233 1.00 26.97 C ATOM 1730 C LEU A 112 -6.263 -7.789 -20.276 1.00 27.67 C ATOM 1731 O LEU A 112 -5.310 -7.104 -20.645 1.00 27.59 O ATOM 1732 CB LEU A 112 -6.583 -7.146 -17.855 1.00 25.59 C ATOM 1733 CG LEU A 112 -5.927 -8.414 -17.304 1.00 25.50 C ATOM 1734 CD1 LEU A 112 -4.500 -8.546 -17.814 1.00 25.51 C ATOM 1735 CD2 LEU A 112 -5.944 -8.397 -15.783 1.00 24.36 C ATOM 0 H LEU A 112 -8.536 -8.637 -18.295 1.00 27.75 H new ATOM 0 HA LEU A 112 -7.571 -6.274 -19.530 1.00 26.97 H new ATOM 0 HB2 LEU A 112 -5.825 -6.364 -17.910 1.00 25.59 H new ATOM 0 HB3 LEU A 112 -7.335 -6.811 -17.141 1.00 25.59 H new ATOM 0 HG LEU A 112 -6.497 -9.275 -17.652 1.00 25.50 H new ATOM 0 HD11 LEU A 112 -4.052 -9.454 -17.410 1.00 25.51 H new ATOM 0 HD12 LEU A 112 -4.506 -8.597 -18.903 1.00 25.51 H new ATOM 0 HD13 LEU A 112 -3.918 -7.681 -17.495 1.00 25.51 H new ATOM 0 HD21 LEU A 112 -5.474 -9.305 -15.404 1.00 24.36 H new ATOM 0 HD22 LEU A 112 -5.395 -7.527 -15.423 1.00 24.36 H new ATOM 0 HD23 LEU A 112 -6.974 -8.347 -15.431 1.00 24.36 H new ATOM 1747 N GLY A 113 -6.510 -9.012 -20.746 1.00 28.44 N ATOM 1748 CA GLY A 113 -5.654 -9.622 -21.747 1.00 29.23 C ATOM 1749 C GLY A 113 -4.601 -10.547 -21.166 1.00 29.21 C ATOM 1750 O GLY A 113 -3.505 -10.115 -20.809 1.00 29.01 O ATOM 0 H GLY A 113 -7.294 -9.592 -20.447 1.00 28.44 H new ATOM 0 HA2 GLY A 113 -6.272 -10.184 -22.447 1.00 29.23 H new ATOM 0 HA3 GLY A 113 -5.160 -8.836 -22.318 1.00 29.23 H new ATOM 1754 N GLU A 114 -4.948 -11.830 -21.079 1.00 29.51 N ATOM 1755 CA GLU A 114 -4.042 -12.853 -20.562 1.00 29.65 C ATOM 1756 C GLU A 114 -4.281 -14.198 -21.234 1.00 30.86 C ATOM 1757 O GLU A 114 -3.342 -14.944 -21.509 1.00 31.02 O ATOM 1758 CB GLU A 114 -4.187 -12.994 -19.045 1.00 28.56 C ATOM 1759 CG GLU A 114 -3.597 -11.830 -18.269 1.00 27.33 C ATOM 1760 CD GLU A 114 -3.561 -12.079 -16.773 1.00 26.52 C ATOM 1761 OE1 GLU A 114 -2.632 -12.772 -16.309 1.00 26.29 O ATOM 1762 OE2 GLU A 114 -4.460 -11.577 -16.066 1.00 26.19 O ATOM 0 H GLU A 114 -5.860 -12.188 -21.363 1.00 29.51 H new ATOM 0 HA GLU A 114 -3.026 -12.532 -20.790 1.00 29.65 H new ATOM 0 HB2 GLU A 114 -5.244 -13.087 -18.796 1.00 28.56 H new ATOM 0 HB3 GLU A 114 -3.702 -13.916 -18.726 1.00 28.56 H new ATOM 0 HG2 GLU A 114 -2.585 -11.638 -18.625 1.00 27.33 H new ATOM 0 HG3 GLU A 114 -4.182 -10.932 -18.469 1.00 27.33 H new ATOM 1769 N LYS A 115 -5.540 -14.494 -21.490 1.00 31.76 N ATOM 1770 CA LYS A 115 -5.930 -15.745 -22.132 1.00 32.97 C ATOM 1771 C LYS A 115 -5.484 -16.930 -21.296 1.00 32.97 C ATOM 1772 O LYS A 115 -4.575 -17.673 -21.672 1.00 33.55 O ATOM 1773 CB LYS A 115 -5.340 -15.836 -23.543 1.00 34.07 C ATOM 1774 CG LYS A 115 -5.850 -14.759 -24.489 1.00 34.37 C ATOM 1775 CD LYS A 115 -7.353 -14.865 -24.704 1.00 34.03 C ATOM 1776 CE LYS A 115 -7.861 -13.776 -25.635 1.00 34.21 C ATOM 1777 NZ LYS A 115 -7.248 -13.871 -26.989 1.00 34.46 N ATOM 0 H LYS A 115 -6.322 -13.881 -21.262 1.00 31.76 H new ATOM 0 HA LYS A 115 -7.017 -15.764 -22.212 1.00 32.97 H new ATOM 0 HB2 LYS A 115 -4.254 -15.766 -23.479 1.00 34.07 H new ATOM 0 HB3 LYS A 115 -5.572 -16.815 -23.962 1.00 34.07 H new ATOM 0 HG2 LYS A 115 -5.609 -13.776 -24.085 1.00 34.37 H new ATOM 0 HG3 LYS A 115 -5.338 -14.844 -25.448 1.00 34.37 H new ATOM 0 HD2 LYS A 115 -7.594 -15.843 -25.121 1.00 34.03 H new ATOM 0 HD3 LYS A 115 -7.865 -14.793 -23.744 1.00 34.03 H new ATOM 0 HE2 LYS A 115 -8.945 -13.849 -25.722 1.00 34.21 H new ATOM 0 HE3 LYS A 115 -7.641 -12.799 -25.205 1.00 34.21 H new ATOM 0 HZ1 LYS A 115 -7.761 -13.250 -27.647 1.00 34.46 H new ATOM 0 HZ2 LYS A 115 -6.252 -13.576 -26.941 1.00 34.46 H new ATOM 0 HZ3 LYS A 115 -7.302 -14.853 -27.327 1.00 34.46 H new ATOM 1791 N VAL A 116 -6.131 -17.092 -20.151 1.00 32.39 N ATOM 1792 CA VAL A 116 -5.815 -18.175 -19.240 1.00 32.39 C ATOM 1793 C VAL A 116 -6.756 -19.355 -19.441 1.00 33.53 C ATOM 1794 O VAL A 116 -7.908 -19.187 -19.844 1.00 33.96 O ATOM 1795 CB VAL A 116 -5.904 -17.708 -17.775 1.00 31.13 C ATOM 1796 CG1 VAL A 116 -5.257 -16.344 -17.605 1.00 29.96 C ATOM 1797 CG2 VAL A 116 -7.349 -17.687 -17.300 1.00 31.21 C ATOM 0 H VAL A 116 -6.883 -16.481 -19.832 1.00 32.39 H new ATOM 0 HA VAL A 116 -4.794 -18.489 -19.458 1.00 32.39 H new ATOM 0 HB VAL A 116 -5.358 -18.421 -17.157 1.00 31.13 H new ATOM 0 HG11 VAL A 116 -5.331 -16.033 -16.563 1.00 