USER MOD reduce.3.24.130724 H: found=0, std=0, add=782, rem=0, adj=23 USER MOD reduce.3.24.130724 removed 780 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 87 SER OG : rot 180:sc= -0.0278 USER MOD Set 1.2: A 91 HIS : no HD1:sc= -1.44 K(o=-1.5,f=-0.53) USER MOD Single : A 1 GLY N :NH3+ 172:sc= 0 (180deg=-0.0869) USER MOD Single : A 2 SER OG : rot 180:sc= 0 USER MOD Single : A 3 SER OG : rot 180:sc= -0.0313 USER MOD Single : A 5 SER OG : rot 180:sc= 0 USER MOD Single : A 6 SER OG : rot 180:sc= 0 USER MOD Single : A 8 SER OG : rot 180:sc= 0 USER MOD Single : A 9 SER OG : rot 180:sc= 0 USER MOD Single : A 12 SER OG : rot 180:sc= -0.301 USER MOD Single : A 14 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 16 SER OG : rot 180:sc= 0.0728 USER MOD Single : A 19 THR OG1 : rot 180:sc= 0 USER MOD Single : A 20 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 22 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 23 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 25 THR OG1 : rot -41:sc= -0.836 USER MOD Single : A 29 GLN : amide:sc= -1.85 K(o=-1.8,f=-1.2) USER MOD Single : A 35 CYS SG : rot 180:sc= 0 USER MOD Single : A 38 GLN : amide:sc= -1.22 K(o=-1.2,f=-0.65) USER MOD Single : A 44 MET CE :methyl 178:sc= -1.77 (180deg=-1.81) USER MOD Single : A 46 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 49 ASN : amide:sc= -0.467 X(o=-0.47,f=-0.94) USER MOD Single : A 61 GLN : amide:sc= 0 X(o=0,f=-0.031) USER MOD Single : A 65 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 76 LYS NZ :NH3+ -168:sc= 0.105 (180deg=0.00349) USER MOD Single : A 77 SER OG : rot 180:sc= 0 USER MOD Single : A 78 GLN : amide:sc= -0.0523 X(o=-0.052,f=0) USER MOD Single : A 81 SER OG : rot 178:sc= -0.996 USER MOD Single : A 82 GLN : amide:sc= -1.19 K(o=-1.2,f=-0.36) USER MOD Single : A 83 THR OG1 : rot 99:sc= 0.871 USER MOD Single : A 89 TYR OH : rot 180:sc= 0 USER MOD Single : A 90 SER OG : rot 180:sc= 0 USER MOD Single : A 97 SER OG : rot 180:sc= 0 USER MOD Single : A 100 SER OG : rot 100:sc= 0.235 USER MOD Single : A 101 SER OG : rot -51:sc= 0.809 USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 1 0.790 37.120 -1.094 1.00 0.00 N ATOM 2 CA GLY A 1 0.882 35.964 -2.027 1.00 0.00 C ATOM 3 C GLY A 1 2.187 35.205 -1.882 1.00 0.00 C ATOM 4 O GLY A 1 2.729 34.698 -2.864 1.00 0.00 O ATOM 0 H1 GLY A 1 -0.053 37.684 -1.322 1.00 0.00 H new ATOM 0 H2 GLY A 1 0.720 36.772 -0.116 1.00 0.00 H new ATOM 0 H3 GLY A 1 1.639 37.712 -1.190 1.00 0.00 H new ATOM 0 HA2 GLY A 1 0.048 35.286 -1.844 1.00 0.00 H new ATOM 0 HA3 GLY A 1 0.784 36.320 -3.053 1.00 0.00 H new ATOM 10 N SER A 2 2.692 35.128 -0.656 1.00 0.00 N ATOM 11 CA SER A 2 3.941 34.426 -0.386 1.00 0.00 C ATOM 12 C SER A 2 3.696 33.189 0.472 1.00 0.00 C ATOM 13 O SER A 2 3.001 33.253 1.486 1.00 0.00 O ATOM 14 CB SER A 2 4.933 35.358 0.313 1.00 0.00 C ATOM 15 OG SER A 2 4.381 35.889 1.505 1.00 0.00 O ATOM 0 H SER A 2 2.255 35.543 0.167 1.00 0.00 H new ATOM 0 HA SER A 2 4.363 34.107 -1.339 1.00 0.00 H new ATOM 0 HB2 SER A 2 5.848 34.813 0.544 1.00 0.00 H new ATOM 0 HB3 SER A 2 5.207 36.172 -0.358 1.00 0.00 H new ATOM 0 HG SER A 2 5.035 36.480 1.934 1.00 0.00 H new ATOM 21 N SER A 3 4.271 32.065 0.058 1.00 0.00 N ATOM 22 CA SER A 3 4.114 30.812 0.789 1.00 0.00 C ATOM 23 C SER A 3 2.646 30.406 0.866 1.00 0.00 C ATOM 24 O SER A 3 1.761 31.167 0.475 1.00 0.00 O ATOM 25 CB SER A 3 4.694 30.945 2.198 1.00 0.00 C ATOM 26 OG SER A 3 4.848 29.675 2.809 1.00 0.00 O ATOM 0 H SER A 3 4.850 31.995 -0.779 1.00 0.00 H new ATOM 0 HA SER A 3 4.658 30.035 0.251 1.00 0.00 H new ATOM 0 HB2 SER A 3 5.659 31.449 2.151 1.00 0.00 H new ATOM 0 HB3 SER A 3 4.039 31.568 2.807 1.00 0.00 H new ATOM 0 HG SER A 3 5.222 29.788 3.708 1.00 0.00 H new ATOM 32 N GLY A 4 2.396 29.204 1.372 1.00 0.00 N ATOM 33 CA GLY A 4 1.034 28.718 1.491 1.00 0.00 C ATOM 34 C GLY A 4 0.546 28.705 2.926 1.00 0.00 C ATOM 35 O GLY A 4 0.789 29.646 3.680 1.00 0.00 O ATOM 0 H GLY A 4 3.112 28.557 1.702 1.00 0.00 H new ATOM 0 HA2 GLY A 4 0.374 29.345 0.892 1.00 0.00 H new ATOM 0 HA3 GLY A 4 0.974 27.710 1.081 1.00 0.00 H new ATOM 39 N SER A 5 -0.145 27.634 3.304 1.00 0.00 N ATOM 40 CA SER A 5 -0.668 27.501 4.659 1.00 0.00 C ATOM 41 C SER A 5 -0.862 26.034 5.027 1.00 0.00 C ATOM 42 O SER A 5 -0.471 25.598 6.110 1.00 0.00 O ATOM 43 CB SER A 5 -1.994 28.251 4.791 1.00 0.00 C ATOM 44 OG SER A 5 -2.689 27.857 5.962 1.00 0.00 O ATOM 0 H SER A 5 -0.356 26.846 2.691 1.00 0.00 H new ATOM 0 HA SER A 5 0.058 27.936 5.346 1.00 0.00 H new ATOM 0 HB2 SER A 5 -1.807 29.324 4.819 1.00 0.00 H new ATOM 0 HB3 SER A 5 -2.613 28.058 3.915 1.00 0.00 H new ATOM 0 HG SER A 5 -3.533 28.352 6.024 1.00 0.00 H new ATOM 50 N SER A 6 -1.465 25.276 4.117 1.00 0.00 N ATOM 51 CA SER A 6 -1.711 23.856 4.346 1.00 0.00 C ATOM 52 C SER A 6 -2.602 23.648 5.566 1.00 0.00 C ATOM 53 O SER A 6 -2.121 23.599 6.698 1.00 0.00 O ATOM 54 CB SER A 6 -0.387 23.112 4.535 1.00 0.00 C ATOM 55 OG SER A 6 0.091 22.603 3.302 1.00 0.00 O ATOM 0 H SER A 6 -1.792 25.621 3.215 1.00 0.00 H new ATOM 0 HA SER A 6 -2.224 23.456 3.471 1.00 0.00 H new ATOM 0 HB2 SER A 6 0.354 23.785 4.966 1.00 0.00 H new ATOM 0 HB3 SER A 6 -0.524 22.294 5.242 1.00 0.00 H new ATOM 0 HG SER A 6 0.939 22.133 3.448 1.00 0.00 H new ATOM 61 N GLY A 7 -3.904 23.525 5.327 1.00 0.00 N ATOM 62 CA GLY A 7 -4.843 23.323 6.416 1.00 0.00 C ATOM 63 C GLY A 7 -5.540 21.980 6.338 1.00 0.00 C ATOM 64 O GLY A 7 -5.802 21.349 7.362 1.00 0.00 O ATOM 0 H GLY A 7 -4.326 23.562 4.399 1.00 0.00 H new ATOM 0 HA2 GLY A 7 -4.315 23.400 7.366 1.00 0.00 H new ATOM 0 HA3 GLY A 7 -5.589 24.118 6.401 1.00 0.00 H new ATOM 68 N SER A 8 -5.841 21.542 5.120 1.00 0.00 N ATOM 69 CA SER A 8 -6.513 20.264 4.912 1.00 0.00 C ATOM 70 C SER A 8 -5.924 19.529 3.713 1.00 0.00 C ATOM 71 O SER A 8 -5.942 20.036 2.591 1.00 0.00 O ATOM 72 CB SER A 8 -8.014 20.480 4.708 1.00 0.00 C ATOM 73 OG SER A 8 -8.768 19.471 5.357 1.00 0.00 O ATOM 0 H SER A 8 -5.631 22.053 4.262 1.00 0.00 H new ATOM 0 HA SER A 8 -6.360 19.652 5.801 1.00 0.00 H new ATOM 0 HB2 SER A 8 -8.300 21.458 5.096 1.00 0.00 H new ATOM 0 HB3 SER A 8 -8.243 20.480 3.642 1.00 0.00 H new ATOM 0 HG SER A 8 -9.724 19.633 5.213 1.00 0.00 H new ATOM 79 N SER A 9 -5.404 18.330 3.956 1.00 0.00 N ATOM 80 CA SER A 9 -4.811 17.525 2.896 1.00 0.00 C ATOM 81 C SER A 9 -4.827 16.044 3.264 1.00 0.00 C ATOM 82 O SER A 9 -5.221 15.200 2.460 1.00 0.00 O ATOM 83 CB SER A 9 -3.375 17.978 2.625 1.00 0.00 C ATOM 84 OG SER A 9 -2.628 18.052 3.827 1.00 0.00 O ATOM 0 H SER A 9 -5.382 17.895 4.878 1.00 0.00 H new ATOM 0 HA SER A 9 -5.406 17.664 1.993 1.00 0.00 H new ATOM 0 HB2 SER A 9 -2.895 17.282 1.937 1.00 0.00 H new ATOM 0 HB3 SER A 9 -3.384 18.953 2.138 1.00 0.00 H new ATOM 0 HG SER A 9 -1.714 18.342 3.627 1.00 0.00 H new ATOM 90 N ALA A 10 -4.398 15.739 4.484 1.00 0.00 N ATOM 91 CA ALA A 10 -4.363 14.361 4.958 1.00 0.00 C ATOM 92 C ALA A 10 -4.770 14.275 6.425 1.00 0.00 C ATOM 93 O ALA A 10 -4.254 15.009 7.267 1.00 0.00 O ATOM 94 CB ALA A 10 -2.976 13.768 4.758 1.00 0.00 C ATOM 0 H ALA A 10 -4.070 16.427 5.162 1.00 0.00 H new ATOM 0 HA ALA A 10 -5.080 13.784 4.374 1.00 0.00 H new ATOM 0 HB1 ALA A 10 -2.965 12.739 5.117 1.00 0.00 H new ATOM 0 HB2 ALA A 10 -2.722 13.786 3.698 1.00 0.00 H new ATOM 0 HB3 ALA A 10 -2.246 14.354 5.316 1.00 0.00 H new ATOM 100 N LEU A 11 -5.700 13.373 6.725 1.00 0.00 N ATOM 101 CA LEU A 11 -6.178 13.192 8.090 1.00 0.00 C ATOM 102 C LEU A 11 -6.805 14.476 8.623 1.00 0.00 C ATOM 103 O LEU A 11 -6.141 15.276 9.283 1.00 0.00 O ATOM 104 CB LEU A 11 -5.028 12.754 9.001 1.00 0.00 C ATOM 105 CG LEU A 11 -4.858 11.242 9.149 1.00 0.00 C ATOM 106 CD1 LEU A 11 -4.419 10.623 7.830 1.00 0.00 C ATOM 107 CD2 LEU A 11 -3.857 10.923 10.248 1.00 0.00 C ATOM 0 H LEU A 11 -6.137 12.756 6.040 1.00 0.00 H new ATOM 0 HA LEU A 11 -6.942 12.414 8.081 1.00 0.00 H new ATOM 0 HB2 LEU A 11 -4.099 13.172 8.614 1.00 0.00 H new ATOM 0 HB3 LEU A 11 -5.184 13.185 9.990 1.00 0.00 H new ATOM 0 HG LEU A 11 -5.821 10.813 9.426 1.00 0.00 H new ATOM 0 HD11 LEU A 11 -4.303 9.546 7.954 1.00 0.00 H new ATOM 0 HD12 LEU A 11 -5.171 10.821 7.067 1.00 0.00 H new ATOM 0 HD13 LEU A 11 -3.468 11.057 7.523 1.00 0.00 H new ATOM 0 HD21 LEU A 11 -3.749 9.842 10.339 1.00 0.00 H new ATOM 0 HD22 LEU A 11 -2.892 11.365 10.000 1.00 0.00 H new ATOM 0 HD23 LEU A 11 -4.212 11.333 11.194 1.00 0.00 H new ATOM 119 N SER A 12 -8.088 14.666 8.332 1.00 0.00 N ATOM 120 CA SER A 12 -8.804 15.854 8.780 1.00 0.00 C ATOM 121 C SER A 12 -10.211 15.495 9.249 1.00 0.00 C ATOM 122 O SER A 12 -10.589 15.778 10.386 1.00 0.00 O ATOM 123 CB SER A 12 -8.878 16.887 7.655 1.00 0.00 C ATOM 124 OG SER A 12 -9.594 16.379 6.542 1.00 0.00 O ATOM 0 H SER A 12 -8.652 14.013 7.788 1.00 0.00 H new ATOM 0 HA SER A 12 -8.257 16.282 9.620 1.00 0.00 H new ATOM 0 HB2 SER A 12 -9.362 17.793 8.020 1.00 0.00 H new ATOM 0 HB3 SER A 12 -7.871 17.166 7.347 1.00 0.00 H new ATOM 0 HG SER A 12 -9.629 17.059 5.837 1.00 0.00 H new ATOM 130 N ARG A 13 -10.982 14.870 8.366 1.00 0.00 N ATOM 131 CA ARG A 13 -12.348 14.472 8.689 1.00 0.00 C ATOM 132 C ARG A 13 -12.904 13.526 7.629 1.00 0.00 C ATOM 133 O ARG A 13 -13.541 12.523 7.952 1.00 0.00 O ATOM 134 CB ARG A 13 -13.244 15.705 8.812 1.00 0.00 C ATOM 135 CG ARG A 13 -14.257 15.610 9.942 1.00 0.00 C ATOM 136 CD ARG A 13 -15.030 16.908 10.106 1.00 0.00 C ATOM 137 NE ARG A 13 -16.349 16.688 10.695 1.00 0.00 N ATOM 138 CZ ARG A 13 -17.093 17.654 11.230 1.00 0.00 C ATOM 139 NH1 ARG A 13 -16.651 18.905 11.253 1.00 0.00 N ATOM 140 NH2 ARG A 13 -18.281 17.368 11.743 1.00 0.00 N ATOM 0 H ARG A 13 -10.685 14.628 7.421 1.00 0.00 H new ATOM 0 HA ARG A 13 -12.332 13.947 9.644 1.00 0.00 H new ATOM 0 HB2 ARG A 13 -12.619 16.584 8.968 1.00 0.00 H new ATOM 0 HB3 ARG A 13 -13.774 15.854 7.871 1.00 0.00 H new ATOM 0 HG2 ARG A 13 -14.952 14.794 9.742 1.00 0.00 H new ATOM 0 HG3 ARG A 13 -13.744 15.371 10.873 1.00 0.00 H new ATOM 0 HD2 ARG A 13 -14.461 17.592 10.736 1.00 0.00 H new ATOM 0 HD3 ARG A 13 -15.142 17.389 9.134 1.00 0.00 H new ATOM 0 HE ARG A 13 -16.722 15.739 10.696 1.00 0.00 H new ATOM 0 HH11 ARG A 13 -15.737 19.130 10.860 1.00 0.00 H new ATOM 0 HH12 ARG A 13 -17.225 19.641 11.664 1.00 0.00 H new ATOM 0 HH21 ARG A 13 -18.625 16.408 11.728 1.00 0.00 H new ATOM 0 HH22 ARG A 13 -18.851 18.108 12.153 1.00 0.00 H new ATOM 154 N ASN A 14 -12.659 13.852 6.365 1.00 0.00 N ATOM 155 CA ASN A 14 -13.134 13.031 5.258 1.00 0.00 C ATOM 156 C ASN A 14 -12.035 12.828 4.220 1.00 0.00 C ATOM 157 O ASN A 14 -11.739 11.700 3.827 1.00 0.00 O ATOM 158 CB ASN A 14 -14.357 13.678 4.605 1.00 0.00 C ATOM 159 CG ASN A 14 -15.661 13.174 5.193 1.00 0.00 C ATOM 160 OD1 ASN A 14 -16.310 13.866 5.977 1.00 0.00 O ATOM 161 ND2 ASN A 14 -16.051 11.961 4.816 1.00 0.00 N ATOM 0 H ASN A 14 -12.134 14.679 6.081 1.00 0.00 H new ATOM 0 HA ASN A 14 -13.416 12.056 5.656 1.00 0.00 H new ATOM 0 HB2 ASN A 14 -14.301 14.760 4.727 1.00 0.00 H new ATOM 0 HB3 ASN A 14 -14.343 13.477 3.534 1.00 0.00 H new ATOM 0 HD21 ASN A 14 -16.920 11.569 5.179 1.00 0.00 H new ATOM 0 HD22 ASN A 14 -15.482 11.422 4.164 1.00 0.00 H new ATOM 168 N GLY A 15 -11.436 13.929 3.778 1.00 0.00 N ATOM 169 CA GLY A 15 -10.377 13.851 2.789 1.00 0.00 C ATOM 170 C GLY A 15 -9.134 13.168 3.323 1.00 0.00 C ATOM 171 O GLY A 15 -8.327 13.786 4.018 1.00 0.00 O ATOM 0 H GLY A 15 -11.665 14.874 4.087 1.00 0.00 H new ATOM 0 HA2 GLY A 15 -10.739 13.309 1.916 1.00 0.00 H new ATOM 0 HA3 GLY A 15 -10.120 14.857 2.456 1.00 0.00 H new ATOM 175 N SER A 16 -8.980 11.889 2.999 1.00 0.00 N ATOM 176 CA SER A 16 -7.825 11.120 3.451 1.00 0.00 C ATOM 177 C SER A 16 -7.559 9.942 2.520 1.00 0.00 C ATOM 178 O SER A 16 -8.211 9.793 1.487 1.00 0.00 O ATOM 179 CB SER A 16 -8.048 10.617 4.878 1.00 0.00 C ATOM 180 OG SER A 16 -6.886 9.983 5.383 1.00 0.00 O ATOM 0 H SER A 16 -9.639 11.363 2.426 1.00 0.00 H new ATOM 0 HA SER A 16 -6.954 11.776 3.436 1.00 0.00 H new ATOM 0 HB2 SER A 16 -8.320 11.453 5.523 1.00 0.00 H new ATOM 0 HB3 SER A 16 -8.884 9.917 4.894 1.00 0.00 H new ATOM 0 HG SER A 16 -7.054 9.672 6.297 1.00 0.00 H new ATOM 186 N PHE A 17 -6.597 9.105 2.895 1.00 0.00 N ATOM 187 CA PHE A 17 -6.244 7.939 2.096 1.00 0.00 C ATOM 188 C PHE A 17 -5.903 6.752 2.990 1.00 0.00 C ATOM 189 O PHE A 17 -4.763 6.603 3.432 1.00 0.00 O ATOM 190 CB PHE A 17 -5.060 8.259 1.179 1.00 0.00 C ATOM 191 CG PHE A 17 -5.179 9.586 0.485 1.00 0.00 C ATOM 192 CD1 PHE A 17 -6.217 9.831 -0.399 1.00 0.00 C ATOM 193 CD2 PHE A 17 -4.251 10.589 0.718 1.00 0.00 C ATOM 194 CE1 PHE A 17 -6.328 11.051 -1.038 1.00 0.00 C ATOM 195 CE2 PHE A 17 -4.357 11.811 0.081 1.00 0.00 C ATOM 196 CZ PHE A 17 -5.396 12.042 -0.798 1.00 0.00 C ATOM 0 H PHE A 17 -6.048 9.213 3.748 1.00 0.00 H new ATOM 0 HA PHE A 17 -7.106 7.675 1.484 1.00 0.00 H new ATOM 0 HB2 PHE A 17 -4.142 8.247 1.767 1.00 0.00 H new ATOM 0 HB3 PHE A 17 -4.969 7.473 0.429 1.00 0.00 H new ATOM 0 HD1 PHE A 17 -6.948 9.059 -0.591 1.00 0.00 H new ATOM 0 HD2 PHE A 17 -3.436 10.414 1.405 1.00 0.00 H new ATOM 0 HE1 PHE A 17 -7.143 11.230 -1.724 1.00 0.00 H new ATOM 0 HE2 PHE A 17 -3.628 12.584 0.271 1.00 0.00 H new ATOM 0 HZ PHE A 17 -5.480 12.996 -1.297 1.00 0.00 H new ATOM 206 N ILE A 18 -6.898 5.911 3.254 1.00 0.00 N ATOM 207 CA ILE A 18 -6.707 4.736 4.096 1.00 0.00 C ATOM 208 C ILE A 18 -6.452 5.135 5.546 1.00 0.00 C ATOM 209 O ILE A 18 -5.636 6.013 5.824 1.00 0.00 O ATOM 210 CB ILE A 18 -5.534 3.866 3.601 1.00 0.00 C ATOM 211 CG1 ILE A 18 -5.675 3.583 2.104 1.00 0.00 C ATOM 212 CG2 ILE A 18 -5.469 2.565 4.386 1.00 0.00 C ATOM 213 CD1 ILE A 18 -4.351 3.386 1.399 1.00 0.00 C ATOM 0 H ILE A 18 -7.847 6.022 2.896 1.00 0.00 H new ATOM 0 HA ILE A 18 -7.627 4.155 4.036 1.00 0.00 H new ATOM 0 HB ILE A 18 -4.605 4.412 3.763 1.00 0.00 H new ATOM 0 HG12 ILE A 18 -6.287 2.691 1.967 1.00 0.00 H new ATOM 0 HG13 ILE A 18 -6.208 4.410 1.635 1.00 0.00 H new ATOM 0 HG21 ILE A 18 -4.636 1.963 4.024 1.00 0.00 H new ATOM 0 HG22 ILE A 18 -5.325 2.785 5.444 1.00 0.00 H new ATOM 0 HG23 ILE A 18 -6.400 2.013 4.254 1.00 0.00 H new ATOM 0 HD11 ILE A 18 -4.528 3.190 0.341 1.00 0.00 H new ATOM 0 HD12 ILE A 18 -3.745 4.286 1.505 1.00 0.00 H new ATOM 0 HD13 ILE A 18 -3.825 2.540 1.842 1.00 0.00 H new ATOM 225 N THR A 19 -7.158 4.485 6.466 1.00 0.00 N ATOM 226 CA THR A 19 -7.009 4.773 7.887 1.00 0.00 C ATOM 227 C THR A 19 -6.179 3.695 8.577 1.00 0.00 C ATOM 228 O THR A 19 -5.577 2.846 7.919 1.00 0.00 O ATOM 229 CB THR A 19 -8.382 4.881 8.554 1.00 0.00 C ATOM 230 OG1 THR A 19 -9.388 5.140 7.591 1.00 0.00 O ATOM 231 CG2 THR A 19 -8.456 5.972 9.600 1.00 0.00 C ATOM 0 H THR A 19 -7.838 3.756 6.252 1.00 0.00 H new ATOM 0 HA THR A 19 -6.489 5.726 7.986 1.00 0.00 H new ATOM 0 HB THR A 19 -8.541 3.920 9.043 1.00 0.00 H new ATOM 0 HG1 THR A 19 -10.259 5.204 8.036 1.00 0.00 H new ATOM 0 HG21 THR A 19 -9.456 5.994 10.033 1.00 0.00 H new ATOM 0 HG22 THR A 19 -7.725 5.774 10.384 1.00 0.00 H new ATOM 0 HG23 THR A 19 -8.240 6.935 9.137 1.00 0.00 H new ATOM 239 N LYS A 20 -6.151 3.735 9.905 1.00 0.00 N ATOM 240 CA LYS A 20 -5.395 2.762 10.685 1.00 0.00 C ATOM 241 C LYS A 20 -6.242 1.530 10.988 1.00 0.00 C ATOM 242 O LYS A 20 -5.737 0.409 11.015 1.00 0.00 O ATOM 243 CB LYS A 20 -4.905 3.394 11.989 1.00 0.00 C ATOM 244 CG LYS A 20 -4.028 2.471 12.820 1.00 0.00 C ATOM 245 CD LYS A 20 -3.284 3.236 13.903 1.00 0.00 C ATOM 246 CE LYS A 20 -3.283 2.478 15.221 1.00 0.00 C ATOM 247 NZ LYS A 20 -3.459 3.389 16.387 1.00 0.00 N ATOM 0 H LYS A 20 -6.644 4.432 10.464 1.00 0.00 H new ATOM 0 HA LYS A 20 -4.533 2.450 10.095 1.00 0.00 H new ATOM 0 HB2 LYS A 20 -4.346 4.300 11.756 1.00 0.00 H new ATOM 0 HB3 LYS A 20 -5.767 3.695 12.584 1.00 0.00 H new ATOM 0 HG2 LYS A 20 -4.644 1.697 13.278 1.00 0.00 H new ATOM 0 HG3 LYS A 20 -3.312 1.967 12.172 1.00 0.00 H new ATOM 0 HD2 LYS A 20 -2.257 3.414 13.584 1.00 0.00 H new ATOM 0 HD3 LYS A 20 -3.748 4.212 14.044 1.00 0.00 H new ATOM 0 HE2 LYS A 20 -4.083 1.738 15.215 1.00 0.00 H new ATOM 0 HE3 LYS A 20 -2.345 1.932 15.325 1.00 0.00 H new ATOM 0 HZ1 LYS A 20 -3.453 2.833 17.266 1.00 0.00 H new ATOM 0 HZ2 LYS A 20 -2.682 4.080 16.408 1.00 0.00 H new ATOM 0 HZ3 LYS A 20 -4.366 3.891 16.301 1.00 0.00 H new ATOM 261 N GLU A 21 -7.533 1.749 11.218 1.00 0.00 N ATOM 262 CA GLU A 21 -8.452 0.657 11.519 1.00 0.00 C ATOM 263 C GLU A 21 -8.624 -0.259 10.312 1.00 0.00 C ATOM 264 O GLU A 21 -8.842 -1.462 10.459 1.00 0.00 O ATOM 265 CB GLU A 21 -9.810 1.210 11.953 1.00 0.00 C ATOM 266 CG GLU A 21 -10.444 2.138 10.929 1.00 0.00 C ATOM 267 CD GLU A 21 -11.948 1.972 10.844 1.00 0.00 C ATOM 268 OE1 GLU A 21 -12.402 0.918 10.351 1.00 0.00 O ATOM 269 OE2 GLU A 21 -12.672 2.895 11.271 1.00 0.00 O ATOM 0 H GLU A 21 -7.966 2.672 11.202 1.00 0.00 H new ATOM 0 HA GLU A 21 -8.028 0.074 12.336 1.00 0.00 H new ATOM 0 HB2 GLU A 21 -10.487 0.378 12.145 1.00 0.00 H new ATOM 0 HB3 GLU A 21 -9.690 1.748 12.894 1.00 0.00 H new ATOM 0 HG2 GLU A 21 -10.210 3.171 11.187 1.00 0.00 H new ATOM 0 HG3 GLU A 21 -10.005 1.946 9.950 1.00 0.00 H new ATOM 276 N LYS A 22 -8.525 0.317 9.119 1.00 0.00 N ATOM 277 CA LYS A 22 -8.670 -0.448 7.886 1.00 0.00 C ATOM 278 C LYS A 22 -7.447 -1.326 7.644 1.00 0.00 C ATOM 279 O LYS A 22 -7.553 -2.409 7.068 1.00 0.00 O ATOM 280 CB LYS A 22 -8.881 0.494 6.699 1.00 0.00 C ATOM 281 CG LYS A 22 -9.522 -0.178 5.496 1.00 0.00 C ATOM 282 CD LYS A 22 -10.241 0.830 4.613 1.00 0.00 C ATOM 283 CE LYS A 22 -11.277 0.157 3.729 1.00 0.00 C ATOM 284 NZ LYS A 22 -12.451 1.039 3.479 1.00 0.00 N ATOM 0 H LYS A 22 -8.345 1.311 8.980 1.00 0.00 H new ATOM 0 HA LYS A 22 -9.543 -1.093 7.988 1.00 0.00 H new ATOM 0 HB2 LYS A 22 -9.507 1.329 7.015 1.00 0.00 H new ATOM 0 HB3 LYS A 22 -7.919 0.912 6.402 1.00 0.00 H new ATOM 0 HG2 LYS A 22 -8.757 -0.692 4.914 1.00 0.00 H new ATOM 0 HG3 LYS A 22 -10.228 -0.936 5.835 1.00 0.00 H new ATOM 0 HD2 LYS A 22 -10.726 1.581 5.237 1.00 0.00 H new ATOM 0 HD3 LYS A 22 -9.515 1.353 3.991 1.00 0.00 H new ATOM 0 HE2 LYS A 22 -10.820 -0.117 2.778 1.00 0.00 H new ATOM 0 HE3 LYS A 22 -11.611 -0.767 4.200 1.00 0.00 H new ATOM 0 HZ1 LYS A 22 -13.135 0.543 2.872 1.00 0.00 H new ATOM 0 HZ2 LYS A 22 -12.903 1.280 4.384 1.00 0.00 H new ATOM 0 HZ3 LYS A 22 -12.136 1.910 3.006 1.00 0.00 H new ATOM 298 N LYS A 23 -6.288 -0.852 8.086 1.00 0.00 N ATOM 299 CA LYS A 23 -5.044 -1.595 7.917 1.00 0.00 C ATOM 300 C LYS A 23 -5.017 -2.826 8.816 1.00 0.00 C ATOM 301 O LYS A 23 -4.423 -3.847 8.471 1.00 0.00 O ATOM 302 CB LYS A 23 -3.843 -0.696 8.226 1.00 0.00 C ATOM 303 CG LYS A 23 -3.479 0.245 7.089 1.00 0.00 C ATOM 304 CD LYS A 23 -2.915 1.557 7.612 1.00 0.00 C ATOM 305 CE LYS A 23 -1.464 1.407 8.041 1.00 0.00 C ATOM 306 NZ LYS A 23 -1.045 2.495 8.967 1.00 0.00 N ATOM 0 H LYS A 23 -6.183 0.043 8.564 1.00 0.00 H new ATOM 0 HA LYS A 23 -4.986 -1.925 6.880 1.00 0.00 H new ATOM 0 HB2 LYS A 23 -4.060 -0.108 9.118 1.00 0.00 H new ATOM 0 HB3 LYS A 23 -2.981 -1.322 8.458 1.00 0.00 H new ATOM 0 HG2 LYS A 23 -2.747 -0.234 6.439 1.00 0.00 H new ATOM 0 HG3 LYS A 23 -4.362 0.443 6.482 1.00 0.00 H new ATOM 0 HD2 LYS A 23 -2.990 2.321 6.838 1.00 0.00 H new ATOM 0 HD3 LYS A 23 -3.512 1.900 8.457 1.00 0.00 H new ATOM 0 HE2 LYS A 23 -1.327 0.442 8.529 1.00 0.00 H new ATOM 0 HE3 LYS A 23 -0.822 1.412 7.160 1.00 0.00 H new ATOM 0 HZ1 LYS A 23 -0.050 2.357 9.237 1.00 0.00 H new ATOM 0 HZ2 LYS A 23 -1.151 3.415 8.493 1.00 0.00 H new ATOM 0 HZ3 LYS A 23 -1.641 2.474 9.819 1.00 0.00 H new ATOM 320 N ASP A 24 -5.665 -2.721 9.973 1.00 0.00 N ATOM 321 CA ASP A 24 -5.716 -3.825 10.923 1.00 0.00 C ATOM 322 C ASP A 24 -6.695 -4.900 10.459 1.00 0.00 C ATOM 323 O ASP A 24 -6.507 -6.085 10.735 1.00 0.00 O ATOM 324 CB ASP A 24 -6.117 -3.314 12.309 1.00 0.00 C ATOM 325 CG ASP A 24 -5.312 -3.960 13.419 1.00 0.00 C ATOM 326 OD1 ASP A 24 -4.197 -3.474 13.703 1.00 0.00 O ATOM 327 OD2 ASP A 24 -5.796 -4.951 14.004 1.00 0.00 O ATOM 0 H ASP A 24 -6.161 -1.882 10.274 1.00 0.00 H new ATOM 0 HA ASP A 24 -4.722 -4.268 10.981 1.00 0.00 H new ATOM 0 HB2 ASP A 24 -5.982 -2.233 12.348 1.00 0.00 H new ATOM 0 HB3 ASP A 24 -7.177 -3.509 12.472 1.00 0.00 H new ATOM 332 N THR A 25 -7.740 -4.477 9.756 1.00 0.00 N ATOM 333 CA THR A 25 -8.749 -5.403 9.256 1.00 0.00 C ATOM 334 C THR A 25 -8.195 -6.245 8.110 1.00 0.00 C ATOM 335 O THR A 25 -8.594 -7.395 7.923 1.00 0.00 O ATOM 336 CB THR A 25 -9.987 -4.636 8.787 1.00 0.00 C ATOM 337 OG1 THR A 25 -10.069 -3.377 9.431 1.00 0.00 O ATOM 338 CG2 THR A 25 -11.283 -5.373 9.053 1.00 0.00 C ATOM 0 H THR A 25 -7.910 -3.499 9.520 1.00 0.00 H new ATOM 0 HA THR A 25 -9.030 -6.070 10.071 1.00 0.00 H new ATOM 0 HB THR A 25 -9.867 -4.522 7.710 1.00 0.00 H new ATOM 0 HG1 THR A 25 -9.826 -3.476 10.375 1.00 0.00 H new ATOM 0 HG21 THR A 25 -12.122 -4.775 8.697 1.00 0.00 H new ATOM 0 HG22 THR A 25 -11.272 -6.329 8.530 1.00 0.00 H new ATOM 0 HG23 THR A 25 -11.390 -5.546 10.124 1.00 0.00 H new ATOM 346 N VAL A 26 -7.275 -5.666 7.347 1.00 0.00 N ATOM 347 CA VAL A 26 -6.666 -6.362 6.220 1.00 0.00 C ATOM 348 C VAL A 26 -5.725 -7.462 6.698 1.00 0.00 C ATOM 349 O VAL A 26 -5.693 -8.556 6.134 1.00 0.00 O ATOM 350 CB VAL A 26 -5.885 -5.392 5.314 1.00 0.00 C ATOM 351 CG1 VAL A 26 -5.390 -6.105 4.065 1.00 0.00 C ATOM 352 CG2 VAL A 26 -6.747 -4.192 4.943 1.00 0.00 C ATOM 0 H VAL A 26 -6.934 -4.715 7.489 1.00 0.00 H new ATOM 0 HA VAL A 26 -7.480 -6.806 5.646 1.00 0.00 H new ATOM 0 HB VAL A 26 -5.018 -5.031 5.867 1.00 0.00 H new ATOM 0 HG11 VAL A 26 -4.841 -5.402 3.438 1.00 0.00 H new ATOM 0 HG12 VAL A 26 -4.733 -6.926 4.351 1.00 0.00 H new ATOM 0 HG13 VAL A 26 -6.241 -6.498 3.509 1.00 0.00 H new ATOM 0 HG21 VAL A 26 -6.177 -3.519 4.303 1.00 0.00 H new ATOM 0 HG22 VAL A 26 -7.636 -4.533 4.412 1.00 0.00 H new ATOM 0 HG23 VAL A 26 -7.046 -3.665 5.849 1.00 0.00 H new ATOM 362 N LEU A 27 -4.957 -7.164 7.742 1.00 0.00 N ATOM 363 CA LEU A 27 -4.013 -8.129 8.296 1.00 0.00 C ATOM 364 C LEU A 27 -4.739 -9.198 9.106 1.00 0.00 C ATOM 365 O LEU A 27 -4.294 -10.343 9.179 1.00 0.00 O ATOM 366 CB LEU A 27 -2.983 -7.418 9.174 1.00 0.00 C ATOM 367 CG LEU A 27 -2.380 -6.149 8.569 1.00 0.00 C ATOM 368 CD1 LEU A 27 -1.892 -5.214 9.665 1.00 0.00 C ATOM 369 CD2 