29.96 H new ATOM 0 HG12 VAL A 116 -4.207 -16.401 -17.893 1.00 29.96 H new ATOM 0 HG13 VAL A 116 -5.768 -15.618 -18.237 1.00 29.96 H new ATOM 0 HG21 VAL A 116 -7.386 -17.354 -16.263 1.00 31.21 H new ATOM 0 HG22 VAL A 116 -7.926 -17.003 -17.922 1.00 31.21 H new ATOM 0 HG23 VAL A 116 -7.771 -18.689 -17.375 1.00 31.21 H new ATOM 1807 N THR A 117 -6.254 -20.547 -19.163 1.00 34.07 N ATOM 1808 CA THR A 117 -7.046 -21.758 -19.292 1.00 35.18 C ATOM 1809 C THR A 117 -7.791 -22.050 -17.994 1.00 34.78 C ATOM 1810 O THR A 117 -7.318 -21.710 -16.911 1.00 33.80 O ATOM 1811 CB THR A 117 -6.166 -22.967 -19.658 1.00 36.10 C ATOM 1812 OG1 THR A 117 -5.048 -23.045 -18.767 1.00 35.42 O ATOM 1813 CG2 THR A 117 -5.672 -22.860 -21.093 1.00 36.81 C ATOM 0 H THR A 117 -5.297 -20.702 -18.845 1.00 34.07 H new ATOM 0 HA THR A 117 -7.764 -21.594 -20.095 1.00 35.18 H new ATOM 0 HB THR A 117 -6.768 -23.871 -19.564 1.00 36.10 H new ATOM 0 HG1 THR A 117 -4.412 -23.714 -19.098 1.00 35.42 H new ATOM 0 HG21 THR A 117 -5.052 -23.725 -21.330 1.00 36.81 H new ATOM 0 HG22 THR A 117 -6.526 -22.829 -21.770 1.00 36.81 H new ATOM 0 HG23 THR A 117 -5.084 -21.950 -21.208 1.00 36.81 H new ATOM 1821 N ASP A 118 -8.960 -22.667 -18.103 1.00 35.59 N ATOM 1822 CA ASP A 118 -9.758 -22.993 -16.928 1.00 35.40 C ATOM 1823 C ASP A 118 -8.939 -23.783 -15.913 1.00 35.21 C ATOM 1824 O ASP A 118 -9.107 -23.624 -14.704 1.00 34.50 O ATOM 1825 CB ASP A 118 -10.993 -23.799 -17.334 1.00 36.59 C ATOM 1826 CG ASP A 118 -11.885 -23.046 -18.301 1.00 36.85 C ATOM 1827 OD1 ASP A 118 -12.756 -22.283 -17.833 1.00 36.95 O ATOM 1828 OD2 ASP A 118 -11.715 -23.222 -19.526 1.00 37.02 O ATOM 0 H ASP A 118 -9.376 -22.951 -18.990 1.00 35.59 H new ATOM 0 HA ASP A 118 -10.074 -22.058 -16.466 1.00 35.40 H new ATOM 0 HB2 ASP A 118 -10.677 -24.737 -17.791 1.00 36.59 H new ATOM 0 HB3 ASP A 118 -11.565 -24.056 -16.442 1.00 36.59 H new ATOM 1833 N GLU A 119 -8.052 -24.635 -16.416 1.00 35.91 N ATOM 1834 CA GLU A 119 -7.211 -25.465 -15.561 1.00 35.91 C ATOM 1835 C GLU A 119 -6.340 -24.638 -14.615 1.00 34.60 C ATOM 1836 O GLU A 119 -6.290 -24.917 -13.417 1.00 34.24 O ATOM 1837 CB GLU A 119 -6.334 -26.387 -16.412 1.00 36.90 C ATOM 1838 CG GLU A 119 -5.423 -25.650 -17.378 1.00 36.71 C ATOM 1839 CD GLU A 119 -4.582 -26.590 -18.219 1.00 37.77 C ATOM 1840 OE1 GLU A 119 -3.478 -26.962 -17.769 1.00 38.19 O ATOM 1841 OE2 GLU A 119 -5.026 -26.954 -19.329 1.00 38.22 O ATOM 0 H GLU A 119 -7.897 -24.769 -17.415 1.00 35.91 H new ATOM 0 HA GLU A 119 -7.879 -26.065 -14.943 1.00 35.91 H new ATOM 0 HB2 GLU A 119 -5.724 -27.004 -15.752 1.00 36.90 H new ATOM 0 HB3 GLU A 119 -6.976 -27.063 -16.977 1.00 36.90 H new ATOM 0 HG2 GLU A 119 -6.027 -25.023 -18.034 1.00 36.71 H new ATOM 0 HG3 GLU A 119 -4.767 -24.985 -16.817 1.00 36.71 H new ATOM 1848 N GLU A 120 -5.652 -23.623 -15.134 1.00 33.92 N ATOM 1849 CA GLU A 120 -4.799 -22.807 -14.278 1.00 32.68 C ATOM 1850 C GLU A 120 -5.656 -22.028 -13.293 1.00 31.73 C ATOM 1851 O GLU A 120 -5.233 -21.748 -12.171 1.00 30.88 O ATOM 1852 CB GLU A 120 -3.902 -21.872 -15.096 1.00 32.23 C ATOM 1853 CG GLU A 120 -4.651 -20.936 -16.024 1.00 31.98 C ATOM 1854 CD GLU A 120 -3.717 -20.029 -16.801 1.00 31.39 C ATOM 1855 OE1 GLU A 120 -3.333 -18.970 -16.263 1.00 31.34 O ATOM 1856 OE2 GLU A 120 -3.372 -20.378 -17.950 1.00 31.03 O ATOM 0 H GLU A 120 -5.667 -23.352 -16.117 1.00 33.92 H new ATOM 0 HA GLU A 120 -4.136 -23.469 -13.721 1.00 32.68 H new ATOM 0 HB2 GLU A 120 -3.298 -21.277 -14.411 1.00 32.23 H new ATOM 0 HB3 GLU A 120 -3.213 -22.475 -15.687 1.00 32.23 H new ATOM 0 HG2 GLU A 120 -5.249 -21.522 -16.722 1.00 31.98 H new ATOM 0 HG3 GLU A 120 -5.344 -20.328 -15.442 1.00 31.98 H new ATOM 1863 N ILE A 121 -6.865 -21.676 -13.723 1.00 31.93 N ATOM 1864 CA ILE A 121 -7.798 -20.964 -12.865 1.00 31.19 C ATOM 1865 C ILE A 121 -8.153 -21.809 -11.640 1.00 31.38 C ATOM 1866 O ILE A 121 -8.102 -21.327 -10.511 1.00 30.48 O ATOM 1867 CB ILE A 121 -9.093 -20.585 -13.623 1.00 31.66 C ATOM 1868 CG1 ILE A 121 -8.812 -19.496 -14.665 1.00 31.30 C ATOM 1869 CG2 ILE A 121 -10.172 -20.124 -12.651 1.00 31.21 C ATOM 1870 CD1 ILE A 121 -8.133 -18.267 -14.094 1.00 29.89 C ATOM 0 H ILE A 121 -7.218 -21.873 -14.659 1.00 31.93 H new ATOM 0 HA ILE A 121 -7.306 -20.046 -12.543 1.00 31.19 H new ATOM 0 HB ILE A 121 -9.454 -21.473 -14.141 1.00 31.66 H new ATOM 0 HG12 ILE A 121 -8.185 -19.913 -15.453 1.00 31.30 H new ATOM 0 HG13 ILE A 121 -9.752 -19.198 -15.129 1.00 31.30 H new ATOM 0 HG21 ILE A 121 -11.073 -19.863 -13.205 1.00 31.21 H new ATOM 0 HG22 ILE A 121 -10.397 -20.927 -11.950 1.00 31.21 H new ATOM 0 HG23 ILE A 121 -9.818 -19.252 -12.102 1.00 31.21 H new ATOM 0 HD11 ILE A 121 -7.966 -17.541 -14.890 1.00 29.89 H new ATOM 0 HD12 ILE A 121 -8.767 -17.825 -13.326 1.00 29.89 H new ATOM 0 HD13 ILE A 121 -7.176 -18.551 -13.655 1.00 29.89 H new ATOM 1882 N ASP A 122 -8.529 -23.069 -11.864 1.00 32.59 N ATOM 1883 CA ASP A 122 -8.879 -23.953 -10.758 1.00 32.95 C ATOM 1884 C ASP A 122 -7.701 -24.116 -9.803 1.00 32.41 C ATOM 1885 O ASP A 122 -7.884 -24.284 -8.597 1.00 32.19 O ATOM 1886 CB ASP A 122 -9.332 -25.327 -11.275 1.00 34.41 C ATOM 1887 CG ASP A 122 -8.181 -26.249 -11.637 1.00 35.02 C ATOM 1888 OD1 ASP A 122 -7.418 -26.628 -10.724 1.00 35.24 O ATOM 1889 OD2 ASP A 122 -8.031 -26.579 -12.832 1.00 35.33 O ATOM 0 H ASP A 122 -8.598 -23.493 -12.789 1.00 32.59 H new ATOM 0 HA ASP A 122 -9.708 -23.497 -10.217 1.00 32.95 H new ATOM 0 HB2 ASP A 122 -9.946 -25.808 -10.514 1.00 34.41 H new ATOM 0 HB3 ASP A 122 -9.963 -25.186 -12.152 1.00 34.41 H new ATOM 1894 N GLU A 123 -6.491 -24.067 -10.353 1.00 32.28 N ATOM 1895 CA GLU A 123 -5.276 -24.217 -9.559 1.00 31.88 C ATOM 1896 C GLU A 123 -5.109 -23.077 -8.558 1.00 30.51 C ATOM 1897 O GLU A 123 -4.965 -23.310 -7.359 1.00 30.32 O ATOM 1898 CB GLU A 123 -4.052 -24.283 -10.478 1.00 32.05 C ATOM 1899 CG GLU A 123 -2.731 -24.269 -9.729 1.00 31.72 C ATOM 1900 CD GLU A 123 -1.561 -24.687 -10.598 1.00 32.49 C ATOM 1901 OE1 GLU A 123 -1.094 -23.856 -11.405 1.00 32.69 O ATOM 1902 OE2 GLU A 123 -1.113 -25.846 -10.474 1.00 32.95 O ATOM 0 H GLU A 123 -6.326 -23.924 -11.349 1.00 32.28 H new ATOM 0 HA GLU A 123 -5.363 -25.147 -8.996 1.00 31.88 H new ATOM 0 HB2 GLU A 123 -4.109 -25.189 -11.081 1.00 32.05 H new ATOM 0 HB3 GLU A 123 -4.079 -23.439 -11.167 1.00 32.05 H new ATOM 0 HG2 GLU A 123 -2.549 -23.267 -9.340 1.00 31.72 H new ATOM 0 HG3 GLU A 123 -2.798 -24.937 -8.871 1.00 31.72 H new ATOM 1909 N MET A 124 -5.119 -21.845 -9.054 1.00 29.62 N ATOM 1910 CA MET A 124 -4.964 -20.680 -8.192 1.00 28.28 C ATOM 1911 C MET A 124 -6.054 -20.633 -7.122 1.00 28.13 C ATOM 1912 O MET A 124 -5.774 -20.354 -5.956 1.00 27.52 O ATOM 1913 CB MET A 124 -4.966 -19.393 -9.023 1.00 27.46 C ATOM 1914 CG MET A 124 -6.195 -19.218 -9.896 1.00 28.01 C ATOM 1915 SD MET A 124 -6.016 -17.877 -11.091 1.00 27.29 S ATOM 1916 CE MET A 124 -5.508 -16.527 -10.028 1.00 26.32 C ATOM 0 H MET A 124 -5.232 -21.628 -10.044 1.00 29.62 H new ATOM 0 HA MET A 124 -4.003 -20.764 -7.684 1.00 28.28 H new ATOM 0 HB2 MET A 124 -4.888 -18.539 -8.350 1.00 27.46 H new ATOM 0 HB3 MET A 124 -4.079 -19.382 -9.657 1.00 27.46 H new ATOM 0 HG2 MET A 124 -6.393 -20.149 -10.428 1.00 28.01 H new ATOM 0 HG3 MET A 124 -7.060 -19.022 -9.263 1.00 28.01 H new ATOM 0 HE1 MET A 124 -5.763 -15.578 -10.499 1.00 26.32 H new ATOM 0 HE2 MET A 124 -6.020 -16.606 -9.069 1.00 26.32 H new ATOM 0 HE3 MET A 124 -4.431 -16.575 -9.869 1.00 26.32 H new ATOM 1926 N ILE A 125 -7.295 -20.906 -7.520 1.00 28.78 N ATOM 1927 CA ILE A 125 -8.414 -20.889 -6.579 1.00 28.80 C ATOM 1928 C ILE A 125 -8.253 -21.923 -5.469 1.00 29.32 C ATOM 1929 O ILE A 125 -8.248 -21.579 -4.292 1.00 28.74 O ATOM 1930 CB ILE A 125 -9.757 -21.172 -7.289 1.00 29.69 C ATOM 1931 CG1 ILE A 125 -10.015 -20.136 -8.389 1.00 29.31 C ATOM 1932 CG2 ILE A 125 -10.898 -21.174 -6.274 1.00 29.77 C ATOM 1933 CD1 ILE A 125 -11.213 -20.455 -9.258 1.00 30.29 C ATOM 0 H ILE A 125 -7.550 -21.140 -8.479 1.00 28.78 H new ATOM 0 HA ILE A 125 -8.416 -19.888 -6.148 1.00 28.80 H new ATOM 0 HB ILE A 125 -9.704 -22.156 -7.755 1.00 29.69 H new ATOM 0 HG12 ILE A 125 -10.162 -19.159 -7.928 1.00 29.31 H new ATOM 0 HG13 ILE A 125 -9.129 -20.061 -9.020 1.00 29.31 H new ATOM 0 HG21 ILE A 125 -11.840 -21.374 -6.785 1.00 29.77 H new ATOM 0 HG22 ILE A 125 -10.719 -21.947 -5.527 1.00 29.77 H new ATOM 0 HG23 ILE A 125 -10.951 -20.202 -5.784 1.00 29.77 H new ATOM 0 HD11 ILE A 125 -11.332 -19.678 -10.013 1.00 30.29 H new ATOM 0 HD12 ILE A 125 -11.061 -21.417 -9.748 1.00 30.29 H new ATOM 0 HD13 ILE A 125 -12.109 -20.501 -8.639 1.00 30.29 H new ATOM 1945 N ARG A 126 -8.116 -23.189 -5.858 1.00 30.48 N ATOM 1946 CA ARG A 126 -7.991 -24.291 -4.902 1.00 31.17 C ATOM 1947 C ARG A 126 -6.891 -24.063 -3.860 1.00 30.45 C ATOM 1948 O ARG A 126 -7.089 -24.333 -2.675 1.00 30.52 O ATOM 1949 CB ARG A 126 -7.739 -25.609 -5.645 1.00 32.45 C ATOM 1950 CG ARG A 126 -6.376 -25.696 -6.309 1.00 32.40 C ATOM 1951 CD ARG A 126 -6.151 -27.057 -6.946 1.00 33.74 C ATOM 1952 NE ARG A 126 -4.831 -27.158 -7.564 1.00 34.27 N ATOM 1953 CZ ARG A 126 -4.363 -28.266 -8.132 1.00 35.37 C ATOM 1954 NH1 ARG A 126 -5.101 -29.367 -8.160 1.00 36.06 N ATOM 1955 NH2 ARG A 126 -3.152 -28.272 -8.672 1.00 35.85 N ATOM 0 H ARG A 126 -8.088 -23.480 -6.835 1.00 30.48 H new ATOM 0 HA ARG A 126 -8.935 -24.341 -4.360 1.00 31.17 H new ATOM 0 HB2 ARG A 126 -7.842 -26.435 -4.942 1.00 32.45 H new ATOM 0 HB3 ARG A 126 -8.510 -25.739 -6.404 1.00 32.45 H new ATOM 0 HG2 ARG A 126 -6.290 -24.919 -7.069 1.00 32.40 H new ATOM 0 HG3 ARG A 126 -5.598 -25.506 -5.570 1.00 32.40 H new ATOM 0 HD2 ARG A 126 -6.258 -27.834 -6.189 1.00 33.74 H new ATOM 0 HD3 ARG A 126 -6.919 -27.237 -7.698 1.00 33.74 H new ATOM 0 HE ARG A 126 -4.234 -26.331 -7.560 1.00 34.27 H new ATOM 0 HH11 ARG A 126 -6.033 -29.367 -7.745 1.00 36.06 H new ATOM 0 HH12 ARG A 126 -4.737 -30.214 -8.597 1.00 36.06 H new ATOM 0 HH21 ARG A 126 -2.580 -27.428 -8.652 1.00 35.85 H new ATOM 0 HH22 ARG A 126 -2.792 -29.121 -9.108 1.00 35.85 H new ATOM 1969 N GLU A 127 -5.736 -23.572 -4.299 1.00 29.84 N ATOM 1970 CA GLU A 127 -4.608 -23.348 -3.396 1.00 29.22 C ATOM 1971 C GLU A 127 -4.944 -22.368 -2.278 1.00 28.15 C ATOM 1972 O GLU A 127 -4.600 -22.600 -1.119 1.00 28.09 O ATOM 1973 CB GLU A 127 -3.397 -22.833 -4.169 1.00 28.76 C ATOM 1974 CG GLU A 127 -2.070 -23.170 -3.506 1.00 28.80 C ATOM 1975 CD GLU A 127 -0.883 -22.928 -4.419 1.00 28.73 C ATOM 1976 OE1 GLU A 127 -0.601 -23.796 -5.270 1.00 28.78 O ATOM 1977 OE2 GLU A 127 -0.237 -21.868 -4.282 1.00 28.70 O ATOM 0 H GLU A 127 -5.555 -23.322 -5.271 1.00 29.84 H new ATOM 0 HA GLU A 127 -4.377 -24.311 -2.941 1.00 29.22 H new ATOM 0 HB2 GLU A 127 -3.410 -23.255 -5.174 1.00 28.76 H new ATOM 0 HB3 GLU A 127 -3.477 -21.751 -4.276 1.00 28.76 H new ATOM 0 HG2 GLU A 127 -1.957 -22.570 -2.603 1.00 28.80 H new ATOM 0 HG3 GLU A 127 -2.078 -24.215 -3.196 1.00 28.80 H new ATOM 1984 N ALA A 128 -5.616 -21.277 -2.623 1.00 27.36 N ATOM 1985 CA ALA A 128 -5.966 -20.265 -1.636 1.00 26.33 C ATOM 1986 C ALA A 128 -7.336 -20.521 -1.020 1.00 26.81 C ATOM 1987 O ALA A 128 -7.637 -20.017 0.057 1.00 26.28 O ATOM 1988 CB ALA A 128 -5.915 -18.880 -2.261 1.00 25.22 C ATOM 0 H ALA A 128 -5.928 -21.071 -3.572 1.00 27.36 H new ATOM 0 HA ALA A 128 -5.232 -20.321 -0.832 1.00 26.33 H new ATOM 0 HB1 ALA A 128 -6.179 -18.133 -1.512 1.00 25.22 H new ATOM 0 HB2 ALA A 128 -4.908 -18.684 -2.630 1.00 25.22 H new ATOM 0 HB3 ALA A 128 -6.621 -18.828 -3.089 1.00 25.22 H new ATOM 1994 N ASP A 129 -8.158 -21.312 -1.700 1.00 27.88 N ATOM 1995 CA ASP A 129 -9.500 -21.617 -1.214 1.00 28.48 C ATOM 1996 C ASP A 129 -9.447 -22.484 0.040 1.00 29.02 C ATOM 1997 O ASP A 129 -9.719 -23.684 -0.004 1.00 30.17 O ATOM 1998 CB ASP A 129 -10.318 -22.312 -2.298 1.00 29.57 C ATOM 1999 CG ASP A 129 -11.765 -22.488 -1.892 1.00 30.10 C ATOM 2000 OD1 ASP A 129 -12.380 -21.494 -1.445 1.00 30.12 O ATOM 2001 OD2 ASP A 129 -12.283 -23.617 -2.022 1.00 30.56 O ATOM 0 H ASP A 129 -7.920 -21.754 -2.588 1.00 27.88 H new ATOM 0 HA ASP A 129 -9.984 -20.674 -0.958 1.00 28.48 H new ATOM 0 HB2 ASP A 129 -10.268 -21.730 -3.219 1.00 29.57 H new ATOM 0 HB3 ASP A 129 -9.881 -23.287 -2.513 1.00 29.57 H new ATOM 2006 N PHE A 130 -9.095 -21.858 1.154 1.00 28.23 N ATOM 2007 CA PHE A 130 -8.993 -22.549 2.434 1.00 28.72 C ATOM 2008 C PHE A 130 -10.370 -22.914 2.983 1.00 29.48 C ATOM 2009 O PHE A 130 -10.561 -23.999 3.531 1.00 30.47 O ATOM 2010 CB PHE A 130 -8.245 -21.676 3.445 1.00 27.68 C ATOM 2011 CG PHE A 130 -6.844 -21.332 3.020 1.00 26.94 C ATOM 2012 CD1 PHE A 130 -5.892 -22.327 2.858 1.00 26.82 C ATOM 2013 CD2 PHE A 130 -6.479 -20.016 2.785 1.00 26.44 C ATOM 2014 CE1 PHE A 130 -4.602 -22.014 2.472 1.00 26.23 C ATOM 2015 CE2 PHE A 130 -5.191 -19.698 2.399 1.00 25.82 C ATOM 2016 CZ PHE A 130 -4.256 -20.697 2.228 1.00 25.72 C ATOM 0 H PHE A 130 -8.873 -20.863 1.198 1.00 28.23 H new ATOM 0 HA PHE A 130 -8.438 -23.473 2.271 1.00 28.72 