LEU A 27 -1.244 -6.501 7.620 1.00 0.00 C ATOM 0 H LEU A 27 -4.970 -6.263 8.221 1.00 0.00 H new ATOM 0 HA LEU A 27 -3.500 -8.615 7.467 1.00 0.00 H new ATOM 0 HB2 LEU A 27 -3.453 -7.161 10.123 1.00 0.00 H new ATOM 0 HB3 LEU A 27 -2.175 -8.115 9.397 1.00 0.00 H new ATOM 0 HG LEU A 27 -3.156 -5.635 8.002 1.00 0.00 H new ATOM 0 HD11 LEU A 27 -1.466 -4.317 9.215 1.00 0.00 H new ATOM 0 HD12 LEU A 27 -2.729 -4.936 10.306 1.00 0.00 H new ATOM 0 HD13 LEU A 27 -1.130 -5.718 10.260 1.00 0.00 H new ATOM 0 HD21 LEU A 27 -0.826 -5.587 7.198 1.00 0.00 H new ATOM 0 HD22 LEU A 27 -0.467 -7.037 8.165 1.00 0.00 H new ATOM 0 HD23 LEU A 27 -1.624 -7.131 6.816 1.00 0.00 H new ATOM 381 N ARG A 28 -5.857 -8.816 9.714 1.00 0.00 N ATOM 382 CA ARG A 28 -6.645 -9.743 10.520 1.00 0.00 C ATOM 383 C ARG A 28 -7.088 -10.944 9.690 1.00 0.00 C ATOM 384 O ARG A 28 -7.011 -12.086 10.142 1.00 0.00 O ATOM 385 CB ARG A 28 -7.868 -9.032 11.103 1.00 0.00 C ATOM 386 CG ARG A 28 -8.258 -9.530 12.485 1.00 0.00 C ATOM 387 CD ARG A 28 -9.339 -8.660 13.107 1.00 0.00 C ATOM 388 NE ARG A 28 -10.679 -9.188 12.859 1.00 0.00 N ATOM 389 CZ ARG A 28 -11.391 -8.927 11.765 1.00 0.00 C ATOM 390 NH1 ARG A 28 -10.901 -8.144 10.811 1.00 0.00 N ATOM 391 NH2 ARG A 28 -12.600 -9.454 11.622 1.00 0.00 N ATOM 0 H ARG A 28 -6.238 -7.871 9.664 1.00 0.00 H new ATOM 0 HA ARG A 28 -6.017 -10.100 11.337 1.00 0.00 H new ATOM 0 HB2 ARG A 28 -7.666 -7.962 11.155 1.00 0.00 H new ATOM 0 HB3 ARG A 28 -8.712 -9.164 10.426 1.00 0.00 H new ATOM 0 HG2 ARG A 28 -8.613 -10.558 12.416 1.00 0.00 H new ATOM 0 HG3 ARG A 28 -7.380 -9.538 13.131 1.00 0.00 H new ATOM 0 HD2 ARG A 28 -9.172 -8.587 14.182 1.00 0.00 H new ATOM 0 HD3 ARG A 28 -9.267 -7.650 12.704 1.00 0.00 H new ATOM 0 HE ARG A 28 -11.094 -9.793 13.567 1.00 0.00 H new ATOM 0 HH11 ARG A 28 -9.971 -7.737 10.913 1.00 0.00 H new ATOM 0 HH12 ARG A 28 -11.454 -7.950 9.976 1.00 0.00 H new ATOM 0 HH21 ARG A 28 -12.982 -10.058 12.350 1.00 0.00 H new ATOM 0 HH22 ARG A 28 -13.147 -9.255 10.784 1.00 0.00 H new ATOM 405 N GLN A 29 -7.552 -10.677 8.473 1.00 0.00 N ATOM 406 CA GLN A 29 -8.007 -11.736 7.579 1.00 0.00 C ATOM 407 C GLN A 29 -6.853 -12.658 7.201 1.00 0.00 C ATOM 408 O GLN A 29 -7.049 -13.852 6.969 1.00 0.00 O ATOM 409 CB GLN A 29 -8.630 -11.135 6.318 1.00 0.00 C ATOM 410 CG GLN A 29 -9.899 -10.340 6.584 1.00 0.00 C ATOM 411 CD GLN A 29 -10.747 -10.164 5.341 1.00 0.00 C ATOM 412 OE1 GLN A 29 -11.579 -11.012 5.018 1.00 0.00 O ATOM 413 NE2 GLN A 29 -10.540 -9.059 4.636 1.00 0.00 N ATOM 0 H GLN A 29 -7.623 -9.737 8.084 1.00 0.00 H new ATOM 0 HA GLN A 29 -8.762 -12.323 8.103 1.00 0.00 H new ATOM 0 HB2 GLN A 29 -7.899 -10.486 5.836 1.00 0.00 H new ATOM 0 HB3 GLN A 29 -8.855 -11.938 5.616 1.00 0.00 H new ATOM 0 HG2 GLN A 29 -10.486 -10.845 7.351 1.00 0.00 H new ATOM 0 HG3 GLN A 29 -9.633 -9.360 6.980 1.00 0.00 H new ATOM 0 HE21 GLN A 29 -9.840 -8.383 4.941 1.00 0.00 H new ATOM 0 HE22 GLN A 29 -11.081 -8.886 3.789 1.00 0.00 H new ATOM 422 N VAL A 30 -5.649 -12.097 7.140 1.00 0.00 N ATOM 423 CA VAL A 30 -4.464 -12.870 6.792 1.00 0.00 C ATOM 424 C VAL A 30 -3.882 -13.566 8.016 1.00 0.00 C ATOM 425 O VAL A 30 -3.315 -14.653 7.913 1.00 0.00 O ATOM 426 CB VAL A 30 -3.379 -11.977 6.159 1.00 0.00 C ATOM 427 CG1 VAL A 30 -2.235 -12.824 5.622 1.00 0.00 C ATOM 428 CG2 VAL A 30 -3.974 -11.112 5.059 1.00 0.00 C ATOM 0 H VAL A 30 -5.470 -11.111 7.327 1.00 0.00 H new ATOM 0 HA VAL A 30 -4.777 -13.621 6.066 1.00 0.00 H new ATOM 0 HB VAL A 30 -2.981 -11.319 6.931 1.00 0.00 H new ATOM 0 HG11 VAL A 30 -1.479 -12.176 5.179 1.00 0.00 H new ATOM 0 HG12 VAL A 30 -1.791 -13.395 6.438 1.00 0.00 H new ATOM 0 HG13 VAL A 30 -2.614 -13.509 4.864 1.00 0.00 H new ATOM 0 HG21 VAL A 30 -3.193 -10.488 4.624 1.00 0.00 H new ATOM 0 HG22 VAL A 30 -4.402 -11.750 4.286 1.00 0.00 H new ATOM 0 HG23 VAL A 30 -4.754 -10.477 5.478 1.00 0.00 H new ATOM 438 N ARG A 31 -4.026 -12.932 9.176 1.00 0.00 N ATOM 439 CA ARG A 31 -3.516 -13.492 10.422 1.00 0.00 C ATOM 440 C ARG A 31 -4.153 -14.849 10.710 1.00 0.00 C ATOM 441 O ARG A 31 -3.518 -15.735 11.280 1.00 0.00 O ATOM 442 CB ARG A 31 -3.780 -12.530 11.583 1.00 0.00 C ATOM 443 CG ARG A 31 -2.514 -12.030 12.259 1.00 0.00 C ATOM 444 CD ARG A 31 -2.797 -10.843 13.165 1.00 0.00 C ATOM 445 NE ARG A 31 -1.909 -10.814 14.324 1.00 0.00 N ATOM 446 CZ ARG A 31 -1.962 -11.693 15.322 1.00 0.00 C ATOM 447 NH1 ARG A 31 -2.859 -12.673 15.305 1.00 0.00 N ATOM 448 NH2 ARG A 31 -1.117 -11.595 16.339 1.00 0.00 N ATOM 0 H ARG A 31 -4.492 -12.030 9.278 1.00 0.00 H new ATOM 0 HA ARG A 31 -2.440 -13.633 10.316 1.00 0.00 H new ATOM 0 HB2 ARG A 31 -4.347 -11.675 11.214 1.00 0.00 H new ATOM 0 HB3 ARG A 31 -4.404 -13.030 12.324 1.00 0.00 H new ATOM 0 HG2 ARG A 31 -2.069 -12.836 12.842 1.00 0.00 H new ATOM 0 HG3 ARG A 31 -1.784 -11.745 11.501 1.00 0.00 H new ATOM 0 HD2 ARG A 31 -2.683 -9.919 12.598 1.00 0.00 H new ATOM 0 HD3 ARG A 31 -3.833 -10.884 13.503 1.00 0.00 H new ATOM 0 HE ARG A 31 -1.206 -10.076 14.372 1.00 0.00 H new ATOM 0 HH11 ARG A 31 -3.511 -12.754 14.525 1.00 0.00 H new ATOM 0 HH12 ARG A 31 -2.896 -13.344 16.072 1.00 0.00 H new ATOM 0 HH21 ARG A 31 -0.425 -10.845 16.357 1.00 0.00 H new ATOM 0 HH22 ARG A 31 -1.159 -12.269 17.103 1.00 0.00 H new ATOM 462 N LEU A 32 -5.411 -15.003 10.309 1.00 0.00 N ATOM 463 CA LEU A 32 -6.133 -16.251 10.524 1.00 0.00 C ATOM 464 C LEU A 32 -5.592 -17.354 9.620 1.00 0.00 C ATOM 465 O LEU A 32 -5.579 -18.527 9.995 1.00 0.00 O ATOM 466 CB LEU A 32 -7.629 -16.050 10.266 1.00 0.00 C ATOM 467 CG LEU A 32 -8.440 -15.598 11.481 1.00 0.00 C ATOM 468 CD1 LEU A 32 -9.746 -14.954 11.042 1.00 0.00 C ATOM 469 CD2 LEU A 32 -8.708 -16.774 12.408 1.00 0.00 C ATOM 0 H LEU A 32 -5.951 -14.280 9.834 1.00 0.00 H new ATOM 0 HA LEU A 32 -5.988 -16.553 11.561 1.00 0.00 H new ATOM 0 HB2 LEU A 32 -7.749 -15.312 9.473 1.00 0.00 H new ATOM 0 HB3 LEU A 32 -8.048 -16.986 9.897 1.00 0.00 H new ATOM 0 HG LEU A 32 -7.859 -14.855 12.027 1.00 0.00 H new ATOM 0 HD11 LEU A 32 -10.309 -14.639 11.920 1.00 0.00 H new ATOM 0 HD12 LEU A 32 -9.532 -14.087 10.418 1.00 0.00 H new ATOM 0 HD13 LEU A 32 -10.334 -15.674 10.473 1.00 0.00 H new ATOM 0 HD21 LEU A 32 -9.286 -16.435 13.268 1.00 0.00 H new ATOM 0 HD22 LEU A 32 -9.269 -17.539 11.872 1.00 0.00 H new ATOM 0 HD23 LEU A 32 -7.761 -17.191 12.750 1.00 0.00 H new ATOM 481 N ASP A 33 -5.147 -16.971 8.428 1.00 0.00 N ATOM 482 CA ASP A 33 -4.603 -17.928 7.471 1.00 0.00 C ATOM 483 C ASP A 33 -3.670 -17.235 6.479 1.00 0.00 C ATOM 484 O ASP A 33 -3.957 -16.132 6.014 1.00 0.00 O ATOM 485 CB ASP A 33 -5.737 -18.627 6.719 1.00 0.00 C ATOM 486 CG ASP A 33 -5.372 -20.039 6.306 1.00 0.00 C ATOM 487 OD1 ASP A 33 -4.733 -20.201 5.246 1.00 0.00 O ATOM 488 OD2 ASP A 33 -5.726 -20.983 7.043 1.00 0.00 O ATOM 0 H ASP A 33 -5.152 -16.005 8.101 1.00 0.00 H new ATOM 0 HA ASP A 33 -4.029 -18.672 8.023 1.00 0.00 H new ATOM 0 HB2 ASP A 33 -6.625 -18.654 7.350 1.00 0.00 H new ATOM 0 HB3 ASP A 33 -5.993 -18.047 5.833 1.00 0.00 H new ATOM 493 N PRO A 34 -2.535 -17.874 6.139 1.00 0.00 N ATOM 494 CA PRO A 34 -1.564 -17.309 5.197 1.00 0.00 C ATOM 495 C PRO A 34 -2.078 -17.319 3.762 1.00 0.00 C ATOM 496 O PRO A 34 -2.459 -18.365 3.236 1.00 0.00 O ATOM 497 CB PRO A 34 -0.353 -18.231 5.340 1.00 0.00 C ATOM 498 CG PRO A 34 -0.922 -19.533 5.786 1.00 0.00 C ATOM 499 CD PRO A 34 -2.111 -19.195 6.645 1.00 0.00 C ATOM 0 HA PRO A 34 -1.346 -16.263 5.413 1.00 0.00 H new ATOM 0 HB2 PRO A 34 0.180 -18.334 4.395 1.00 0.00 H new ATOM 0 HB3 PRO A 34 0.359 -17.840 6.067 1.00 0.00 H new ATOM 0 HG2 PRO A 34 -1.218 -20.142 4.932 1.00 0.00 H new ATOM 0 HG3 PRO A 34 -0.186 -20.108 6.348 1.00 0.00 H new ATOM 0 HD2 PRO A 34 -2.903 -19.937 6.544 1.00 0.00 H new ATOM 0 HD3 PRO A 34 -1.845 -19.154 7.701 1.00 0.00 H new ATOM 507 N CYS A 35 -2.084 -16.149 3.132 1.00 0.00 N ATOM 508 CA CYS A 35 -2.551 -16.023 1.756 1.00 0.00 C ATOM 509 C CYS A 35 -1.462 -15.436 0.864 1.00 0.00 C ATOM 510 O CYS A 35 -0.517 -14.815 1.348 1.00 0.00 O ATOM 511 CB CYS A 35 -3.803 -15.145 1.698 1.00 0.00 C ATOM 512 SG CYS A 35 -5.352 -16.052 1.909 1.00 0.00 S ATOM 0 H CYS A 35 -1.771 -15.274 3.552 1.00 0.00 H new ATOM 0 HA CYS A 35 -2.798 -17.019 1.390 1.00 0.00 H new ATOM 0 HB2 CYS A 35 -3.734 -14.381 2.472 1.00 0.00 H new ATOM 0 HB3 CYS A 35 -3.826 -14.627 0.739 1.00 0.00 H new ATOM 0 HG CYS A 35 -6.352 -15.224 1.847 1.00 0.00 H new ATOM 518 N ASP A 36 -1.604 -15.637 -0.443 1.00 0.00 N ATOM 519 CA ASP A 36 -0.633 -15.126 -1.403 1.00 0.00 C ATOM 520 C ASP A 36 -0.534 -13.606 -1.322 1.00 0.00 C ATOM 521 O ASP A 36 -1.411 -12.890 -1.806 1.00 0.00 O ATOM 522 CB ASP A 36 -1.017 -15.548 -2.822 1.00 0.00 C ATOM 523 CG ASP A 36 -2.448 -15.187 -3.165 1.00 0.00 C ATOM 524 OD1 ASP A 36 -3.369 -15.876 -2.676 1.00 0.00 O ATOM 525 OD2 ASP A 36 -2.651 -14.216 -3.924 1.00 0.00 O ATOM 0 H ASP A 36 -2.381 -16.149 -0.860 1.00 0.00 H new ATOM 0 HA ASP A 36 0.341 -15.549 -1.156 1.00 0.00 H new ATOM 0 HB2 ASP A 36 -0.344 -15.071 -3.535 1.00 0.00 H new ATOM 0 HB3 ASP A 36 -0.882 -16.624 -2.927 1.00 0.00 H new ATOM 530 N LEU A 37 0.537 -13.120 -0.704 1.00 0.00 N ATOM 531 CA LEU A 37 0.749 -11.685 -0.557 1.00 0.00 C ATOM 532 C LEU A 37 1.830 -11.191 -1.514 1.00 0.00 C ATOM 533 O LEU A 37 2.532 -10.223 -1.226 1.00 0.00 O ATOM 534 CB LEU A 37 1.137 -11.351 0.885 1.00 0.00 C ATOM 535 CG LEU A 37 -0.003 -11.449 1.901 1.00 0.00 C ATOM 536 CD1 LEU A 37 0.505 -12.008 3.222 1.00 0.00 C ATOM 537 CD2 LEU A 37 -0.649 -10.088 2.109 1.00 0.00 C ATOM 0 H LEU A 37 1.272 -13.699 -0.297 1.00 0.00 H new ATOM 0 HA LEU A 37 -0.185 -11.179 -0.802 1.00 0.00 H new ATOM 0 HB2 LEU A 37 1.938 -12.022 1.195 1.00 0.00 H new ATOM 0 HB3 LEU A 37 1.541 -10.339 0.911 1.00 0.00 H new ATOM 0 HG LEU A 37 -0.757 -12.131 1.508 1.00 0.00 H new ATOM 0 HD11 LEU A 37 -0.320 -12.070 3.932 1.00 0.00 H new ATOM 0 HD12 LEU A 37 0.921 -13.003 3.060 1.00 0.00 H new ATOM 0 HD13 LEU A 37 1.279 -11.352 3.621 1.00 0.00 H new ATOM 0 HD21 LEU A 37 -1.458 -10.176 2.835 1.00 0.00 H new ATOM 0 HD22 LEU A 37 0.096 -9.384 2.480 1.00 0.00 H new ATOM 0 HD23 LEU A 37 -1.049 -9.727 1.162 1.00 0.00 H new ATOM 549 N GLN A 38 1.959 -11.864 -2.654 1.00 0.00 N ATOM 550 CA GLN A 38 2.957 -11.492 -3.650 1.00 0.00 C ATOM 551 C GLN A 38 2.352 -10.579 -4.718 1.00 0.00 C ATOM 552 O GLN A 38 2.860 -9.486 -4.967 1.00 0.00 O ATOM 553 CB GLN A 38 3.553 -12.743 -4.300 1.00 0.00 C ATOM 554 CG GLN A 38 5.030 -12.940 -3.996 1.00 0.00 C ATOM 555 CD GLN A 38 5.881 -11.775 -4.459 1.00 0.00 C ATOM 556 OE1 GLN A 38 5.968 -11.490 -5.654 1.00 0.00 O ATOM 557 NE2 GLN A 38 6.516 -11.093 -3.513 1.00 0.00 N ATOM 0 H GLN A 38 1.386 -12.668 -2.910 1.00 0.00 H new ATOM 0 HA GLN A 38 3.752 -10.944 -3.144 1.00 0.00 H new ATOM 0 HB2 GLN A 38 3.000 -13.618 -3.959 1.00 0.00 H new ATOM 0 HB3 GLN A 38 3.418 -12.681 -5.380 1.00 0.00 H new ATOM 0 HG2 GLN A 38 5.161 -13.077 -2.923 1.00 0.00 H new ATOM 0 HG3 GLN A 38 5.378 -13.853 -4.479 1.00 0.00 H new ATOM 0 HE21 GLN A 38 6.416 -11.364 -2.535 1.00 0.00 H new ATOM 0 HE22 GLN A 38 7.104 -10.298 -3.765 1.00 0.00 H new ATOM 566 N PRO A 39 1.256 -11.014 -5.366 1.00 0.00 N ATOM 567 CA PRO A 39 0.591 -10.224 -6.408 1.00 0.00 C ATOM 568 C PRO A 39 0.192 -8.837 -5.917 1.00 0.00 C ATOM 569 O PRO A 39 0.110 -7.889 -6.698 1.00 0.00 O ATOM 570 CB PRO A 39 -0.655 -11.046 -6.749 1.00 0.00 C ATOM 571 CG PRO A 39 -0.322 -12.437 -6.333 1.00 0.00 C ATOM 572 CD PRO A 39 0.579 -12.304 -5.137 1.00 0.00 C ATOM 0 HA PRO A 39 1.247 -10.050 -7.261 1.00 0.00 H new ATOM 0 HB2 PRO A 39 -1.531 -10.674 -6.218 1.00 0.00 H new ATOM 0 HB3 PRO A 39 -0.882 -10.996 -7.814 1.00 0.00 H new ATOM 0 HG2 PRO A 39 -1.223 -12.996 -6.083 1.00 0.00 H new ATOM 0 HG3 PRO A 39 0.175 -12.977 -7.139 1.00 0.00 H new ATOM 0 HD2 PRO A 39 0.013 -12.302 -4.205 1.00 0.00 H new ATOM 0 HD3 PRO A 39 1.291 -13.127 -5.076 1.00 0.00 H new ATOM 580 N ILE A 40 -0.058 -8.725 -4.616 1.00 0.00 N ATOM 581 CA ILE A 40 -0.452 -7.455 -4.019 1.00 0.00 C ATOM 582 C ILE A 40 0.736 -6.503 -3.907 1.00 0.00 C ATOM 583 O ILE A 40 0.569 -5.284 -3.923 1.00 0.00 O ATOM 584 CB ILE A 40 -1.065 -7.658 -2.620 1.00 0.00 C ATOM 585 CG1 ILE A 40 -2.150 -8.736 -2.665 1.00 0.00 C ATOM 586 CG2 ILE A 40 -1.635 -6.349 -2.095 1.00 0.00 C ATOM 587 CD1 ILE A 40 -2.487 -9.312 -1.307 1.00 0.00 C ATOM 0 H ILE A 40 0.006 -9.499 -3.955 1.00 0.00 H new ATOM 0 HA ILE A 40 -1.202 -7.018 -4.678 1.00 0.00 H new ATOM 0 HB ILE A 40 -0.279 -7.988 -1.941 1.00 0.00 H new ATOM 0 HG12 ILE A 40 -3.053 -8.313 -3.105 1.00 0.00 H new ATOM 0 HG13 ILE A 40 -1.823 -9.542 -3.321 1.00 0.00 H new ATOM 0 HG21 ILE A 40 -2.064 -6.510 -1.106 1.00 0.00 H new ATOM 0 HG22 ILE A 40 -0.840 -5.606 -2.029 1.00 0.00 H new ATOM 0 HG23 ILE A 40 -2.410 -5.992 -2.773 1.00 0.00 H new ATOM 0 HD11 ILE A 40 -3.263 -10.070 -1.416 1.00 0.00 H new ATOM 0 HD12 ILE A 40 -1.596 -9.765 -0.873 1.00 0.00 H new ATOM 0 HD13 ILE A 40 -2.845 -8.517 -0.653 1.00 0.00 H new ATOM 599 N PHE A 41 1.934 -7.068 -3.794 1.00 0.00 N ATOM 600 CA PHE A 41 3.146 -6.265 -3.678 1.00 0.00 C ATOM 601 C PHE A 41 3.775 -6.022 -5.047 1.00 0.00 C ATOM 602 O PHE A 41 4.115 -4.891 -5.392 1.00 0.00 O ATOM 603 CB PHE A 41 4.154 -6.956 -2.758 1.00 0.00 C ATOM 604 CG PHE A 41 3.791 -6.875 -1.302 1.00 0.00 C ATOM 605 CD1 PHE A 41 2.656 -7.507 -0.823 1.00 0.00 C ATOM 606 CD2 PHE A 41 4.584 -6.166 -0.416 1.00 0.00 C ATOM 607 CE1 PHE A 41 2.318 -7.435 0.515 1.00 0.00 C ATOM 608 CE2 PHE A 41 4.252 -6.089 0.923 1.00 0.00 C ATOM 609 CZ PHE A 41 3.118 -6.725 1.390 1.00 0.00 C ATOM 0 H PHE A 41 2.091 -8.076 -3.780 1.00 0.00 H new ATOM 0 HA PHE A 41 2.871 -5.301 -3.249 1.00 0.00 H new ATOM 0 HB2 PHE A 41 4.237 -8.004 -3.046 1.00 0.00 H new ATOM 0 HB3 PHE A 41 5.136 -6.506 -2.905 1.00 0.00 H new ATOM 0 HD1 PHE A 41 2.027 -8.063 -1.503 1.00 0.00 H new ATOM 0 HD2 PHE A 41 5.472 -5.668 -0.775 1.00 0.00 H new ATOM 0 HE1 PHE A 41 1.430 -7.933 0.876 1.00 0.00 H new ATOM 0 HE2 PHE A 41 4.878 -5.532 1.604 1.00 0.00 H new ATOM 0 HZ PHE A 41 2.857 -6.667 2.436 1.00 0.00 H new ATOM 619 N ASP A 42 3.928 -7.091 -5.822 1.00 0.00 N ATOM 620 CA ASP A 42 4.518 -6.994 -7.152 1.00 0.00 C ATOM 621 C ASP A 42 3.744 -6.012 -8.027 1.00 0.00 C ATOM 622 O ASP A 42 4.336 -5.246 -8.788 1.00 0.00 O ATOM 623 CB ASP A 42 4.550 -8.371 -7.819 1.00 0.00 C ATOM 624 CG ASP A 42 5.802 -9.153 -7.473 1.00 0.00 C ATOM 625 OD1 ASP A 42 6.233 -9.093 -6.302 1.00 0.00 O ATOM 626 OD2 ASP A 42 6.349 -9.825 -8.371 1.00 0.00 O ATOM 0 H ASP A 42 3.651 -8.035 -5.552 1.00 0.00 H new ATOM 0 HA ASP A 42 5.537 -6.625 -7.041 1.00 0.00 H new ATOM 0 HB2 ASP A 42 3.673 -8.941 -7.512 1.00 0.00 H new ATOM 0 HB3 ASP A 42 4.488 -8.249 -8.900 1.00 0.00 H new ATOM 631 N ASP A 43 2.421 -6.039 -7.913 1.00 0.00 N ATOM 632 CA ASP A 43 1.568 -5.151 -8.694 1.00 0.00 C ATOM 633 C ASP A 43 1.681 -3.711 -8.204 1.00 0.00 C ATOM 634 O ASP A 43 1.519 -2.768 -8.977 1.00 0.00 O ATOM 635 CB ASP A 43 0.112 -5.615 -8.619 1.00 0.00 C ATOM 636 CG ASP A 43 -0.707 -5.140 -9.804 1.00 0.00 C ATOM 637 OD1 ASP A 43 -0.821 -3.911 -9.993 1.00 0.00 O ATOM 638 OD2 ASP A 43 -1.233 -5.998 -10.545 1.00 0.00 O ATOM 0 H ASP A 43 1.916 -6.666 -7.287 1.00 0.00 H new ATOM 0 HA ASP A 43 1.903 -5.187 -9.731 1.00 0.00 H new ATOM 0 HB2 ASP A 43 0.082 -6.704 -8.573 1.00 0.00 H new ATOM 0 HB3 ASP A 43 -0.338 -5.245 -7.698 1.00 0.00 H new ATOM 643 N MET A 44 1.958 -3.549 -6.914 1.00 0.00 N ATOM 644 CA MET A 44 2.091 -2.223 -6.321 1.00 0.00 C ATOM 645 C MET A 44 3.537 -1.733 -6.371 1.00 0.00 C ATOM 646 O MET A 44 3.804 -0.547 -6.173 1.00 0.00 O ATOM 647 CB MET A 44 1.597 -2.239 -4.874 1.00 0.00 C ATOM 648 CG MET A 44 0.107 -2.512 -4.742 1.00 0.00 C ATOM 649 SD MET A 44 -0.900 -1.340 -5.671 1.00 0.00 S ATOM 650 CE MET A 44 -0.697 0.139 -4.681 1.00 0.00 C ATOM 0 H MET A 44 2.095 -4.319 -6.259 1.00 0.00 H new ATOM 0 HA MET A 44 1.479 -1.535 -6.904 1.00 0.00 H new ATOM 0 HB2 MET A 44 2.148 -2.999 -4.319 1.00 0.00 H new ATOM 0 HB3 MET A 44 1.824 -1.279 -4.411 1.00 0.00 H new ATOM 0 HG2 MET A 44 -0.105 -3.523 -5.090 1.00 0.00 H new ATOM 0 HG3 MET A 44 -0.174 -2.472 -3.690 1.00 0.00 H new ATOM 0 HE1 MET A 44 -1.233 0.965 -5.147 1.00 0.00 H new ATOM 0 HE2 MET A 44 -1.096 -0.035 -3.682 1.00 0.00 H new ATOM 0 HE3 MET A 44 0.362 0.387 -4.611 1.00 0.00 H new ATOM 660 N LEU A 45 4.469 -2.647 -6.636 1.00 0.00 N ATOM 661 CA LEU A 45 5.884 -2.298 -6.709 1.00 0.00 C ATOM 662 C LEU A 45 6.116 -1.139 -7.675 1.00 0.00 C ATOM 663 O LEU A 45 7.047 -0.351 -7.503 1.00 0.00 O ATOM 664 CB LEU A 45 6.708 -3.512 -7.144 1.00 0.00 C ATOM 665 CG LEU A 45 7.200 -4.403 -6.004 1.00 0.00 C ATOM 666 CD1 LEU A 45 8.048 -5.544 -6.545 1.00 0.00 C ATOM 667 CD2 LEU A 45 7.988 -3.585 -4.992 1.00 0.00 C ATOM 0 H LEU A 45 4.269 -3.633 -6.803 1.00 0.00 H new ATOM 0 HA LEU A 45 6.204 -1.985 -5.715 1.00 0.00 H new ATOM 0 HB2 LEU A 45 6.106 -4.116 -7.823 1.00 0.00 H new ATOM 0 HB3 LEU A 45 7.572 -3.162 -7.710 1.00 0.00 H new ATOM 0 HG LEU A 45 6.332 -4.830 -5.501 1.00 0.00 H new ATOM 0 HD11 LEU A 45 8.389 -6.167 -5.718 1.00 0.00 H new ATOM 0 HD12 LEU A 45 7.453 -6.146 -7.232 1.00 0.00 H new ATOM 0 HD13 LEU A 45 8.911 -5.138 -7.073 1.00 0.00 H new ATOM 0 HD21 LEU A 45 8.331 -4.235 -4.187 1.00 0.00 H new ATOM 0 HD22 LEU A 45 8.848 -3.130 -5.483 1.00 0.00 H new ATOM 0 HD23 LEU A 45 7.350 -2.803 -4.580 1.00 0.00 H new ATOM 679 N HIS A 46 5.264 -1.041 -8.690 1.00 0.00 N ATOM 680 CA HIS A 46 5.378 0.022 -9.682 1.00 0.00 C ATOM 681 C HIS A 46 4.899 1.352 -9.112 1.00 0.00 C ATOM 682 O HIS A 46 5.389 2.416 -9.494 1.00 0.00 O ATOM 683 CB HIS A 46 4.570 -0.331 -10.933 1.00 0.00 C ATOM 684 CG HIS A 46 5.090 0.313 -12.181 1.00 0.00 C ATOM 685 ND1 HIS A 46 5.952 -0.303 -13.061 1.00 0.00 N ATOM 686 CD2 HIS A 46 4.851 1.548 -12.693 1.00 0.00 C ATOM 687 CE1 HIS A 46 6.206 0.558 -14.057 1.00 0.00 C ATOM 688 NE2 HIS A 46 5.562 1.695 -13.882 1.00 0.00 N ATOM 0 H HIS A 46 4.488 -1.684 -8.847 1.00 0.00 H new ATOM 0 HA HIS A 46 6.429 0.121 -9.952 1.00 0.00 H new ATOM 0 HB2 HIS A 46 4.572 -1.413 -11.064 1.00 0.00 H new ATOM 0 HB3 HIS A 46 3.533 -0.030 -10.783 1.00 0.00 H new ATOM 0 HD2 HIS A 46 4.212 2.297 -12.249 1.00 0.00 H new ATOM 0 HE1 HIS A 46 6.854 0.347 -14.895 1.00 0.00 H new ATOM 0 HE2 HIS A 46 5.580 2.513 -14.491 1.00 0.00 H new ATOM 696 N PHE A 47 3.937 1.287 -8.197 1.00 0.00 N ATOM 697 CA PHE A 47 3.392 2.488 -7.574 1.00 0.00 C ATOM 698 C PHE A 47 4.375 3.073 -6.566 1.00 0.00 C ATOM 699 O PHE A 47 4.480 4.292 -6.421 1.00 0.00 O ATOM 700 CB PHE A 47 2.065 2.172 -6.882 1.00 0.00 C ATOM 701 CG PHE A 47 0.953 1.844 -7.838 1.00 0.00 C ATOM 702 CD1 PHE A 47 0.910 0.616 -8.478 1.00 0.00 C ATOM 703 CD2 PHE A 47 -0.049 2.766 -8.097 1.00 0.00 C ATOM 704 CE1 PHE A 47 -0.112 0.313 -9.358 1.00 0.00 C ATOM 705 CE2 PHE A 47 -1.073 2.468 -8.977 1.00 0.00 C ATOM 706 CZ PHE A 47 -1.104 1.240 -9.608 1.00 0.00 C ATOM 0 H PHE A 47 3.519 0.416 -7.871 1.00 0.00 H new ATOM 0 HA PHE A 47 3.220 3.226 -8.358 1.00 0.00 H new ATOM 0 HB2 PHE A 47 2.210 1.331 -6.203 1.00 0.00 H new ATOM 0 HB3 PHE A 47 1.770 3.026 -6.273 1.00 0.00 H new ATOM 0 HD1 PHE A 47 1.684 -0.113 -8.287 1.00 0.00 H new ATOM 0 HD2 PHE A 47 -0.030 3.728 -7.606 1.00 0.00 H new ATOM 0 HE1 PHE A 47 -0.134 -0.648 -9.850 1.00 0.00 H new ATOM 0 HE2 PHE A 47 -1.848 3.195 -9.171 1.00 0.00 H new ATOM 0 HZ PHE A 47 -1.903 1.005 -10.296 1.00 0.00 H new ATOM 716 N LEU A 48 5.093 2.198 -5.870 1.00 0.00 N ATOM 717 CA LEU A 48 6.067 2.629 -4.874 1.00 0.00 C ATOM 718 C LEU A 48 7.336 3.151 -5.541 1.00 0.00 C ATOM 719 O LEU A 48 7.513 3.018 -6.752 1.00 0.00 O ATOM 720 CB LEU A 48 6.411 1.473 -3.933 1.00 0.00 C ATOM 721 CG LEU A 48 5.241 0.944 -3.102 1.00 0.00 C ATOM 722 CD1 LEU A 48 5.582 -0.412 -2.505 1.00 0.00 C ATOM 723 CD2 LEU A 48 4.877 1.934 -2.006 1.00 0.00 C ATOM 0 H LEU A 48 5.019 1.186 -5.977 1.00 0.00 H new ATOM 0 HA LEU A 48 5.623 3.440 -4.297 1.00 0.00 H new ATOM 0 HB2 LEU A 48 6.817 0.652 -4.524 1.00 0.00 H new ATOM 0 HB3 LEU A 48 7.200 1.799 -3.255 1.00 0.00 H new ATOM 0 HG LEU A 48 4.378 0.823 -3.757 1.00 0.00 H new ATOM 0 HD11 LEU A 48 4.738 -0.773 -1.917 1.00 0.00 H new ATOM 0 HD12 LEU A 48 5.795 -1.119 -3.307 1.00 0.00 H new ATOM 0 HD13 LEU A 48 6.458 -0.317 -1.863 1.00 0.00 H new ATOM 0 HD21 LEU A 48 4.043 1.542 -1.424 1.00 0.00 H new ATOM 0 HD22 LEU A 48 5.736 2.085 -1.352 1.00 0.00 H new ATOM 0 HD23 LEU A 48 4.591 2.885 -2.455 1.00 0.00 H new ATOM 735 N ASN A 49 8.216 3.745 -4.742 1.00 0.00 N ATOM 736 CA ASN A 49 9.470 4.288 -5.252 1.00 0.00 C ATOM 737 C ASN A 49 10.655 3.442 -4.790 1.00 0.00 C ATOM 738 O ASN A 49 10.523 2.617 -3.885 1.00 0.00 O ATOM 739 CB ASN A 49 9.647 5.735 -4.790 1.00 0.00 C ATOM 740 CG ASN A 49 9.280 6.735 -5.868 1.00 0.00 C ATOM 741 OD1 ASN A 49 8.454 6.455 -6.736 1.00 0.00 O ATOM 742 ND2 ASN A 49 9.895 7.912 -5.818 1.00 0.00 N ATOM 0 H ASN A 49 8.084 3.863 -3.737 1.00 0.00 H new ATOM 0 HA ASN A 49 9.434 4.265 -6.341 1.00 0.00 H new ATOM 0 HB2 ASN A 49 9.029 5.911 -3.910 1.00 0.00 H new ATOM 0 HB3 ASN A 49 10.683 5.893 -4.489 1.00 0.00 H new ATOM 0 HD21 ASN A 49 9.689 8.625 -6.517 1.00 0.00 H new ATOM 0 HD22 ASN A 49 10.573 8.102 -5.080 1.00 0.00 H new ATOM 749 N PRO A 50 11.834 3.636 -5.406 1.00 0.00 N ATOM 750 CA PRO A 50 13.043 2.885 -5.049 1.00 0.00 C ATOM 751 C PRO A 50 13.461 3.121 -3.602 1.00 0.00 C ATOM 752 O PRO A 50 13.921 2.204 -2.922 1.00 0.00 O ATOM 753 CB PRO A 50 14.109 3.429 -6.009 1.00 0.00 C ATOM 754 CG PRO A 50 13.578 4.740 -6.481 1.00 0.00 C ATOM 755 CD PRO A 50 12.083 4.598 -6.492 1.00 0.00 C ATOM 0 HA PRO A 50 12.890 1.809 -5.133 1.00 0.00 H new ATOM 0 HB2 PRO A 50 15.068 3.551 -5.505 1.00 0.00 H new ATOM 0 HB3 PRO A 50 14.272 2.747 -6.843 1.00 0.00 H new ATOM 0 HG2 PRO A 50 13.889 5.548 -5.819 1.00 0.00 H new ATOM 0 HG3 PRO A 50 13.955 4.979 -7.475 1.00 0.00 H new ATOM 0 HD2 PRO A 50 11.586 5.551 -6.309 1.00 0.00 H new ATOM 0 HD3 PRO A 50 11.720 4.228 -7.451 1.00 0.00 H new ATOM 763 N GLU A 51 13.300 4.356 -3.138 1.00 0.00 N ATOM 764 CA GLU A 51 13.660 4.711 -1.771 1.00 0.00 C ATOM 765 C GLU A 51 12.658 4.131 -0.777 1.00 0.00 C ATOM 766 O GLU A 51 13.012 3.802 0.355 1.00 0.00 O ATOM 767 CB GLU A 51 13.731 6.232 -1.620 1.00 0.00 C ATOM 