H new ATOM 0 HB2 PHE A 130 -8.805 -20.754 3.602 1.00 27.68 H new ATOM 0 HB3 PHE A 130 -8.209 -22.194 4.403 1.00 27.68 H new ATOM 0 HD1 PHE A 130 -6.161 -23.358 3.035 1.00 26.82 H new ATOM 0 HD2 PHE A 130 -7.210 -19.230 2.905 1.00 26.44 H new ATOM 0 HE1 PHE A 130 -3.866 -22.796 2.361 1.00 26.23 H new ATOM 0 HE2 PHE A 130 -4.917 -18.667 2.231 1.00 25.82 H new ATOM 0 HZ PHE A 130 -3.255 -20.452 1.904 1.00 25.72 H new ATOM 2026 N ASP A 131 -11.327 -22.001 2.832 1.00 29.07 N ATOM 2027 CA ASP A 131 -12.683 -22.230 3.323 1.00 29.81 C ATOM 2028 C ASP A 131 -13.373 -23.312 2.503 1.00 31.01 C ATOM 2029 O ASP A 131 -14.491 -23.726 2.812 1.00 31.82 O ATOM 2030 CB ASP A 131 -13.516 -20.954 3.230 1.00 29.11 C ATOM 2031 CG ASP A 131 -12.685 -19.690 3.268 1.00 27.70 C ATOM 2032 OD1 ASP A 131 -12.062 -19.416 4.316 1.00 27.01 O ATOM 2033 OD2 ASP A 131 -12.660 -18.972 2.243 1.00 27.31 O ATOM 0 H ASP A 131 -11.189 -21.099 2.375 1.00 29.07 H new ATOM 0 HA ASP A 131 -12.605 -22.544 4.364 1.00 29.81 H new ATOM 0 HB2 ASP A 131 -14.094 -20.973 2.306 1.00 29.11 H new ATOM 0 HB3 ASP A 131 -14.231 -20.935 4.053 1.00 29.11 H new ATOM 2038 N GLY A 132 -12.691 -23.766 1.457 1.00 31.16 N ATOM 2039 CA GLY A 132 -13.247 -24.778 0.582 1.00 32.30 C ATOM 2040 C GLY A 132 -14.550 -24.355 -0.049 1.00 32.54 C ATOM 2041 O GLY A 132 -15.524 -25.107 -0.051 1.00 33.59 O ATOM 0 H GLY A 132 -11.757 -23.448 1.200 1.00 31.16 H new ATOM 0 HA2 GLY A 132 -12.527 -25.008 -0.203 1.00 32.30 H new ATOM 0 HA3 GLY A 132 -13.404 -25.695 1.149 1.00 32.30 H new ATOM 2045 N ASP A 133 -14.561 -23.145 -0.595 1.00 31.60 N ATOM 2046 CA ASP A 133 -15.733 -22.625 -1.262 1.00 31.81 C ATOM 2047 C ASP A 133 -15.435 -22.493 -2.738 1.00 31.80 C ATOM 2048 O ASP A 133 -14.280 -22.416 -3.150 1.00 31.29 O ATOM 2049 CB ASP A 133 -16.126 -21.240 -0.742 1.00 30.84 C ATOM 2050 CG ASP A 133 -15.682 -20.972 0.674 1.00 30.25 C ATOM 2051 OD1 ASP A 133 -16.059 -21.745 1.578 1.00 30.65 O ATOM 2052 OD2 ASP A 133 -14.952 -19.975 0.873 1.00 29.45 O ATOM 0 H ASP A 133 -13.764 -22.508 -0.585 1.00 31.60 H new ATOM 0 HA ASP A 133 -16.554 -23.316 -1.070 1.00 31.81 H new ATOM 0 HB2 ASP A 133 -15.697 -20.481 -1.397 1.00 30.84 H new ATOM 0 HB3 ASP A 133 -17.209 -21.135 -0.799 1.00 30.84 H new ATOM 2057 N GLY A 134 -16.480 -22.466 -3.523 1.00 32.44 N ATOM 2058 CA GLY A 134 -16.320 -22.297 -4.950 1.00 32.56 C ATOM 2059 C GLY A 134 -15.936 -20.871 -5.291 1.00 31.38 C ATOM 2060 O GLY A 134 -16.133 -20.421 -6.417 1.00 31.48 O ATOM 0 H GLY A 134 -17.445 -22.558 -3.205 1.00 32.44 H new ATOM 0 HA2 GLY A 134 -15.554 -22.981 -5.317 1.00 32.56 H new ATOM 0 HA3 GLY A 134 -17.249 -22.558 -5.457 1.00 32.56 H new ATOM 2064 N MET A 135 -15.393 -20.157 -4.301 1.00 30.31 N ATOM 2065 CA MET A 135 -14.992 -18.769 -4.482 1.00 29.12 C ATOM 2066 C MET A 135 -13.772 -18.423 -3.626 1.00 28.02 C ATOM 2067 O MET A 135 -13.520 -19.046 -2.585 1.00 28.13 O ATOM 2068 CB MET A 135 -16.162 -17.848 -4.131 1.00 28.97 C ATOM 2069 CG MET A 135 -16.864 -18.231 -2.838 1.00 29.26 C ATOM 2070 SD MET A 135 -18.637 -17.904 -2.886 1.00 30.55 S ATOM 2071 CE MET A 135 -19.153 -19.005 -4.201 1.00 31.50 C ATOM 0 H MET A 135 -15.223 -20.524 -3.365 1.00 30.31 H new ATOM 0 HA MET A 135 -14.714 -18.626 -5.526 1.00 29.12 H new ATOM 0 HB2 MET A 135 -15.797 -16.824 -4.048 1.00 28.97 H new ATOM 0 HB3 MET A 135 -16.885 -17.864 -4.947 1.00 28.97 H new ATOM 0 HG2 MET A 135 -16.699 -19.290 -2.640 1.00 29.26 H new ATOM 0 HG3 MET A 135 -16.419 -17.679 -2.010 1.00 29.26 H new ATOM 0 HE1 MET A 135 -20.171 -19.345 -4.012 1.00 31.50 H new ATOM 0 HE2 MET A 135 -19.118 -18.476 -5.153 1.00 31.50 H new ATOM 0 HE3 MET A 135 -18.484 -19.865 -4.239 1.00 31.50 H new ATOM 2081 N ILE A 136 -13.028 -17.411 -4.065 1.00 27.01 N ATOM 2082 CA ILE A 136 -11.831 -16.973 -3.356 1.00 25.91 C ATOM 2083 C ILE A 136 -12.127 -15.759 -2.487 1.00 24.90 C ATOM 2084 O ILE A 136 -12.641 -14.762 -2.969 1.00 24.54 O ATOM 2085 CB ILE A 136 -10.691 -16.603 -4.325 1.00 25.40 C ATOM 2086 CG1 ILE A 136 -10.386 -17.758 -5.278 1.00 26.49 C ATOM 2087 CG2 ILE A 136 -9.443 -16.217 -3.546 1.00 24.33 C ATOM 2088 CD1 ILE A 136 -9.344 -17.415 -6.321 1.00 26.17 C ATOM 0 H ILE A 136 -13.234 -16.879 -4.910 1.00 27.01 H new ATOM 0 HA ILE A 136 -11.517 -17.813 -2.736 1.00 25.91 H new ATOM 0 HB ILE A 136 -11.014 -15.749 -4.920 1.00 25.40 H new ATOM 0 HG12 ILE A 136 -10.043 -18.616 -4.700 1.00 26.49 H new ATOM 0 HG13 ILE A 136 -11.306 -18.059 -5.779 1.00 26.49 H new ATOM 0 HG21 ILE A 136 -8.645 -15.958 -4.242 1.00 24.33 H new ATOM 0 HG22 ILE A 136 -9.662 -15.360 -2.910 1.00 24.33 H new ATOM 0 HG23 ILE A 136 -9.126 -17.057 -2.927 1.00 24.33 H new ATOM 0 HD11 ILE A 136 -9.175 -18.279 -6.964 1.00 26.17 H new ATOM 0 HD12 ILE A 136 -9.694 -16.577 -6.923 1.00 26.17 H new ATOM 0 HD13 ILE A 136 -8.411 -17.142 -5.827 1.00 26.17 H new ATOM 2100 N ASN A 137 -11.777 -15.833 -1.213 1.00 24.49 N ATOM 2101 CA ASN A 137 -12.015 -14.726 -0.303 1.00 23.59 C ATOM 2102 C ASN A 137 -10.831 -13.775 -0.334 1.00 22.27 C ATOM 2103 O ASN A 137 -9.704 -14.198 -0.576 1.00 22.13 O ATOM 2104 CB ASN A 137 -12.253 -15.244 1.119 1.00 23.94 C ATOM 2105 CG ASN A 137 -12.667 -14.152 2.090 1.00 23.25 C ATOM 2106 OD1 ASN A 137 -12.281 -12.994 1.952 1.00 22.19 O ATOM 2107 ND2 ASN A 137 -13.459 -14.519 3.086 1.00 23.92 N ATOM 0 H ASN A 137 -11.329 -16.645 -0.788 1.00 24.49 H new ATOM 0 HA ASN A 137 -12.908 -14.189 -0.622 1.00 23.59 H new ATOM 0 HB2 ASN A 137 -13.026 -16.012 1.095 1.00 23.94 H new ATOM 0 HB3 ASN A 137 -11.342 -15.719 1.483 1.00 23.94 H new ATOM 0 HD21 ASN A 137 -13.769 -13.830 3.771 1.00 23.92 H new ATOM 0 HD22 ASN A 137 -13.759 -15.490 3.168 1.00 23.92 H new ATOM 2114 N TYR A 138 -11.094 -12.492 -0.119 1.00 21.38 N ATOM 2115 CA TYR A 138 -10.046 -11.480 -0.123 1.00 20.08 C ATOM 2116 C TYR A 138 -8.767 -11.996 0.528 1.00 19.79 C ATOM 2117 O TYR A 138 -7.676 -11.773 0.015 1.00 19.22 O ATOM 2118 CB TYR A 138 -10.533 -10.223 0.595 1.00 19.28 C ATOM 2119 CG TYR A 138 -9.458 -9.180 0.795 1.00 17.91 C ATOM 2120 CD1 TYR A 138 -8.998 -8.410 -0.267 1.00 17.42 C ATOM 2121 CD2 TYR A 138 -8.908 -8.962 2.052 1.00 17.16 C ATOM 2122 CE1 TYR A 138 -8.020 -7.453 -0.080 1.00 16.17 C ATOM 2123 CE2 TYR A 138 -7.928 -8.009 2.245 1.00 15.93 C ATOM 2124 CZ TYR A 138 -7.488 -7.257 1.179 1.00 15.40 C ATOM 2125 OH TYR A 138 -6.514 -6.304 1.372 1.00 14.17 O ATOM 0 H TYR A 138 -12.029 -12.127 0.061 1.00 21.38 H new ATOM 0 HA TYR A 138 -9.816 -11.238 -1.161 1.00 20.08 H new ATOM 0 HB2 TYR A 138 -11.351 -9.784 0.024 1.00 19.28 H new ATOM 0 HB3 TYR A 138 -10.938 -10.505 1.567 1.00 19.28 H new ATOM 0 HD1 TYR A 138 -9.412 -8.562 -1.253 1.00 17.42 H new ATOM 0 HD2 TYR A 138 -9.253 -9.547 2.892 1.00 17.16 H new ATOM 0 HE1 TYR A 138 -7.673 -6.861 -0.914 1.00 16.17 H new ATOM 0 HE2 TYR A 138 -7.508 -7.854 3.228 1.00 15.93 H new ATOM 0 HH TYR A 138 -6.249 -6.294 2.315 1.00 14.17 H new ATOM 2135 N GLU A 139 -8.917 -12.702 1.643 1.00 20.30 N ATOM 2136 CA GLU A 139 -7.771 -13.246 2.373 1.00 20.23 C ATOM 2137 C GLU A 139 -7.004 -14.274 1.544 1.00 20.87 C ATOM 2138 O GLU A 139 -5.771 -14.272 1.512 1.00 20.48 O ATOM 2139 CB GLU A 139 -8.246 -13.894 3.671 1.00 20.94 C ATOM 2140 CG GLU A 139 -9.353 -14.919 3.474 1.00 22.25 C ATOM 2141 CD GLU A 139 -9.821 -15.530 4.780 1.00 22.99 C ATOM 2142 OE1 GLU A 139 -10.746 -14.966 5.401 1.00 23.36 O ATOM 2143 OE2 GLU A 139 -9.260 -16.571 5.183 1.00 23.27 O ATOM 0 H GLU A 139 -9.822 -12.913 2.064 1.00 20.30 H new ATOM 0 HA GLU A 139 -7.096 -12.418 2.591 1.00 20.23 H new ATOM 0 HB2 GLU A 139 -7.398 -14.377 4.157 1.00 20.94 H new ATOM 0 HB3 GLU A 139 -8.600 -13.116 4.347 1.00 20.94 H new ATOM 0 HG2 GLU A 139 -10.198 -14.444 2.976 1.00 22.25 H new ATOM 0 HG3 GLU A 139 -8.997 -15.710 2.814 1.00 22.25 H new ATOM 2150 N GLU A 140 -7.744 -15.135 0.865 1.00 21.93 N ATOM 2151 CA GLU A 140 -7.150 -16.187 0.052 1.00 22.74 C ATOM 2152 C GLU A 140 -6.476 -15.604 -1.180 1.00 22.24 C ATOM 2153 O GLU A 140 -5.333 -15.932 -1.497 1.00 22.29 O ATOM 2154 CB GLU A 140 -8.228 -17.170 -0.391 1.00 24.01 C ATOM 2155 CG GLU A 140 -9.173 -17.608 0.716 1.00 24.56 C ATOM 2156 CD GLU A 140 -10.227 -18.583 0.218 1.00 25.83 C ATOM 2157 OE1 GLU A 140 -10.680 -18.437 -0.935 1.00 26.40 O ATOM 2158 OE2 GLU A 140 -10.609 -19.486 0.988 1.00 26.30 O ATOM 0 H GLU A 140 -8.764 -15.127 0.860 1.00 21.93 H new ATOM 0 HA GLU A 140 -6.402 -16.700 0.656 1.00 22.74 H new ATOM 0 HB2 GLU A 140 -8.812 -16.714 -1.191 1.00 24.01 H new ATOM 0 HB3 GLU A 140 -7.747 -18.053 -0.811 1.00 24.01 H new ATOM 0 HG2 GLU A 140 -8.600 -18.073 1.518 1.00 24.56 H new ATOM 0 HG3 GLU A 140 -9.663 -16.732 1.141 1.00 24.56 H new