768 CG GLU A 51 15.091 6.736 -1.164 1.00 0.00 C ATOM 769 CD GLU A 51 15.769 7.611 -2.201 1.00 0.00 C ATOM 770 OE1 GLU A 51 15.490 8.828 -2.223 1.00 0.00 O ATOM 771 OE2 GLU A 51 16.576 7.078 -2.991 1.00 0.00 O ATOM 0 H GLU A 51 12.923 5.127 -3.689 1.00 0.00 H new ATOM 0 HA GLU A 51 14.641 4.287 -1.556 1.00 0.00 H new ATOM 0 HB2 GLU A 51 13.483 6.695 -2.575 1.00 0.00 H new ATOM 0 HB3 GLU A 51 12.975 6.553 -0.904 1.00 0.00 H new ATOM 0 HG2 GLU A 51 14.973 7.301 -0.239 1.00 0.00 H new ATOM 0 HG3 GLU A 51 15.732 5.884 -0.938 1.00 0.00 H new ATOM 778 N GLU A 52 11.407 4.010 -1.209 1.00 0.00 N ATOM 779 CA GLU A 52 10.354 3.471 -0.357 1.00 0.00 C ATOM 780 C GLU A 52 10.505 1.962 -0.192 1.00 0.00 C ATOM 781 O GLU A 52 10.206 1.410 0.866 1.00 0.00 O ATOM 782 CB GLU A 52 8.979 3.797 -0.942 1.00 0.00 C ATOM 783 CG GLU A 52 8.692 5.288 -1.029 1.00 0.00 C ATOM 784 CD GLU A 52 7.528 5.605 -1.946 1.00 0.00 C ATOM 785 OE1 GLU A 52 6.734 4.686 -2.237 1.00 0.00 O ATOM 786 OE2 GLU A 52 7.409 6.773 -2.373 1.00 0.00 O ATOM 0 H GLU A 52 11.098 4.278 -2.143 1.00 0.00 H new ATOM 0 HA GLU A 52 10.443 3.936 0.625 1.00 0.00 H new ATOM 0 HB2 GLU A 52 8.905 3.363 -1.939 1.00 0.00 H new ATOM 0 HB3 GLU A 52 8.211 3.323 -0.330 1.00 0.00 H new ATOM 0 HG2 GLU A 52 8.479 5.672 -0.031 1.00 0.00 H new ATOM 0 HG3 GLU A 52 9.582 5.805 -1.386 1.00 0.00 H new ATOM 793 N LEU A 53 10.971 1.302 -1.246 1.00 0.00 N ATOM 794 CA LEU A 53 11.161 -0.144 -1.219 1.00 0.00 C ATOM 795 C LEU A 53 12.276 -0.527 -0.252 1.00 0.00 C ATOM 796 O LEU A 53 12.244 -1.598 0.355 1.00 0.00 O ATOM 797 CB LEU A 53 11.486 -0.664 -2.621 1.00 0.00 C ATOM 798 CG LEU A 53 10.324 -0.613 -3.616 1.00 0.00 C ATOM 799 CD1 LEU A 53 10.736 -1.220 -4.948 1.00 0.00 C ATOM 800 CD2 LEU A 53 9.109 -1.334 -3.052 1.00 0.00 C ATOM 0 H LEU A 53 11.224 1.744 -2.129 1.00 0.00 H new ATOM 0 HA LEU A 53 10.233 -0.601 -0.876 1.00 0.00 H new ATOM 0 HB2 LEU A 53 12.315 -0.083 -3.024 1.00 0.00 H new ATOM 0 HB3 LEU A 53 11.829 -1.695 -2.539 1.00 0.00 H new ATOM 0 HG LEU A 53 10.058 0.431 -3.783 1.00 0.00 H new ATOM 0 HD11 LEU A 53 9.898 -1.175 -5.643 1.00 0.00 H new ATOM 0 HD12 LEU A 53 11.577 -0.661 -5.358 1.00 0.00 H new ATOM 0 HD13 LEU A 53 11.029 -2.259 -4.799 1.00 0.00 H new ATOM 0 HD21 LEU A 53 8.292 -1.288 -3.772 1.00 0.00 H new ATOM 0 HD22 LEU A 53 9.362 -2.376 -2.857 1.00 0.00 H new ATOM 0 HD23 LEU A 53 8.801 -0.855 -2.123 1.00 0.00 H new ATOM 812 N ARG A 54 13.261 0.355 -0.112 1.00 0.00 N ATOM 813 CA ARG A 54 14.386 0.109 0.782 1.00 0.00 C ATOM 814 C ARG A 54 13.908 -0.073 2.220 1.00 0.00 C ATOM 815 O ARG A 54 14.515 -0.809 2.997 1.00 0.00 O ATOM 816 CB ARG A 54 15.385 1.264 0.708 1.00 0.00 C ATOM 817 CG ARG A 54 16.726 0.953 1.354 1.00 0.00 C ATOM 818 CD ARG A 54 17.881 1.517 0.545 1.00 0.00 C ATOM 819 NE ARG A 54 19.165 1.328 1.217 1.00 0.00 N ATOM 820 CZ ARG A 54 19.602 2.097 2.211 1.00 0.00 C ATOM 821 NH1 ARG A 54 18.863 3.106 2.653 1.00 0.00 N ATOM 822 NH2 ARG A 54 20.782 1.856 2.767 1.00 0.00 N ATOM 0 H ARG A 54 13.302 1.246 -0.606 1.00 0.00 H new ATOM 0 HA ARG A 54 14.878 -0.809 0.462 1.00 0.00 H new ATOM 0 HB2 ARG A 54 15.547 1.526 -0.337 1.00 0.00 H new ATOM 0 HB3 ARG A 54 14.952 2.139 1.193 1.00 0.00 H new ATOM 0 HG2 ARG A 54 16.750 1.368 2.362 1.00 0.00 H new ATOM 0 HG3 ARG A 54 16.842 -0.126 1.451 1.00 0.00 H new ATOM 0 HD2 ARG A 54 17.909 1.034 -0.432 1.00 0.00 H new ATOM 0 HD3 ARG A 54 17.716 2.580 0.371 1.00 0.00 H new ATOM 0 HE ARG A 54 19.761 0.561 0.906 1.00 0.00 H new ATOM 0 HH11 ARG A 54 17.954 3.296 2.231 1.00 0.00 H new ATOM 0 HH12 ARG A 54 19.204 3.692 3.415 1.00 0.00 H new ATOM 0 HH21 ARG A 54 21.355 1.081 2.433 1.00 0.00 H new ATOM 0 HH22 ARG A 54 21.117 2.446 3.529 1.00 0.00 H new ATOM 836 N VAL A 55 12.816 0.602 2.565 1.00 0.00 N ATOM 837 CA VAL A 55 12.256 0.513 3.908 1.00 0.00 C ATOM 838 C VAL A 55 11.429 -0.755 4.077 1.00 0.00 C ATOM 839 O VAL A 55 11.373 -1.332 5.163 1.00 0.00 O ATOM 840 CB VAL A 55 11.374 1.734 4.229 1.00 0.00 C ATOM 841 CG1 VAL A 55 10.964 1.727 5.694 1.00 0.00 C ATOM 842 CG2 VAL A 55 12.097 3.025 3.876 1.00 0.00 C ATOM 0 H VAL A 55 12.302 1.216 1.933 1.00 0.00 H new ATOM 0 HA VAL A 55 13.097 0.488 4.600 1.00 0.00 H new ATOM 0 HB VAL A 55 10.470 1.675 3.622 1.00 0.00 H new ATOM 0 HG11 VAL A 55 10.341 2.597 5.902 1.00 0.00 H new ATOM 0 HG12 VAL A 55 10.402 0.819 5.910 1.00 0.00 H new ATOM 0 HG13 VAL A 55 11.855 1.760 6.321 1.00 0.00 H new ATOM 0 HG21 VAL A 55 11.457 3.876 4.110 1.00 0.00 H new ATOM 0 HG22 VAL A 55 13.019 3.095 4.453 1.00 0.00 H new ATOM 0 HG23 VAL A 55 12.333 3.031 2.812 1.00 0.00 H new ATOM 852 N ILE A 56 10.789 -1.186 2.995 1.00 0.00 N ATOM 853 CA ILE A 56 9.964 -2.388 3.023 1.00 0.00 C ATOM 854 C ILE A 56 10.820 -3.644 2.905 1.00 0.00 C ATOM 855 O ILE A 56 10.480 -4.694 3.449 1.00 0.00 O ATOM 856 CB ILE A 56 8.922 -2.383 1.889 1.00 0.00 C ATOM 857 CG1 ILE A 56 8.187 -1.042 1.848 1.00 0.00 C ATOM 858 CG2 ILE A 56 7.938 -3.528 2.068 1.00 0.00 C ATOM 859 CD1 ILE A 56 7.152 -0.953 0.746 1.00 0.00 C ATOM 0 H ILE A 56 10.826 -0.721 2.088 1.00 0.00 H new ATOM 0 HA ILE A 56 9.445 -2.392 3.982 1.00 0.00 H new ATOM 0 HB ILE A 56 9.440 -2.521 0.940 1.00 0.00 H new ATOM 0 HG12 ILE A 56 7.699 -0.875 2.808 1.00 0.00 H new ATOM 0 HG13 ILE A 56 8.915 -0.242 1.717 1.00 0.00 H new ATOM 0 HG21 ILE A 56 7.208 -3.510 1.259 1.00 0.00 H new ATOM 0 HG22 ILE A 56 8.476 -4.476 2.051 1.00 0.00 H new ATOM 0 HG23 ILE A 56 7.423 -3.420 3.023 1.00 0.00 H new ATOM 0 HD11 ILE A 56 6.671 0.025 0.777 1.00 0.00 H new ATOM 0 HD12 ILE A 56 7.637 -1.088 -0.221 1.00 0.00 H new ATOM 0 HD13 ILE A 56 6.402 -1.731 0.887 1.00 0.00 H new ATOM 871 N GLU A 57 11.934 -3.530 2.188 1.00 0.00 N ATOM 872 CA GLU A 57 12.840 -4.655 1.998 1.00 0.00 C ATOM 873 C GLU A 57 13.377 -5.151 3.337 1.00 0.00 C ATOM 874 O GLU A 57 13.583 -6.350 3.528 1.00 0.00 O ATOM 875 CB GLU A 57 14.001 -4.252 1.085 1.00 0.00 C ATOM 876 CG GLU A 57 13.814 -4.681 -0.361 1.00 0.00 C ATOM 877 CD GLU A 57 14.634 -5.906 -0.718 1.00 0.00 C ATOM 878 OE1 GLU A 57 15.879 -5.805 -0.718 1.00 0.00 O ATOM 879 OE2 GLU A 57 14.032 -6.964 -0.996 1.00 0.00 O ATOM 0 H GLU A 57 12.230 -2.669 1.729 1.00 0.00 H new ATOM 0 HA GLU A 57 12.283 -5.465 1.528 1.00 0.00 H new ATOM 0 HB2 GLU A 57 14.122 -3.169 1.121 1.00 0.00 H new ATOM 0 HB3 GLU A 57 14.923 -4.689 1.469 1.00 0.00 H new ATOM 0 HG2 GLU A 57 12.759 -4.890 -0.540 1.00 0.00 H new ATOM 0 HG3 GLU A 57 14.092 -3.858 -1.019 1.00 0.00 H new ATOM 886 N GLU A 58 13.603 -4.222 4.259 1.00 0.00 N ATOM 887 CA GLU A 58 14.116 -4.563 5.582 1.00 0.00 C ATOM 888 C GLU A 58 13.194 -5.552 6.287 1.00 0.00 C ATOM 889 O GLU A 58 13.646 -6.384 7.074 1.00 0.00 O ATOM 890 CB GLU A 58 14.273 -3.300 6.431 1.00 0.00 C ATOM 891 CG GLU A 58 15.296 -2.320 5.879 1.00 0.00 C ATOM 892 CD GLU A 58 15.037 -0.895 6.326 1.00 0.00 C ATOM 893 OE1 GLU A 58 14.519 -0.709 7.448 1.00 0.00 O ATOM 894 OE2 GLU A 58 15.350 0.036 5.554 1.00 0.00 O ATOM 0 H GLU A 58 13.439 -3.226 4.115 1.00 0.00 H new ATOM 0 HA GLU A 58 15.092 -5.032 5.455 1.00 0.00 H new ATOM 0 HB2 GLU A 58 13.307 -2.800 6.506 1.00 0.00 H new ATOM 0 HB3 GLU A 58 14.564 -3.585 7.442 1.00 0.00 H new ATOM 0 HG2 GLU A 58 16.293 -2.622 6.200 1.00 0.00 H new ATOM 0 HG3 GLU A 58 15.285 -2.363 4.790 1.00 0.00 H new ATOM 901 N ILE A 59 11.900 -5.455 6.000 1.00 0.00 N ATOM 902 CA ILE A 59 10.914 -6.342 6.608 1.00 0.00 C ATOM 903 C ILE A 59 11.037 -7.762 6.055 1.00 0.00 C ATOM 904 O ILE A 59 10.747 -8.003 4.883 1.00 0.00 O ATOM 905 CB ILE A 59 9.480 -5.834 6.367 1.00 0.00 C ATOM 906 CG1 ILE A 59 9.366 -4.356 6.748 1.00 0.00 C ATOM 907 CG2 ILE A 59 8.482 -6.667 7.159 1.00 0.00 C ATOM 908 CD1 ILE A 59 7.985 -3.780 6.526 1.00 0.00 C ATOM 0 H ILE A 59 11.510 -4.772 5.351 1.00 0.00 H new ATOM 0 HA ILE A 59 11.114 -6.352 7.679 1.00 0.00 H new ATOM 0 HB ILE A 59 9.250 -5.936 5.306 1.00 0.00 H new ATOM 0 HG12 ILE A 59 9.636 -4.238 7.797 1.00 0.00 H new ATOM 0 HG13 ILE A 59 10.088 -3.782 6.167 1.00 0.00 H new ATOM 0 HG21 ILE A 59 7.473 -6.296 6.978 1.00 0.00 H new ATOM 0 HG22 ILE A 59 8.547 -7.709 6.845 1.00 0.00 H new ATOM 0 HG23 ILE A 59 8.710 -6.594 8.222 1.00 0.00 H new ATOM 0 HD11 ILE A 59 7.978 -2.730 6.817 1.00 0.00 H new ATOM 0 HD12 ILE A 59 7.720 -3.866 5.472 1.00 0.00 H new ATOM 0 HD13 ILE A 59 7.261 -4.329 7.128 1.00 0.00 H new ATOM 920 N PRO A 60 11.469 -8.724 6.891 1.00 0.00 N ATOM 921 CA PRO A 60 11.626 -10.119 6.467 1.00 0.00 C ATOM 922 C PRO A 60 10.286 -10.828 6.298 1.00 0.00 C ATOM 923 O PRO A 60 10.069 -11.539 5.316 1.00 0.00 O ATOM 924 CB PRO A 60 12.421 -10.747 7.613 1.00 0.00 C ATOM 925 CG PRO A 60 12.065 -9.934 8.808 1.00 0.00 C ATOM 926 CD PRO A 60 11.840 -8.532 8.307 1.00 0.00 C ATOM 0 HA PRO A 60 12.114 -10.199 5.496 1.00 0.00 H new ATOM 0 HB2 PRO A 60 12.154 -11.795 7.753 1.00 0.00 H new ATOM 0 HB3 PRO A 60 13.493 -10.714 7.416 1.00 0.00 H new ATOM 0 HG2 PRO A 60 11.169 -10.324 9.292 1.00 0.00 H new ATOM 0 HG3 PRO A 60 12.864 -9.960 9.549 1.00 0.00 H new ATOM 0 HD2 PRO A 60 11.049 -8.029 8.864 1.00 0.00 H new ATOM 0 HD3 PRO A 60 12.738 -7.922 8.407 1.00 0.00 H new ATOM 934 N GLN A 61 9.392 -10.630 7.261 1.00 0.00 N ATOM 935 CA GLN A 61 8.072 -11.252 7.217 1.00 0.00 C ATOM 936 C GLN A 61 7.159 -10.521 6.240 1.00 0.00 C ATOM 937 O GLN A 61 7.375 -9.350 5.929 1.00 0.00 O ATOM 938 CB GLN A 61 7.443 -11.260 8.611 1.00 0.00 C ATOM 939 CG GLN A 61 8.079 -12.264 9.560 1.00 0.00 C ATOM 940 CD GLN A 61 7.279 -13.546 9.673 1.00 0.00 C ATOM 941 OE1 GLN A 61 6.133 -13.539 10.121 1.00 0.00 O ATOM 942 NE2 GLN A 61 7.883 -14.657 9.267 1.00 0.00 N ATOM 0 H GLN A 61 9.556 -10.045 8.080 1.00 0.00 H new ATOM 0 HA GLN A 61 8.193 -12.280 6.874 1.00 0.00 H new ATOM 0 HB2 GLN A 61 7.524 -10.263 9.043 1.00 0.00 H new ATOM 0 HB3 GLN A 61 6.380 -11.482 8.520 1.00 0.00 H new ATOM 0 HG2 GLN A 61 9.086 -12.498 9.214 1.00 0.00 H new ATOM 0 HG3 GLN A 61 8.177 -11.813 10.548 1.00 0.00 H new ATOM 0 HE21 GLN A 61 8.835 -14.616 8.902 1.00 0.00 H new ATOM 0 HE22 GLN A 61 7.395 -15.551 9.320 1.00 0.00 H new ATOM 951 N ALA A 62 6.137 -11.221 5.757 1.00 0.00 N ATOM 952 CA ALA A 62 5.189 -10.638 4.815 1.00 0.00 C ATOM 953 C ALA A 62 4.042 -9.949 5.546 1.00 0.00 C ATOM 954 O ALA A 62 3.478 -8.972 5.054 1.00 0.00 O ATOM 955 CB ALA A 62 4.653 -11.708 3.878 1.00 0.00 C ATOM 0 H ALA A 62 5.945 -12.192 6.003 1.00 0.00 H new ATOM 0 HA ALA A 62 5.714 -9.885 4.227 1.00 0.00 H new ATOM 0 HB1 ALA A 62 3.946 -11.259 3.180 1.00 0.00 H new ATOM 0 HB2 ALA A 62 5.479 -12.152 3.323 1.00 0.00 H new ATOM 0 HB3 ALA A 62 4.149 -12.481 4.458 1.00 0.00 H new ATOM 961 N GLU A 63 3.703 -10.463 6.723 1.00 0.00 N ATOM 962 CA GLU A 63 2.623 -9.896 7.523 1.00 0.00 C ATOM 963 C GLU A 63 2.909 -8.439 7.869 1.00 0.00 C ATOM 964 O GLU A 63 2.019 -7.591 7.813 1.00 0.00 O ATOM 965 CB GLU A 63 2.428 -10.709 8.805 1.00 0.00 C ATOM 966 CG GLU A 63 0.988 -10.745 9.288 1.00 0.00 C ATOM 967 CD GLU A 63 0.807 -11.617 10.515 1.00 0.00 C ATOM 968 OE1 GLU A 63 1.226 -11.192 11.612 1.00 0.00 O ATOM 969 OE2 GLU A 63 0.246 -12.724 10.379 1.00 0.00 O ATOM 0 H GLU A 63 4.160 -11.271 7.145 1.00 0.00 H new ATOM 0 HA GLU A 63 1.708 -9.937 6.933 1.00 0.00 H new ATOM 0 HB2 GLU A 63 2.771 -11.729 8.634 1.00 0.00 H new ATOM 0 HB3 GLU A 63 3.056 -10.289 9.591 1.00 0.00 H new ATOM 0 HG2 GLU A 63 0.659 -9.731 9.516 1.00 0.00 H new ATOM 0 HG3 GLU A 63 0.349 -11.115 8.486 1.00 0.00 H new ATOM 976 N ASP A 64 4.157 -8.156 8.225 1.00 0.00 N ATOM 977 CA ASP A 64 4.563 -6.801 8.580 1.00 0.00 C ATOM 978 C ASP A 64 4.799 -5.958 7.330 1.00 0.00 C ATOM 979 O ASP A 64 4.620 -4.741 7.347 1.00 0.00 O ATOM 980 CB ASP A 64 5.831 -6.831 9.435 1.00 0.00 C ATOM 981 CG ASP A 64 5.632 -7.583 10.737 1.00 0.00 C ATOM 982 OD1 ASP A 64 4.836 -7.115 11.577 1.00 0.00 O ATOM 983 OD2 ASP A 64 6.273 -8.640 10.916 1.00 0.00 O ATOM 0 H ASP A 64 4.905 -8.847 8.275 1.00 0.00 H new ATOM 0 HA ASP A 64 3.756 -6.348 9.156 1.00 0.00 H new ATOM 0 HB2 ASP A 64 6.637 -7.297 8.869 1.00 0.00 H new ATOM 0 HB3 ASP A 64 6.144 -5.810 9.652 1.00 0.00 H new ATOM 988 N LYS A 65 5.201 -6.615 6.247 1.00 0.00 N ATOM 989 CA LYS A 65 5.463 -5.927 4.987 1.00 0.00 C ATOM 990 C LYS A 65 4.220 -5.186 4.503 1.00 0.00 C ATOM 991 O LYS A 65 4.307 -4.055 4.026 1.00 0.00 O ATOM 992 CB LYS A 65 5.925 -6.927 3.924 1.00 0.00 C ATOM 993 CG LYS A 65 7.166 -6.481 3.170 1.00 0.00 C ATOM 994 CD LYS A 65 7.859 -7.655 2.495 1.00 0.00 C ATOM 995 CE LYS A 65 9.274 -7.298 2.073 1.00 0.00 C ATOM 996 NZ LYS A 65 9.609 -7.849 0.730 1.00 0.00 N ATOM 0 H LYS A 65 5.353 -7.623 6.216 1.00 0.00 H new ATOM 0 HA LYS A 65 6.254 -5.197 5.156 1.00 0.00 H new ATOM 0 HB2 LYS A 65 6.125 -7.886 4.402 1.00 0.00 H new ATOM 0 HB3 LYS A 65 5.115 -7.088 3.212 1.00 0.00 H new ATOM 0 HG2 LYS A 65 6.891 -5.739 2.420 1.00 0.00 H new ATOM 0 HG3 LYS A 65 7.857 -5.996 3.859 1.00 0.00 H new ATOM 0 HD2 LYS A 65 7.885 -8.505 3.177 1.00 0.00 H new ATOM 0 HD3 LYS A 65 7.285 -7.965 1.622 1.00 0.00 H new ATOM 0 HE2 LYS A 65 9.386 -6.214 2.059 1.00 0.00 H new ATOM 0 HE3 LYS A 65 9.980 -7.682 2.809 1.00 0.00 H new ATOM 0 HZ1 LYS A 65 10.583 -7.583 0.479 1.00 0.00 H new ATOM 0 HZ2 LYS A 65 9.527 -8.886 0.750 1.00 0.00 H new ATOM 0 HZ3 LYS A 65 8.951 -7.463 0.023 1.00 0.00 H new ATOM 1010 N LEU A 66 3.065 -5.830 4.631 1.00 0.00 N ATOM 1011 CA LEU A 66 1.805 -5.232 4.208 1.00 0.00 C ATOM 1012 C LEU A 66 1.471 -4.008 5.055 1.00 0.00 C ATOM 1013 O LEU A 66 0.835 -3.067 4.581 1.00 0.00 O ATOM 1014 CB LEU A 66 0.672 -6.256 4.303 1.00 0.00 C ATOM 1015 CG LEU A 66 -0.541 -5.965 3.417 1.00 0.00 C ATOM 1016 CD1 LEU A 66 -0.254 -6.354 1.975 1.00 0.00 C ATOM 1017 CD2 LEU A 66 -1.768 -6.699 3.936 1.00 0.00 C ATOM 0 H LEU A 66 2.976 -6.767 5.025 1.00 0.00 H new ATOM 0 HA LEU A 66 1.913 -4.915 3.171 1.00 0.00 H new ATOM 0 HB2 LEU A 66 1.067 -7.237 4.041 1.00 0.00 H new ATOM 0 HB3 LEU A 66 0.340 -6.313 5.340 1.00 0.00 H new ATOM 0 HG LEU A 66 -0.743 -4.894 3.449 1.00 0.00 H new ATOM 0 HD11 LEU A 66 -1.128 -6.140 1.360 1.00 0.00 H new ATOM 0 HD12 LEU A 66 0.598 -5.783 1.607 1.00 0.00 H new ATOM 0 HD13 LEU A 66 -0.026 -7.419 1.924 1.00 0.00 H new ATOM 0 HD21 LEU A 66 -2.621 -6.481 3.294 1.00 0.00 H new ATOM 0 HD22 LEU A 66 -1.578 -7.772 3.934 1.00 0.00 H new ATOM 0 HD23 LEU A 66 -1.985 -6.371 4.952 1.00 0.00 H new ATOM 1029 N ASP A 67 1.903 -4.029 6.313 1.00 0.00 N ATOM 1030 CA ASP A 67 1.650 -2.922 7.226 1.00 0.00 C ATOM 1031 C ASP A 67 2.360 -1.655 6.760 1.00 0.00 C ATOM 1032 O ASP A 67 1.880 -0.544 6.982 1.00 0.00 O ATOM 1033 CB ASP A 67 2.107 -3.285 8.640 1.00 0.00 C ATOM 1034 CG ASP A 67 1.167 -2.756 9.706 1.00 0.00 C ATOM 1035 OD1 ASP A 67 0.424 -1.795 9.418 1.00 0.00 O ATOM 1036 OD2 ASP A 67 1.174 -3.304 10.828 1.00 0.00 O ATOM 0 H ASP A 67 2.430 -4.801 6.722 1.00 0.00 H new ATOM 0 HA ASP A 67 0.577 -2.732 7.235 1.00 0.00 H new ATOM 0 HB2 ASP A 67 2.179 -4.369 8.728 1.00 0.00 H new ATOM 0 HB3 ASP A 67 3.106 -2.884 8.810 1.00 0.00 H new ATOM 1041 N ARG A 68 3.508 -1.830 6.113 1.00 0.00 N ATOM 1042 CA ARG A 68 4.285 -0.700 5.616 1.00 0.00 C ATOM 1043 C ARG A 68 3.756 -0.227 4.265 1.00 0.00 C ATOM 1044 O ARG A 68 3.813 0.961 3.947 1.00 0.00 O ATOM 1045 CB ARG A 68 5.762 -1.081 5.493 1.00 0.00 C ATOM 1046 CG ARG A 68 6.693 0.118 5.399 1.00 0.00 C ATOM 1047 CD ARG A 68 7.791 0.064 6.450 1.00 0.00 C ATOM 1048 NE ARG A 68 7.927 1.331 7.164 1.00 0.00 N ATOM 1049 CZ ARG A 68 8.543 1.459 8.336 1.00 0.00 C ATOM 1050 NH1 ARG A 68 9.082 0.401 8.930 1.00 0.00 N ATOM 1051 NH2 ARG A 68 8.621 2.648 8.918 1.00 0.00 N ATOM 0 H ARG A 68 3.921 -2.743 5.921 1.00 0.00 H new ATOM 0 HA ARG A 68 4.187 0.117 6.331 1.00 0.00 H new ATOM 0 HB2 ARG A 68 6.046 -1.685 6.355 1.00 0.00 H new ATOM 0 HB3 ARG A 68 5.896 -1.705 4.609 1.00 0.00 H new ATOM 0 HG2 ARG A 68 7.142 0.153 4.406 1.00 0.00 H new ATOM 0 HG3 ARG A 68 6.118 1.036 5.521 1.00 0.00 H new ATOM 0 HD2 ARG A 68 7.573 -0.732 7.162 1.00 0.00 H new ATOM 0 HD3 ARG A 68 8.738 -0.187 5.972 1.00 0.00 H new ATOM 0 HE ARG A 68 7.526 2.167 6.739 1.00 0.00 H new ATOM 0 HH11 ARG A 68 9.025 -0.516 8.488 1.00 0.00 H new ATOM 0 HH12 ARG A 68 9.553 0.506 9.829 1.00 0.00 H new ATOM 0 HH21 ARG A 68 8.209 3.465 8.467 1.00 0.00 H new ATOM 0 HH22 ARG A 68 9.093 2.746 9.817 1.00 0.00 H new ATOM 1065 N LEU A 69 3.243 -1.164 3.475 1.00 0.00 N ATOM 1066 CA LEU A 69 2.704 -0.843 2.158 1.00 0.00 C ATOM 1067 C LEU A 69 1.574 0.178 2.265 1.00 0.00 C ATOM 1068 O LEU A 69 1.356 0.975 1.353 1.00 0.00 O ATOM 1069 CB LEU A 69 2.198 -2.110 1.467 1.00 0.00 C ATOM 1070 CG LEU A 69 1.755 -1.924 0.015 1.00 0.00 C ATOM 1071 CD1 LEU A 69 2.899 -1.378 -0.826 1.00 0.00 C ATOM 1072 CD2 LEU A 69 1.248 -3.238 -0.560 1.00 0.00 C ATOM 0 H LEU A 69 3.189 -2.152 3.723 1.00 0.00 H new ATOM 0 HA LEU A 69 3.507 -0.409 1.562 1.00 0.00 H new ATOM 0 HB2 LEU A 69 2.987 -2.861 1.496 1.00 0.00 H new ATOM 0 HB3 LEU A 69 1.359 -2.507 2.039 1.00 0.00 H new ATOM 0 HG LEU A 69 0.939 -1.202 -0.006 1.00 0.00 H new ATOM 0 HD11 LEU A 69 2.565 -1.252 -1.856 1.00 0.00 H new ATOM 0 HD12 LEU A 69 3.216 -0.415 -0.427 1.00 0.00 H new ATOM 0 HD13 LEU A 69 3.736 -2.076 -0.798 1.00 0.00 H new ATOM 0 HD21 LEU A 69 0.937 -3.087 -1.594 1.00 0.00 H new ATOM 0 HD22 LEU A 69 2.044 -3.982 -0.526 1.00 0.00 H new ATOM 0 HD23 LEU A 69 0.399 -3.588 0.027 1.00 0.00 H new ATOM 1084 N PHE A 70 0.858 0.146 3.385 1.00 0.00 N ATOM 1085 CA PHE A 70 -0.249 1.068 3.610 1.00 0.00 C ATOM 1086 C PHE A 70 0.247 2.384 4.201 1.00 0.00 C ATOM 1087 O PHE A 70 -0.375 3.430 4.020 1.00 0.00 O ATOM 1088 CB PHE A 70 -1.283 0.435 4.544 1.00 0.00 C ATOM 1089 CG PHE A 70 -2.156 -0.585 3.870 1.00 0.00 C ATOM 1090 CD1 PHE A 70 -1.596 -1.643 3.171 1.00 0.00 C ATOM 1091 CD2 PHE A 70 -3.537 -0.486 3.936 1.00 0.00 C ATOM 1092 CE1 PHE A 70 -2.397 -2.583 2.551 1.00 0.00 C ATOM 1093 CE2 PHE A 70 -4.343 -1.423 3.317 1.00 0.00 C ATOM 1094 CZ PHE A 70 -3.772 -2.473 2.624 1.00 0.00 C ATOM 0 H PHE A 70 1.025 -0.508 4.150 1.00 0.00 H new ATOM 0 HA PHE A 70 -0.715 1.277 2.647 1.00 0.00 H new ATOM 0 HB2 PHE A 70 -0.765 -0.037 5.379 1.00 0.00 H new ATOM 0 HB3 PHE A 70 -1.912 1.221 4.962 1.00 0.00 H new ATOM 0 HD1 PHE A 70 -0.522 -1.734 3.110 1.00 0.00 H new ATOM 0 HD2 PHE A 70 -3.988 0.332 4.477 1.00 0.00 H new ATOM 0 HE1 PHE A 70 -1.948 -3.403 2.010 1.00 0.00 H new ATOM 0 HE2 PHE A 70 -5.418 -1.334 3.375 1.00 0.00 H new ATOM 0 HZ PHE A 70 -4.400 -3.207 2.140 1.00 0.00 H new ATOM 1104 N GLU A 71 1.370 2.326 4.911 1.00 0.00 N ATOM 1105 CA GLU A 71 1.948 3.513 5.529 1.00 0.00 C ATOM 1106 C GLU A 71 2.403 4.514 4.471 1.00 0.00 C ATOM 1107 O GLU A 71 2.158 5.714 4.593 1.00 0.00 O ATOM 1108 CB GLU A 71 3.126 3.124 6.425 1.00 0.00 C ATOM 1109 CG GLU A 71 3.038 3.696 7.831 1.00 0.00 C ATOM 1110 CD GLU A 71 3.918 4.915 8.022 1.00 0.00 C ATOM 1111 OE1 GLU A 71 5.118 4.739 8.322 1.00 0.00 O ATOM 1112 OE2 GLU A 71 3.409 6.045 7.872 1.00 0.00 O ATOM 0 H GLU A 71 1.898 1.468 5.072 1.00 0.00 H new ATOM 0 HA GLU A 71 1.178 3.986 6.139 1.00 0.00 H new ATOM 0 HB2 GLU A 71 3.181 2.037 6.487 1.00 0.00 H new ATOM 0 HB3 GLU A 71 4.052 3.464 5.961 1.00 0.00 H new ATOM 0 HG2 GLU A 71 2.003 3.962 8.046 1.00 0.00 H new ATOM 0 HG3 GLU A 71 3.326 2.929 8.550 1.00 0.00 H new ATOM 1119 N ILE A 72 3.067 4.014 3.435 1.00 0.00 N ATOM 1120 CA ILE A 72 3.557 4.866 2.357 1.00 0.00 C ATOM 1121 C ILE A 72 2.414 5.334 1.462 1.00 0.00 C ATOM 1122 O ILE A 72 2.189 6.533 1.301 1.00 0.00 O ATOM 1123 CB ILE A 72 4.605 4.136 1.494 1.00 0.00 C ATOM 1124 CG1 ILE A 72 5.685 3.513 2.381 1.00 0.00 C ATOM 1125 CG2 ILE A 72 5.226 5.096 0.490 1.00 0.00 C ATOM 1126 CD1 ILE A 72 6.480 2.426 1.692 1.00 0.00 C ATOM 0 H ILE A 72 3.279 3.023 3.318 1.00 0.00 H new ATOM 0 HA ILE A 72 4.024 5.731 2.827 1.00 0.00 H new ATOM 0 HB ILE A 72 4.108 3.337 0.944 1.00 0.00 H new ATOM 0 HG12 ILE A 72 6.367 4.296 2.713 1.00 0.00 H new ATOM 0 HG13 ILE A 72 5.216 3.099 3.274 1.00 0.00 H new ATOM 0 HG21 ILE A 72 5.964 4.566 -0.112 1.00 0.00 H new ATOM 0 HG22 ILE A 72 4.448 5.497 -0.160 1.00 0.00 H new ATOM 0 HG23 ILE A 72 5.712 5.914 1.021 1.00 0.00 H new ATOM 0 HD11 ILE A 72 7.227 2.030 2.380 1.00 0.00 H new ATOM 0 HD12 ILE A 72 5.809 1.624 1.384 1.00 0.00 H new ATOM 0 HD13 ILE A 72 6.978 2.840 0.815 1.00 0.00 H new ATOM 1138 N ILE A 73 1.694 4.379 0.881 1.00 0.00 N ATOM 1139 CA ILE A 73 0.574 4.696 0.002 1.00 0.00 C ATOM 1140 C ILE A 73 -0.541 5.401 0.768 1.00 0.00 C ATOM 1141 O ILE A 73 -1.278 6.210 0.205 1.00 0.00 O ATOM 1142 CB ILE A 73 0.005 3.427 -0.665 1.00 0.00 C ATOM 1143 CG1 ILE A 73 1.130 2.619 -1.317 1.00 0.00 C ATOM 1144 CG2 ILE A 73 -1.056 3.797 -1.694 1.00 0.00 C ATOM 1145 CD1 ILE A 73 0.647 1.368 -2.019 1.00 0.00 C ATOM 0 H ILE A 73 1.866 3.381 1.003 1.00 0.00 H new ATOM 0 HA ILE A 73 0.956 5.361 -0.772 1.00 0.00 H new ATOM 0 HB ILE A 73 -0.462 2.810 0.102 1.00 0.00 H new ATOM 0 HG12 ILE A 73 1.651 3.251 -2.036 1.00 0.00 H new ATOM 0 HG13 ILE A 73 1.856 2.340 -0.553 1.00 0.00 H new ATOM 0 HG21 ILE A 73 -1.447 2.890 -2.155 1.00 0.00 H new ATOM 0 HG22 ILE A 73 -1.868 4.334 -1.203 1.00 0.00 H new ATOM 0 HG23 ILE A 73 -0.613 4.432 -2.461 1.00 0.00 H new ATOM 0 HD11 ILE A 73 1.497 0.846 -2.458 1.00 0.00 H new ATOM 0 HD12 ILE A 73 0.152 0.715 -1.300 1.00 0.00 H new ATOM 0 HD13 ILE A 73 -0.056 1.641 -2.806 1.00 0.00 H new ATOM 1157 N GLY A 74 -0.658 5.089 2.054 1.00 0.00 N ATOM 1158 CA GLY A 74 -1.684 5.703 2.876 1.00 0.00 C ATOM 1159 C GLY A 74 -1.576 7.216 2.916 1.00 0.00 C ATOM 1160 O GLY A 74 -2.541 7.903 3.251 1.00 0.00 O ATOM 0 H GLY A 74 -0.060 4.422 2.542 1.00 0.00 H new ATOM 0 HA2 GLY A 74 -2.666 5.423 2.494 1.00 0.00 H new ATOM 0 HA3 GLY A 74 -1.613 5.311 3.891 1.00 0.00 H new ATOM 1164 N VAL A 75 -0.400 7.737 2.576 1.00 0.00 N ATOM 1165 CA VAL A 75 -0.176 9.177 2.577 1.00 0.00 C ATOM 1166 C VAL A 75 0.317 9.659 1.216 1.00 0.00 C ATOM 1167 O VAL A 75 1.093 10.610 1.127 1.00 0.00 O ATOM 1168 CB VAL A 75 0.847 9.585 3.653 1.00 0.00 C ATOM 1169 CG1 VAL A 75 0.253 9.421 5.045 1.00 0.00 C ATOM 1170 CG2 VAL A 75 2.124 8.772 3.511 1.00 0.00 C ATOM 0 H VAL A 75 0.410 7.184 2.297 1.00 0.00 H new ATOM 0 HA VAL A 75 -1.135 9.645 2.800 1.00 0.00 H new ATOM 0 HB VAL A 75 1.096 10.637 3.511 1.00 0.00 H new ATOM 0 HG11 VAL A 75 0.991 