ATOM 2165 N PHE A 141 -7.203 -14.737 -1.865 1.00 21.88 N ATOM 2166 CA PHE A 141 -6.714 -14.103 -3.078 1.00 21.51 C ATOM 2167 C PHE A 141 -5.456 -13.281 -2.807 1.00 20.36 C ATOM 2168 O PHE A 141 -4.432 -13.462 -3.467 1.00 20.46 O ATOM 2169 CB PHE A 141 -7.820 -13.222 -3.666 1.00 21.36 C ATOM 2170 CG PHE A 141 -7.357 -12.293 -4.747 1.00 20.89 C ATOM 2171 CD1 PHE A 141 -7.201 -12.741 -6.046 1.00 20.72 C ATOM 2172 CD2 PHE A 141 -7.083 -10.970 -4.457 1.00 20.72 C ATOM 2173 CE1 PHE A 141 -6.780 -11.880 -7.042 1.00 20.40 C ATOM 2174 CE2 PHE A 141 -6.660 -10.104 -5.446 1.00 20.40 C ATOM 2175 CZ PHE A 141 -6.508 -10.560 -6.739 1.00 20.24 C ATOM 0 H PHE A 141 -8.146 -14.454 -1.597 1.00 21.88 H new ATOM 0 HA PHE A 141 -6.445 -14.878 -3.796 1.00 21.51 H new ATOM 0 HB2 PHE A 141 -8.606 -13.863 -4.066 1.00 21.36 H new ATOM 0 HB3 PHE A 141 -8.266 -12.634 -2.864 1.00 21.36 H new ATOM 0 HD1 PHE A 141 -7.410 -13.773 -6.285 1.00 20.72 H new ATOM 0 HD2 PHE A 141 -7.201 -10.609 -3.446 1.00 20.72 H new ATOM 0 HE1 PHE A 141 -6.664 -12.238 -8.054 1.00 20.40 H new ATOM 0 HE2 PHE A 141 -6.449 -9.072 -5.208 1.00 20.40 H new ATOM 0 HZ PHE A 141 -6.176 -9.885 -7.514 1.00 20.24 H new ATOM 2185 N VAL A 142 -5.541 -12.377 -1.838 1.00 19.36 N ATOM 2186 CA VAL A 142 -4.406 -11.522 -1.492 1.00 18.22 C ATOM 2187 C VAL A 142 -3.180 -12.344 -1.136 1.00 18.56 C ATOM 2188 O VAL A 142 -2.050 -11.949 -1.421 1.00 18.08 O ATOM 2189 CB VAL A 142 -4.716 -10.570 -0.320 1.00 17.23 C ATOM 2190 CG1 VAL A 142 -5.053 -11.336 0.945 1.00 17.77 C ATOM 2191 CG2 VAL A 142 -3.535 -9.647 -0.086 1.00 16.07 C ATOM 0 H VAL A 142 -6.379 -12.216 -1.279 1.00 19.36 H new ATOM 0 HA VAL A 142 -4.207 -10.925 -2.382 1.00 18.22 H new ATOM 0 HB VAL A 142 -5.591 -9.976 -0.583 1.00 17.23 H new ATOM 0 HG11 VAL A 142 -5.266 -10.633 1.750 1.00 17.77 H new ATOM 0 HG12 VAL A 142 -5.928 -11.962 0.769 1.00 17.77 H new ATOM 0 HG13 VAL A 142 -4.208 -11.964 1.226 1.00 17.77 H new ATOM 0 HG21 VAL A 142 -3.757 -8.975 0.743 1.00 16.07 H new ATOM 0 HG22 VAL A 142 -2.652 -10.240 0.154 1.00 16.07 H new ATOM 0 HG23 VAL A 142 -3.346 -9.062 -0.986 1.00 16.07 H new ATOM 2201 N TRP A 143 -3.411 -13.493 -0.518 1.00 19.50 N ATOM 2202 CA TRP A 143 -2.326 -14.376 -0.130 1.00 20.05 C ATOM 2203 C TRP A 143 -1.553 -14.817 -1.361 1.00 20.61 C ATOM 2204 O TRP A 143 -0.327 -14.729 -1.423 1.00 20.44 O ATOM 2205 CB TRP A 143 -2.885 -15.610 0.585 1.00 21.15 C ATOM 2206 CG TRP A 143 -1.973 -16.793 0.497 1.00 22.13 C ATOM 2207 CD1 TRP A 143 -0.933 -17.059 1.315 1.00 22.20 C ATOM 2208 CD2 TRP A 143 -1.999 -17.844 -0.476 1.00 23.25 C ATOM 2209 NE1 TRP A 143 -0.306 -18.221 0.931 1.00 23.30 N ATOM 2210 CE2 TRP A 143 -0.942 -18.718 -0.168 1.00 23.94 C ATOM 2211 CE3 TRP A 143 -2.811 -18.135 -1.570 1.00 23.82 C ATOM 2212 CZ2 TRP A 143 -0.675 -19.856 -0.916 1.00 25.11 C ATOM 2213 CZ3 TRP A 143 -2.543 -19.265 -2.315 1.00 24.98 C ATOM 2214 CH2 TRP A 143 -1.483 -20.112 -1.983 1.00 25.59 C ATOM 0 H TRP A 143 -4.341 -13.834 -0.275 1.00 19.50 H new ATOM 0 HA TRP A 143 -1.660 -13.838 0.544 1.00 20.05 H new ATOM 0 HB2 TRP A 143 -3.060 -15.369 1.634 1.00 21.15 H new ATOM 0 HB3 TRP A 143 -3.851 -15.869 0.152 1.00 21.15 H new ATOM 0 HD1 TRP A 143 -0.635 -16.446 2.153 1.00 22.20 H new ATOM 0 HE1 TRP A 143 0.501 -18.641 1.392 1.00 23.30 H new ATOM 0 HE3 TRP A 143 -3.635 -17.488 -1.830 1.00 23.82 H new ATOM 0 HZ2 TRP A 143 0.143 -20.514 -0.662 1.00 25.11 H new ATOM 0 HZ3 TRP A 143 -3.163 -19.498 -3.168 1.00 24.98 H new ATOM 0 HH2 TRP A 143 -1.300 -20.989 -2.585 1.00 25.59 H new ATOM 2225 N MET A 144 -2.308 -15.292 -2.328 1.00 21.37 N ATOM 2226 CA MET A 144 -1.773 -15.799 -3.577 1.00 22.12 C ATOM 2227 C MET A 144 -0.841 -14.809 -4.272 1.00 21.40 C ATOM 2228 O MET A 144 0.308 -15.135 -4.570 1.00 21.75 O ATOM 2229 CB MET A 144 -2.955 -16.144 -4.464 1.00 22.89 C ATOM 2230 CG MET A 144 -2.586 -16.503 -5.892 1.00 23.65 C ATOM 2231 SD MET A 144 -4.032 -16.725 -6.943 1.00 23.25 S ATOM 2232 CE MET A 144 -4.927 -15.209 -6.617 1.00 22.97 C ATOM 0 H MET A 144 -3.325 -15.338 -2.270 1.00 21.37 H new ATOM 0 HA MET A 144 -1.160 -16.677 -3.374 1.00 22.12 H new ATOM 0 HB2 MET A 144 -3.494 -16.981 -4.020 1.00 22.89 H new ATOM 0 HB3 MET A 144 -3.640 -15.296 -4.481 1.00 22.89 H new ATOM 0 HG2 MET A 144 -1.955 -15.718 -6.309 1.00 23.65 H new ATOM 0 HG3 MET A 144 -1.997 -17.420 -5.892 1.00 23.65 H new ATOM 0 HE1 MET A 144 -5.432 -14.882 -7.526 1.00 22.97 H new ATOM 0 HE2 MET A 144 -5.665 -15.383 -5.834 1.00 22.97 H new ATOM 0 HE3 MET A 144 -4.229 -14.437 -6.292 1.00 22.97 H new ATOM 2242 N ILE A 145 -1.336 -13.606 -4.529 1.00 20.47 N ATOM 2243 CA ILE A 145 -0.541 -12.582 -5.198 1.00 19.79 C ATOM 2244 C ILE A 145 0.565 -12.054 -4.291 1.00 18.96 C ATOM 2245 O ILE A 145 1.491 -11.387 -4.751 1.00 18.60 O ATOM 2246 CB ILE A 145 -1.419 -11.408 -5.663 1.00 19.06 C ATOM 2247 CG1 ILE A 145 -2.148 -10.797 -4.466 1.00 18.09 C ATOM 2248 CG2 ILE A 145 -2.407 -11.877 -6.722 1.00 20.01 C ATOM 2249 CD1 ILE A 145 -3.051 -9.638 -4.828 1.00 17.41 C ATOM 0 H ILE A 145 -2.283 -13.314 -4.285 1.00 20.47 H new ATOM 0 HA ILE A 145 -0.088 -13.055 -6.069 1.00 19.79 H new ATOM 0 HB ILE A 145 -0.785 -10.641 -6.108 1.00 19.06 H new ATOM 0 HG12 ILE A 145 -2.743 -11.571 -3.981 1.00 18.09 H new ATOM 0 HG13 ILE A 145 -1.411 -10.458 -3.738 1.00 18.09 H new ATOM 0 HG21 ILE A 145 -3.023 -11.037 -7.043 1.00 20.01 H new ATOM 0 HG22 ILE A 145 -1.862 -12.275 -7.578 1.00 20.01 H new ATOM 0 HG23 ILE A 145 -3.045 -12.656 -6.305 1.00 20.01 H new ATOM 0 HD11 ILE A 145 -3.533 -9.257 -3.928 1.00 17.41 H new ATOM 0 HD12 ILE A 145 -2.459 -8.845 -5.286 1.00 17.41 H new ATOM 0 HD13 ILE A 145 -3.812 -9.975 -5.532 1.00 17.41 H new ATOM 2261 N SER A 146 0.463 -12.355 -3.000 1.00 18.76 N ATOM 2262 CA SER A 146 1.458 -11.907 -2.032 1.00 18.09 C ATOM 2263 C SER A 146 2.717 -12.764 -2.114 1.00 18.99 C ATOM 2264 O SER A 146 3.675 -12.552 -1.368 1.00 18.73 O ATOM 2265 CB SER A 146 0.885 -11.951 -0.614 1.00 17.78 C ATOM 2266 OG SER A 146 1.808 -11.430 0.325 1.00 17.22 O ATOM 0 H SER A 146 -0.297 -12.906 -2.601 1.00 18.76 H new ATOM 0 HA SER A 146 1.723 -10.877 -2.272 1.00 18.09 H new ATOM 0 HB2 SER A 146 -0.041 -11.378 -0.575 1.00 17.78 H new ATOM 0 HB3 SER A 146 0.635 -12.979 -0.351 1.00 17.78 H new ATOM 0 HG SER A 146 2.073 -12.137 0.950 1.00 17.22 H new ATOM 2272 N GLN A 147 2.710 -13.733 -3.026 1.00 20.13 N ATOM 2273 CA GLN A 147 3.853 -14.616 -3.214 1.00 21.14 C ATOM 2274 C GLN A 147 4.118 -14.835 -4.698 1.00 21.86 C ATOM 2275 O GLN A 147 5.237 -14.650 -5.175 1.00 22.11 O ATOM 2276 CB GLN A 147 3.616 -15.963 -2.532 1.00 22.13 C ATOM 2277 CG GLN A 147 2.716 -15.885 -1.312 1.00 21.65 C ATOM 2278 CD GLN A 147 2.797 -17.128 -0.461 1.00 22.67 C ATOM 2279 OE1 GLN A 147 3.612 -17.218 0.457 1.00 22.79 O ATOM 2280 NE2 GLN A 147 1.950 -18.097 -0.767 1.00 23.48 N ATOM 0 H GLN A 147 1.923 -13.925 -3.646 1.00 20.13 H new ATOM 0 HA GLN A 147 4.723 -14.140 -2.761 1.00 21.14 H new ATOM 0 HB2 GLN A 147 3.175 -16.652 -3.253 1.00 22.13 H new ATOM 0 HB3 GLN A 147 4.577 -16.383 -2.236 1.00 22.13 H new ATOM 0 HG2 GLN A 147 2.994 -15.018 -0.713 1.00 21.65 H new ATOM 0 HG3 GLN A 147 1.685 -15.733 -1.633 1.00 21.65 H new ATOM 0 HE21 GLN A 147 1.293 -17.975 -1.537 1.00 23.48 H new ATOM 0 HE22 GLN A 147 1.954 -18.966 -0.233 1.00 23.48 H new ATOM 2289 N LYS A 148 3.077 -15.230 -5.422 1.00 22.30 N ATOM 2290 CA LYS A 148 3.190 -15.479 -6.853 1.00 23.11 C ATOM 2291 C LYS A 148 3.001 -14.191 -7.650 1.00 22.36 C ATOM 2292 O LYS A 148 1.844 -13.878 -8.004 1.00 22.12 O ATOM 2293 CB LYS A 148 2.161 -16.525 -7.285 1.00 24.04 C ATOM 2294 CG LYS A 148 2.471 -17.922 -6.774 1.00 24.96 C ATOM 2295 CD LYS A 148 1.241 -18.814 -6.799 1.00 25.58 C ATOM 2296 CE LYS A 148 0.294 -18.482 -5.658 1.00 25.71 C ATOM 2297 NZ LYS A 148 -0.915 -19.350 -5.670 1.00 26.17 N ATOM 2298 OXT LYS A 148 4.012 -13.505 -7.911 1.00 22.11 O ATOM 0 H LYS A 148 2.144 -15.385 -5.040 1.00 22.30 H new ATOM 0 HA LYS A 148 4.191 -15.858 -7.057 1.00 23.11 H new ATOM 0 HB2 LYS A 148 1.176 -16.225 -6.927 1.00 24.04 H new ATOM 0 HB3 LYS A 148 2.111 -16.547 -8.374 1.00 24.04 H new ATOM 0 HG2 LYS A 148 3.256 -18.367 -7.385 1.00 24.96 H new ATOM 0 HG3 LYS A 148 2.856 -17.860 -5.756 1.00 24.96 H new ATOM 0 HD2 LYS A 148 0.723 -18.696 -7.751 1.00 25.58 H new ATOM 0 HD3 LYS A 148 1.545 -19.858 -6.730 1.00 25.58 H new ATOM 0 HE2 LYS A 148 0.815 -18.599 -4.708 1.00 25.71 H new ATOM 0 HE3 LYS A 148 -0.008 -17.437 -5.729 1.00 25.71 H new ATOM 0 HZ1 LYS A 148 -1.596 -19.006 -4.964 1.00 26.17 H new ATOM 0 HZ2 LYS A 148 -1.352 -19.324 -6.614 1.00 26.17 H new ATOM 0 HZ3 LYS A 148 -0.643 -20.327 -5.441 1.00 26.17 H new