9.714 5.792 1.00 0.00 H new ATOM 0 HG12 VAL A 75 -0.631 10.052 5.140 1.00 0.00 H new ATOM 0 HG13 VAL A 75 -0.027 8.379 5.201 1.00 0.00 H new ATOM 0 HG21 VAL A 75 2.835 9.074 4.280 1.00 0.00 H new ATOM 0 HG22 VAL A 75 1.895 7.712 3.625 1.00 0.00 H new ATOM 0 HG23 VAL A 75 2.558 8.946 2.527 1.00 0.00 H new ATOM 1180 N LYS A 76 -0.141 8.997 0.158 1.00 0.00 N ATOM 1181 CA LYS A 76 0.252 9.358 -1.198 1.00 0.00 C ATOM 1182 C LYS A 76 -0.876 10.091 -1.916 1.00 0.00 C ATOM 1183 O LYS A 76 -0.772 11.283 -2.202 1.00 0.00 O ATOM 1184 CB LYS A 76 0.648 8.107 -1.988 1.00 0.00 C ATOM 1185 CG LYS A 76 1.812 8.332 -2.940 1.00 0.00 C ATOM 1186 CD LYS A 76 1.958 7.183 -3.924 1.00 0.00 C ATOM 1187 CE LYS A 76 2.805 6.061 -3.346 1.00 0.00 C ATOM 1188 NZ LYS A 76 2.540 4.760 -4.022 1.00 0.00 N ATOM 0 H LYS A 76 -0.785 8.208 0.215 1.00 0.00 H new ATOM 0 HA LYS A 76 1.111 10.026 -1.134 1.00 0.00 H new ATOM 0 HB2 LYS A 76 0.910 7.313 -1.288 1.00 0.00 H new ATOM 0 HB3 LYS A 76 -0.214 7.759 -2.557 1.00 0.00 H new ATOM 0 HG2 LYS A 76 1.662 9.263 -3.486 1.00 0.00 H new ATOM 0 HG3 LYS A 76 2.734 8.443 -2.369 1.00 0.00 H new ATOM 0 HD2 LYS A 76 0.972 6.799 -4.186 1.00 0.00 H new ATOM 0 HD3 LYS A 76 2.413 7.547 -4.845 1.00 0.00 H new ATOM 0 HE2 LYS A 76 3.860 6.314 -3.447 1.00 0.00 H new ATOM 0 HE3 LYS A 76 2.601 5.964 -2.280 1.00 0.00 H new ATOM 0 HZ1 LYS A 76 2.976 3.990 -3.476 1.00 0.00 H new ATOM 0 HZ2 LYS A 76 1.514 4.603 -4.083 1.00 0.00 H new ATOM 0 HZ3 LYS A 76 2.945 4.778 -4.980 1.00 0.00 H new ATOM 1202 N SER A 77 -1.956 9.369 -2.203 1.00 0.00 N ATOM 1203 CA SER A 77 -3.105 9.951 -2.887 1.00 0.00 C ATOM 1204 C SER A 77 -4.210 8.917 -3.071 1.00 0.00 C ATOM 1205 O SER A 77 -4.018 7.732 -2.799 1.00 0.00 O ATOM 1206 CB SER A 77 -2.687 10.513 -4.247 1.00 0.00 C ATOM 1207 OG SER A 77 -3.389 11.709 -4.543 1.00 0.00 O ATOM 0 H SER A 77 -2.059 8.381 -1.972 1.00 0.00 H new ATOM 0 HA SER A 77 -3.489 10.762 -2.269 1.00 0.00 H new ATOM 0 HB2 SER A 77 -1.614 10.707 -4.250 1.00 0.00 H new ATOM 0 HB3 SER A 77 -2.879 9.773 -5.024 1.00 0.00 H new ATOM 0 HG SER A 77 -3.103 12.049 -5.416 1.00 0.00 H new ATOM 1213 N GLN A 78 -5.369 9.373 -3.536 1.00 0.00 N ATOM 1214 CA GLN A 78 -6.506 8.488 -3.758 1.00 0.00 C ATOM 1215 C GLN A 78 -6.288 7.616 -4.991 1.00 0.00 C ATOM 1216 O GLN A 78 -6.820 6.511 -5.083 1.00 0.00 O ATOM 1217 CB GLN A 78 -7.791 9.304 -3.917 1.00 0.00 C ATOM 1218 CG GLN A 78 -9.035 8.583 -3.424 1.00 0.00 C ATOM 1219 CD GLN A 78 -10.278 8.972 -4.199 1.00 0.00 C ATOM 1220 OE1 GLN A 78 -11.072 8.117 -4.591 1.00 0.00 O ATOM 1221 NE2 GLN A 78 -10.454 10.270 -4.423 1.00 0.00 N ATOM 0 H GLN A 78 -5.545 10.351 -3.766 1.00 0.00 H new ATOM 0 HA GLN A 78 -6.601 7.837 -2.889 1.00 0.00 H new ATOM 0 HB2 GLN A 78 -7.685 10.242 -3.372 1.00 0.00 H new ATOM 0 HB3 GLN A 78 -7.922 9.559 -4.969 1.00 0.00 H new ATOM 0 HG2 GLN A 78 -8.883 7.507 -3.504 1.00 0.00 H new ATOM 0 HG3 GLN A 78 -9.185 8.806 -2.368 1.00 0.00 H new ATOM 0 HE21 GLN A 78 -9.770 10.944 -4.080 1.00 0.00 H new ATOM 0 HE22 GLN A 78 -11.273 10.592 -4.938 1.00 0.00 H new ATOM 1230 N GLU A 79 -5.500 8.121 -5.937 1.00 0.00 N ATOM 1231 CA GLU A 79 -5.213 7.388 -7.163 1.00 0.00 C ATOM 1232 C GLU A 79 -4.469 6.092 -6.862 1.00 0.00 C ATOM 1233 O GLU A 79 -4.684 5.074 -7.520 1.00 0.00 O ATOM 1234 CB GLU A 79 -4.386 8.254 -8.115 1.00 0.00 C ATOM 1235 CG GLU A 79 -5.227 9.138 -9.021 1.00 0.00 C ATOM 1236 CD GLU A 79 -5.336 8.591 -10.431 1.00 0.00 C ATOM 1237 OE1 GLU A 79 -4.284 8.280 -11.029 1.00 0.00 O ATOM 1238 OE2 GLU A 79 -6.472 8.475 -10.937 1.00 0.00 O ATOM 0 H GLU A 79 -5.050 9.034 -5.876 1.00 0.00 H new ATOM 0 HA GLU A 79 -6.162 7.138 -7.638 1.00 0.00 H new ATOM 0 HB2 GLU A 79 -3.715 8.882 -7.530 1.00 0.00 H new ATOM 0 HB3 GLU A 79 -3.761 7.607 -8.731 1.00 0.00 H new ATOM 0 HG2 GLU A 79 -6.226 9.241 -8.597 1.00 0.00 H new ATOM 0 HG3 GLU A 79 -4.791 10.136 -9.055 1.00 0.00 H new ATOM 1245 N ALA A 80 -3.594 6.136 -5.863 1.00 0.00 N ATOM 1246 CA ALA A 80 -2.817 4.965 -5.475 1.00 0.00 C ATOM 1247 C ALA A 80 -3.458 4.248 -4.291 1.00 0.00 C ATOM 1248 O ALA A 80 -3.386 3.023 -4.181 1.00 0.00 O ATOM 1249 CB ALA A 80 -1.389 5.366 -5.141 1.00 0.00 C ATOM 0 H ALA A 80 -3.405 6.970 -5.307 1.00 0.00 H new ATOM 0 HA ALA A 80 -2.801 4.275 -6.319 1.00 0.00 H new ATOM 0 HB1 ALA A 80 -0.821 4.482 -4.853 1.00 0.00 H new ATOM 0 HB2 ALA A 80 -0.927 5.826 -6.014 1.00 0.00 H new ATOM 0 HB3 ALA A 80 -1.395 6.078 -4.316 1.00 0.00 H new ATOM 1255 N SER A 81 -4.083 5.019 -3.408 1.00 0.00 N ATOM 1256 CA SER A 81 -4.737 4.457 -2.231 1.00 0.00 C ATOM 1257 C SER A 81 -5.879 3.529 -2.633 1.00 0.00 C ATOM 1258 O SER A 81 -5.947 2.383 -2.187 1.00 0.00 O ATOM 1259 CB SER A 81 -5.264 5.578 -1.332 1.00 0.00 C ATOM 1260 OG SER A 81 -6.297 5.111 -0.480 1.00 0.00 O ATOM 0 H SER A 81 -4.151 6.034 -3.484 1.00 0.00 H new ATOM 0 HA SER A 81 -4.000 3.875 -1.679 1.00 0.00 H new ATOM 0 HB2 SER A 81 -4.448 5.980 -0.731 1.00 0.00 H new ATOM 0 HB3 SER A 81 -5.639 6.395 -1.948 1.00 0.00 H new ATOM 0 HG SER A 81 -6.592 5.839 0.106 1.00 0.00 H new ATOM 1266 N GLN A 82 -6.774 4.032 -3.477 1.00 0.00 N ATOM 1267 CA GLN A 82 -7.914 3.248 -3.940 1.00 0.00 C ATOM 1268 C GLN A 82 -7.453 1.971 -4.636 1.00 0.00 C ATOM 1269 O GLN A 82 -8.147 0.955 -4.613 1.00 0.00 O ATOM 1270 CB GLN A 82 -8.778 4.079 -4.890 1.00 0.00 C ATOM 1271 CG GLN A 82 -10.271 3.885 -4.681 1.00 0.00 C ATOM 1272 CD GLN A 82 -10.758 2.538 -5.176 1.00 0.00 C ATOM 1273 OE1 GLN A 82 -11.207 2.407 -6.315 1.00 0.00 O ATOM 1274 NE2 GLN A 82 -10.674 1.527 -4.318 1.00 0.00 N ATOM 0 H GLN A 82 -6.732 4.979 -3.854 1.00 0.00 H new ATOM 0 HA GLN A 82 -8.508 2.969 -3.070 1.00 0.00 H new ATOM 0 HB2 GLN A 82 -8.535 5.134 -4.760 1.00 0.00 H new ATOM 0 HB3 GLN A 82 -8.527 3.819 -5.918 1.00 0.00 H new ATOM 0 HG2 GLN A 82 -10.502 3.983 -3.620 1.00 0.00 H new ATOM 0 HG3 GLN A 82 -10.813 4.676 -5.199 1.00 0.00 H new ATOM 0 HE21 GLN A 82 -10.295 1.681 -3.384 1.00 0.00 H new ATOM 0 HE22 GLN A 82 -10.989 0.597 -4.594 1.00 0.00 H new ATOM 1283 N THR A 83 -6.278 2.030 -5.253 1.00 0.00 N ATOM 1284 CA THR A 83 -5.725 0.877 -5.955 1.00 0.00 C ATOM 1285 C THR A 83 -5.137 -0.129 -4.971 1.00 0.00 C ATOM 1286 O THR A 83 -5.151 -1.335 -5.218 1.00 0.00 O ATOM 1287 CB THR A 83 -4.650 1.325 -6.947 1.00 0.00 C ATOM 1288 OG1 THR A 83 -5.161 2.309 -7.829 1.00 0.00 O ATOM 1289 CG2 THR A 83 -4.103 0.193 -7.789 1.00 0.00 C ATOM 0 H THR A 83 -5.690 2.863 -5.281 1.00 0.00 H new ATOM 0 HA THR A 83 -6.535 0.393 -6.501 1.00 0.00 H new ATOM 0 HB THR A 83 -3.841 1.724 -6.335 1.00 0.00 H new ATOM 0 HG1 THR A 83 -4.887 3.198 -7.522 1.00 0.00 H new ATOM 0 HG21 THR A 83 -3.345 0.580 -8.471 1.00 0.00 H new ATOM 0 HG22 THR A 83 -3.657 -0.560 -7.140 1.00 0.00 H new ATOM 0 HG23 THR A 83 -4.912 -0.257 -8.364 1.00 0.00 H new ATOM 1297 N LEU A 84 -4.622 0.375 -3.855 1.00 0.00 N ATOM 1298 CA LEU A 84 -4.029 -0.479 -2.832 1.00 0.00 C ATOM 1299 C LEU A 84 -5.079 -1.397 -2.213 1.00 0.00 C ATOM 1300 O LEU A 84 -4.936 -2.619 -2.229 1.00 0.00 O ATOM 1301 CB LEU A 84 -3.373 0.374 -1.743 1.00 0.00 C ATOM 1302 CG LEU A 84 -2.780 -0.412 -0.573 1.00 0.00 C ATOM 1303 CD1 LEU A 84 -1.784 -1.445 -1.074 1.00 0.00 C ATOM 1304 CD2 LEU A 84 -2.118 0.532 0.421 1.00 0.00 C ATOM 0 H LEU A 84 -4.603 1.371 -3.636 1.00 0.00 H new ATOM 0 HA LEU A 84 -3.267 -1.097 -3.307 1.00 0.00 H new ATOM 0 HB2 LEU A 84 -2.582 0.971 -2.198 1.00 0.00 H new ATOM 0 HB3 LEU A 84 -4.115 1.071 -1.353 1.00 0.00 H new ATOM 0 HG LEU A 84 -3.589 -0.936 -0.064 1.00 0.00 H new ATOM 0 HD11 LEU A 84 -1.373 -1.994 -0.227 1.00 0.00 H new ATOM 0 HD12 LEU A 84 -2.287 -2.139 -1.747 1.00 0.00 H new ATOM 0 HD13 LEU A 84 -0.977 -0.943 -1.608 1.00 0.00 H new ATOM 0 HD21 LEU A 84 -1.701 -0.044 1.247 1.00 0.00 H new ATOM 0 HD22 LEU A 84 -1.320 1.083 -0.077 1.00 0.00 H new ATOM 0 HD23 LEU A 84 -2.858 1.234 0.805 1.00 0.00 H new ATOM 1316 N LEU A 85 -6.132 -0.799 -1.667 1.00 0.00 N ATOM 1317 CA LEU A 85 -7.206 -1.562 -1.042 1.00 0.00 C ATOM 1318 C LEU A 85 -7.889 -2.475 -2.056 1.00 0.00 C ATOM 1319 O LEU A 85 -8.379 -3.549 -1.708 1.00 0.00 O ATOM 1320 CB LEU A 85 -8.233 -0.618 -0.416 1.00 0.00 C ATOM 1321 CG LEU A 85 -7.668 0.366 0.610 1.00 0.00 C ATOM 1322 CD1 LEU A 85 -8.590 1.564 0.767 1.00 0.00 C ATOM 1323 CD2 LEU A 85 -7.458 -0.326 1.949 1.00 0.00 C ATOM 0 H LEU A 85 -6.265 0.212 -1.645 1.00 0.00 H new ATOM 0 HA LEU A 85 -6.768 -2.182 -0.260 1.00 0.00 H new ATOM 0 HB2 LEU A 85 -8.716 -0.052 -1.212 1.00 0.00 H new ATOM 0 HB3 LEU A 85 -9.007 -1.216 0.065 1.00 0.00 H new ATOM 0 HG LEU A 85 -6.703 0.723 0.250 1.00 0.00 H new ATOM 0 HD11 LEU A 85 -8.171 2.252 1.501 1.00 0.00 H new ATOM 0 HD12 LEU A 85 -8.691 2.073 -0.191 1.00 0.00 H new ATOM 0 HD13 LEU A 85 -9.570 1.227 1.104 1.00 0.00 H new ATOM 0 HD21 LEU A 85 -7.056 0.387 2.668 1.00 0.00 H new ATOM 0 HD22 LEU A 85 -8.411 -0.710 2.313 1.00 0.00 H new ATOM 0 HD23 LEU A 85 -6.757 -1.152 1.826 1.00 0.00 H new ATOM 1335 N ASP A 86 -7.918 -2.040 -3.311 1.00 0.00 N ATOM 1336 CA ASP A 86 -8.541 -2.819 -4.376 1.00 0.00 C ATOM 1337 C ASP A 86 -7.647 -3.979 -4.799 1.00 0.00 C ATOM 1338 O ASP A 86 -8.132 -5.063 -5.121 1.00 0.00 O ATOM 1339 CB ASP A 86 -8.841 -1.925 -5.581 1.00 0.00 C ATOM 1340 CG ASP A 86 -9.836 -2.556 -6.535 1.00 0.00 C ATOM 1341 OD1 ASP A 86 -10.843 -3.118 -6.056 1.00 0.00 O ATOM 1342 OD2 ASP A 86 -9.608 -2.487 -7.761 1.00 0.00 O ATOM 0 H ASP A 86 -7.518 -1.153 -3.616 1.00 0.00 H new ATOM 0 HA ASP A 86 -9.476 -3.228 -3.993 1.00 0.00 H new ATOM 0 HB2 ASP A 86 -9.232 -0.969 -5.232 1.00 0.00 H new ATOM 0 HB3 ASP A 86 -7.914 -1.715 -6.114 1.00 0.00 H new ATOM 1347 N SER A 87 -6.339 -3.744 -4.796 1.00 0.00 N ATOM 1348 CA SER A 87 -5.377 -4.769 -5.181 1.00 0.00 C ATOM 1349 C SER A 87 -5.434 -5.958 -4.226 1.00 0.00 C ATOM 1350 O SER A 87 -5.182 -7.096 -4.621 1.00 0.00 O ATOM 1351 CB SER A 87 -3.962 -4.188 -5.204 1.00 0.00 C ATOM 1352 OG SER A 87 -3.001 -5.194 -5.473 1.00 0.00 O ATOM 0 H SER A 87 -5.921 -2.852 -4.531 1.00 0.00 H new ATOM 0 HA SER A 87 -5.637 -5.116 -6.181 1.00 0.00 H new ATOM 0 HB2 SER A 87 -3.898 -3.408 -5.963 1.00 0.00 H new ATOM 0 HB3 SER A 87 -3.743 -3.719 -4.245 1.00 0.00 H new ATOM 0 HG SER A 87 -2.105 -4.796 -5.484 1.00 0.00 H new ATOM 1358 N VAL A 88 -5.766 -5.685 -2.969 1.00 0.00 N ATOM 1359 CA VAL A 88 -5.854 -6.731 -1.957 1.00 0.00 C ATOM 1360 C VAL A 88 -7.030 -7.665 -2.230 1.00 0.00 C ATOM 1361 O VAL A 88 -6.902 -8.884 -2.127 1.00 0.00 O ATOM 1362 CB VAL A 88 -6.004 -6.136 -0.545 1.00 0.00 C ATOM 1363 CG1 VAL A 88 -5.894 -7.227 0.510 1.00 0.00 C ATOM 1364 CG2 VAL A 88 -4.965 -5.051 -0.310 1.00 0.00 C ATOM 0 H VAL A 88 -5.979 -4.748 -2.627 1.00 0.00 H new ATOM 0 HA VAL A 88 -4.924 -7.297 -2.008 1.00 0.00 H new ATOM 0 HB VAL A 88 -6.993 -5.684 -0.465 1.00 0.00 H new ATOM 0 HG11 VAL A 88 -6.003 -6.787 1.501 1.00 0.00 H new ATOM 0 HG12 VAL A 88 -6.680 -7.966 0.353 1.00 0.00 H new ATOM 0 HG13 VAL A 88 -4.920 -7.711 0.433 1.00 0.00 H new ATOM 0 HG21 VAL A 88 -5.086 -4.642 0.693 1.00 0.00 H new ATOM 0 HG22 VAL A 88 -3.966 -5.476 -0.410 1.00 0.00 H new ATOM 0 HG23 VAL A 88 -5.097 -4.256 -1.044 1.00 0.00 H new ATOM 1374 N TYR A 89 -8.173 -7.083 -2.576 1.00 0.00 N ATOM 1375 CA TYR A 89 -9.371 -7.864 -2.863 1.00 0.00 C ATOM 1376 C TYR A 89 -9.373 -8.353 -4.307 1.00 0.00 C ATOM 1377 O TYR A 89 -9.913 -9.417 -4.612 1.00 0.00 O ATOM 1378 CB TYR A 89 -10.625 -7.028 -2.593 1.00 0.00 C ATOM 1379 CG TYR A 89 -10.622 -6.352 -1.240 1.00 0.00 C ATOM 1380 CD1 TYR A 89 -10.336 -7.070 -0.085 1.00 0.00 C ATOM 1381 CD2 TYR A 89 -10.907 -4.999 -1.118 1.00 0.00 C ATOM 1382 CE1 TYR A 89 -10.333 -6.456 1.153 1.00 0.00 C ATOM 1383 CE2 TYR A 89 -10.906 -4.377 0.117 1.00 0.00 C ATOM 1384 CZ TYR A 89 -10.619 -5.110 1.249 1.00 0.00 C ATOM 1385 OH TYR A 89 -10.616 -4.496 2.480 1.00 0.00 O ATOM 0 H TYR A 89 -8.295 -6.074 -2.665 1.00 0.00 H new ATOM 0 HA TYR A 89 -9.372 -8.734 -2.206 1.00 0.00 H new ATOM 0 HB2 TYR A 89 -10.719 -6.269 -3.369 1.00 0.00 H new ATOM 0 HB3 TYR A 89 -11.503 -7.670 -2.667 1.00 0.00 H new ATOM 0 HD1 TYR A 89 -10.113 -8.124 -0.156 1.00 0.00 H new ATOM 0 HD2 TYR A 89 -11.133 -4.422 -2.003 1.00 0.00 H new ATOM 0 HE1 TYR A 89 -10.108 -7.027 2.041 1.00 0.00 H new ATOM 0 HE2 TYR A 89 -11.129 -3.323 0.194 1.00 0.00 H new ATOM 0 HH TYR A 89 -10.836 -3.547 2.373 1.00 0.00 H new ATOM 1395 N SER A 90 -8.768 -7.569 -5.193 1.00 0.00 N ATOM 1396 CA SER A 90 -8.701 -7.923 -6.606 1.00 0.00 C ATOM 1397 C SER A 90 -7.888 -9.198 -6.813 1.00 0.00 C ATOM 1398 O SER A 90 -8.151 -9.971 -7.734 1.00 0.00 O ATOM 1399 CB SER A 90 -8.084 -6.778 -7.411 1.00 0.00 C ATOM 1400 OG SER A 90 -8.013 -7.102 -8.789 1.00 0.00 O ATOM 0 H SER A 90 -8.317 -6.685 -4.958 1.00 0.00 H new ATOM 0 HA SER A 90 -9.718 -8.101 -6.957 1.00 0.00 H new ATOM 0 HB2 SER A 90 -8.678 -5.874 -7.277 1.00 0.00 H new ATOM 0 HB3 SER A 90 -7.085 -6.561 -7.033 1.00 0.00 H new ATOM 0 HG SER A 90 -7.616 -6.353 -9.281 1.00 0.00 H new ATOM 1406 N HIS A 91 -6.901 -9.411 -5.949 1.00 0.00 N ATOM 1407 CA HIS A 91 -6.051 -10.593 -6.037 1.00 0.00 C ATOM 1408 C HIS A 91 -6.547 -11.692 -5.103 1.00 0.00 C ATOM 1409 O HIS A 91 -6.456 -12.878 -5.420 1.00 0.00 O ATOM 1410 CB HIS A 91 -4.604 -10.233 -5.697 1.00 0.00 C ATOM 1411 CG HIS A 91 -4.017 -9.194 -6.600 1.00 0.00 C ATOM 1412 ND1 HIS A 91 -4.194 -9.176 -7.966 1.00 0.00 N ATOM 1413 CD2 HIS A 91 -3.241 -8.119 -6.309 1.00 0.00 C ATOM 1414 CE1 HIS A 91 -3.534 -8.115 -8.452 1.00 0.00 C ATOM 1415 NE2 HIS A 91 -2.940 -7.440 -7.486 1.00 0.00 N ATOM 0 H HIS A 91 -6.670 -8.781 -5.181 1.00 0.00 H new ATOM 0 HA HIS A 91 -6.095 -10.965 -7.061 1.00 0.00 H new ATOM 0 HB2 HIS A 91 -4.560 -9.875 -4.668 1.00 0.00 H new ATOM 0 HB3 HIS A 91 -3.993 -11.134 -5.748 1.00 0.00 H new ATOM 0 HD2 HIS A 91 -2.910 -7.836 -5.321 1.00 0.00 H new ATOM 0 HE1 HIS A 91 -3.494 -7.848 -9.498 1.00 0.00 H new ATOM 0 HE2 HIS A 91 -2.377 -6.595 -7.582 1.00 0.00 H new ATOM 1423 N LEU A 92 -7.071 -11.291 -3.950 1.00 0.00 N ATOM 1424 CA LEU A 92 -7.581 -12.241 -2.970 1.00 0.00 C ATOM 1425 C LEU A 92 -9.093 -12.100 -2.808 1.00 0.00 C ATOM 1426 O LEU A 92 -9.566 -11.328 -1.974 1.00 0.00 O ATOM 1427 CB LEU A 92 -6.890 -12.033 -1.620 1.00 0.00 C ATOM 1428 CG LEU A 92 -5.409 -12.413 -1.585 1.00 0.00 C ATOM 1429 CD1 LEU A 92 -4.733 -11.810 -0.365 1.00 0.00 C ATOM 1430 CD2 LEU A 92 -5.249 -13.926 -1.593 1.00 0.00 C ATOM 0 H LEU A 92 -7.153 -10.313 -3.671 1.00 0.00 H new ATOM 0 HA LEU A 92 -7.365 -13.247 -3.330 1.00 0.00 H new ATOM 0 HB2 LEU A 92 -6.987 -10.985 -1.337 1.00 0.00 H new ATOM 0 HB3 LEU A 92 -7.417 -12.617 -0.866 1.00 0.00 H new ATOM 0 HG LEU A 92 -4.928 -12.011 -2.477 1.00 0.00 H new ATOM 0 HD11 LEU A 92 -3.680 -12.091 -0.357 1.00 0.00 H new ATOM 0 HD12 LEU A 92 -4.819 -10.724 -0.401 1.00 0.00 H new ATOM 0 HD13 LEU A 92 -5.215 -12.182 0.539 1.00 0.00 H new ATOM 0 HD21 LEU A 92 -4.189 -14.180 -1.568 1.00 0.00 H new ATOM 0 HD22 LEU A 92 -5.744 -14.349 -0.719 1.00 0.00 H new ATOM 0 HD23 LEU A 92 -5.699 -14.335 -2.498 1.00 0.00 H new ATOM 1442 N PRO A 93 -9.875 -12.847 -3.606 1.00 0.00 N ATOM 1443 CA PRO A 93 -11.340 -12.801 -3.546 1.00 0.00 C ATOM 1444 C PRO A 93 -11.886 -13.403 -2.255 1.00 0.00 C ATOM 1445 O PRO A 93 -12.988 -13.066 -1.820 1.00 0.00 O ATOM 1446 CB PRO A 93 -11.774 -13.637 -4.751 1.00 0.00 C ATOM 1447 CG PRO A 93 -10.633 -14.559 -5.006 1.00 0.00 C ATOM 1448 CD PRO A 93 -9.393 -13.797 -4.628 1.00 0.00 C ATOM 0 HA PRO A 93 -11.716 -11.778 -3.564 1.00 0.00 H new ATOM 0 HB2 PRO A 93 -12.689 -14.190 -4.540 1.00 0.00 H new ATOM 0 HB3 PRO A 93 -11.975 -13.007 -5.618 1.00 0.00 H new ATOM 0 HG2 PRO A 93 -10.727 -15.470 -4.414 1.00 0.00 H new ATOM 0 HG3 PRO A 93 -10.602 -14.861 -6.053 1.00 0.00 H new ATOM 0 HD2 PRO A 93 -8.621 -14.457 -4.232 1.00 0.00 H new ATOM 0 HD3 PRO A 93 -8.961 -13.280 -5.485 1.00 0.00 H new ATOM 1456 N ASP A 94 -11.110 -14.294 -1.646 1.00 0.00 N ATOM 1457 CA ASP A 94 -11.519 -14.943 -0.405 1.00 0.00 C ATOM 1458 C ASP A 94 -11.811 -13.912 0.682 1.00 0.00 C ATOM 1459 O ASP A 94 -12.647 -14.139 1.557 1.00 0.00 O ATOM 1460 CB ASP A 94 -10.433 -15.910 0.071 1.00 0.00 C ATOM 1461 CG ASP A 94 -11.006 -17.211 0.599 1.00 0.00 C ATOM 1462 OD1 ASP A 94 -12.003 -17.697 0.024 1.00 0.00 O ATOM 1463 OD2 ASP A 94 -10.458 -17.743 1.587 1.00 0.00 O ATOM 0 H ASP A 94 -10.195 -14.583 -1.991 1.00 0.00 H new ATOM 0 HA ASP A 94 -12.434 -15.502 -0.603 1.00 0.00 H new ATOM 0 HB2 ASP A 94 -9.754 -16.124 -0.755 1.00 0.00 H new ATOM 0 HB3 ASP A 94 -9.843 -15.432 0.853 1.00 0.00 H new ATOM 1468 N LEU A 95 -11.118 -12.781 0.621 1.00 0.00 N ATOM 1469 CA LEU A 95 -11.304 -11.717 1.600 1.00 0.00 C ATOM 1470 C LEU A 95 -12.721 -11.161 1.537 1.00 0.00 C ATOM 1471 O LEU A 95 -13.547 -11.431 2.409 1.00 0.00 O ATOM 1472 CB LEU A 95 -10.291 -10.594 1.366 1.00 0.00 C ATOM 1473 CG LEU A 95 -8.830 -10.977 1.613 1.00 0.00 C ATOM 1474 CD1 LEU A 95 -7.903 -9.853 1.175 1.00 0.00 C ATOM 1475 CD2 LEU A 95 -8.606 -11.315 3.080 1.00 0.00 C ATOM 0 H LEU A 95 -10.422 -12.577 -0.096 1.00 0.00 H new ATOM 0 HA LEU A 95 -11.143 -12.140 2.592 1.00 0.00 H new ATOM 0 HB2 LEU A 95 -10.390 -10.244 0.338 1.00 0.00 H new ATOM 0 HB3 LEU A 95 -10.545 -9.755 2.014 1.00 0.00 H new ATOM 0 HG LEU A 95 -8.601 -11.862 1.019 1.00 0.00 H new ATOM 0 HD11 LEU A 95 -6.868 -10.143 1.358 1.00 0.00 H new ATOM 0 HD12 LEU A 95 -8.043 -9.659 0.112 1.00 0.00 H new ATOM 0 HD13 LEU A 95 -8.133 -8.950 1.741 1.00 0.00 H new ATOM 0 HD21 LEU A 95 -7.561 -11.585 3.236 1.00 0.00 H new ATOM 0 HD22 LEU A 95 -8.853 -10.449 3.695 1.00 0.00 H new ATOM 0 HD23 LEU A 95 -9.243 -12.153 3.362 1.00 0.00 H new ATOM 1487 N LEU A 96 -12.995 -10.382 0.498 1.00 0.00 N ATOM 1488 CA LEU A 96 -14.312 -9.784 0.314 1.00 0.00 C ATOM 1489 C LEU A 96 -14.963 -10.287 -0.972 1.00 0.00 C ATOM 1490 O LEU A 96 -14.888 -9.636 -2.014 1.00 0.00 O ATOM 1491 CB LEU A 96 -14.202 -8.257 0.287 1.00 0.00 C ATOM 1492 CG LEU A 96 -14.876 -7.538 1.457 1.00 0.00 C ATOM 1493 CD1 LEU A 96 -14.680 -6.035 1.345 1.00 0.00 C ATOM 1494 CD2 LEU A 96 -16.358 -7.882 1.507 1.00 0.00 C ATOM 0 H LEU A 96 -12.321 -10.149 -0.232 1.00 0.00 H new ATOM 0 HA LEU A 96 -14.940 -10.079 1.154 1.00 0.00 H new ATOM 0 HB2 LEU A 96 -13.147 -7.984 0.272 1.00 0.00 H new ATOM 0 HB3 LEU A 96 -14.638 -7.893 -0.643 1.00 0.00 H new ATOM 0 HG LEU A 96 -14.411 -7.875 2.384 1.00 0.00 H new ATOM 0 HD11 LEU A 96 -15.166 -5.541 2.186 1.00 0.00 H new ATOM 0 HD12 LEU A 96 -13.615 -5.805 1.356 1.00 0.00 H new ATOM 0 HD13 LEU A 96 -15.118 -5.679 0.412 1.00 0.00 H new ATOM 0 HD21 LEU A 96 -16.824 -7.363 2.345 1.00 0.00 H new ATOM 0 HD22 LEU A 96 -16.835 -7.572 0.577 1.00 0.00 H new ATOM 0 HD23 LEU A 96 -16.478 -8.958 1.635 1.00 0.00 H new ATOM 1506 N SER A 97 -15.600 -11.450 -0.889 1.00 0.00 N ATOM 1507 CA SER A 97 -16.266 -12.042 -2.044 1.00 0.00 C ATOM 1508 C SER A 97 -16.963 -13.342 -1.660 1.00 0.00 C ATOM 1509 O SER A 97 -18.073 -13.623 -2.117 1.00 0.00 O ATOM 1510 CB SER A 97 -15.255 -12.304 -3.162 1.00 0.00 C ATOM 1511 OG SER A 97 -15.865 -12.197 -4.437 1.00 0.00 O ATOM 0 H SER A 97 -15.669 -12.002 -0.034 1.00 0.00 H new ATOM 0 HA SER A 97 -17.018 -11.338 -2.400 1.00 0.00 H new ATOM 0 HB2 SER A 97 -14.433 -11.592 -3.088 1.00 0.00 H new ATOM 0 HB3 SER A 97 -14.826 -13.299 -3.043 1.00 0.00 H new ATOM 0 HG SER A 97 -15.198 -12.367 -5.134 1.00 0.00 H new ATOM 1517 N GLY A 98 -16.308 -14.133 -0.816 1.00 0.00 N ATOM 1518 CA GLY A 98 -16.880 -15.393 -0.382 1.00 0.00 C ATOM 1519 C GLY A 98 -17.698 -15.252 0.889 1.00 0.00 C ATOM 1520 O GLY A 98 -18.384 -14.247 1.076 1.00 0.00 O ATOM 0 H GLY A 98 -15.390 -13.923 -0.425 1.00 0.00 H new ATOM 0 HA2 GLY A 98 -17.512 -15.794 -1.175 1.00 0.00 H new ATOM 0 HA3 GLY A 98 -16.080 -16.114 -0.217 1.00 0.00 H new ATOM 1524 N PRO A 99 -17.649 -16.250 1.789 1.00 0.00 N ATOM 1525 CA PRO A 99 -18.399 -16.214 3.049 1.00 0.00 C ATOM 1526 C PRO A 99 -18.185 -14.913 3.816 1.00 0.00 C ATOM 1527 O PRO A 99 -19.143 -14.238 4.192 1.00 0.00 O ATOM 1528 CB PRO A 99 -17.831 -17.397 3.833 1.00 0.00 C ATOM 1529 CG PRO A 99 -17.342 -18.342 2.791 1.00 0.00 C ATOM 1530 CD PRO A 99 -16.858 -17.488 1.652 1.00 0.00 C ATOM 0 HA PRO A 99 -19.475 -16.271 2.884 1.00 0.00 H new ATOM 0 HB2 PRO A 99 -17.023 -17.083 4.493 1.00 0.00 H new ATOM 0 HB3 PRO A 99 -18.593 -17.859 4.460 1.00 0.00 H new ATOM 0 HG2 PRO A 99 -16.538 -18.968 3.178 1.00 0.00 H new ATOM 0 HG3 PRO A 99 -18.139 -19.011 2.466 1.00 0.00 H new ATOM 0 HD2 PRO A 99 -15.788 -17.291 1.724 1.00 0.00 H new ATOM 0 HD3 PRO A 99 -17.029 -17.969 0.689 1.00 0.00 H new ATOM 1538 N SER A 100 -16.922 -14.568 4.045 1.00 0.00 N ATOM 1539 CA SER A 100 -16.583 -13.348 4.767 1.00 0.00 C ATOM 1540 C SER A 100 -17.020 -12.114 3.985 1.00 0.00 C ATOM 1541 O SER A 100 -16.364 -11.710 3.024 1.00 0.00 O ATOM 1542 CB SER A 100 -15.078 -13.291 5.034 1.00 0.00 C ATOM 1543 OG SER A 100 -14.355 -13.997 4.041 1.00 0.00 O ATOM 0 H SER A 100 -16.117 -15.116 3.741 1.00 0.00 H new ATOM 0 HA SER A 100 -17.114 -13.359 5.719 1.00 0.00 H new ATOM 0 HB2 SER A 100 -14.749 -12.252 5.058 1.00 0.00 H new ATOM 0 HB3 SER A 100 -14.864 -13.716 6.015 1.00 0.00 H new ATOM 0 HG SER A 100 -13.990 -13.363 3.389 1.00 0.00 H new ATOM 1549 N SER A 101 -18.132 -11.518 4.403 1.00 0.00 N ATOM 1550 CA SER A 101 -18.657 -10.329 3.741 1.00 0.00 C ATOM 1551 C SER A 101 -19.425 -9.452 4.726 1.00 0.00 C ATOM 1552 O SER A 101 -20.440 -8.851 4.376 1.00 0.00 O ATOM 1553 CB SER A 101 -19.567 -10.727 2.578 1.00 0.00 C ATOM 1554 OG SER A 101 -20.017 -9.587 1.868 1.00 0.00 O ATOM 0 H SER A 101 -18.687 -11.839 5.197 1.00 0.00 H new ATOM 0 HA SER A 101 -17.814 -9.757 3.354 1.00 0.00 H new ATOM 0 HB2 SER A 101 -19.028 -11.391 1.902 1.00 0.00 H new ATOM 0 HB3 SER A 101 -20.424 -11.284 2.957 1.00 0.00 H new ATOM 0 HG SER A 101 -20.391 -8.936 2.498 1.00 0.00 H new ATOM 1560 N GLY A 102 -18.932 -9.385 5.958 1.00 0.00 N ATOM 1561 CA GLY A 102 -19.584 -8.579 6.975 1.00 0.00 C ATOM 1562 C GLY A 102 -20.192 -9.421 8.080 1.00 0.00 C ATOM 1563 O GLY A 102 -21.122 -8.932 8.755 1.00 0.00 O ATOM 1564 OXT GLY A 102 -19.738 -10.569 8.270 1.00 0.00 O ATOM 0 H GLY A 102 -18.093 -9.874 6.271 1.00 0.00 H new ATOM 0 HA2 GLY A 102 -18.860 -7.888 7.406 1.00 0.00 H new ATOM 0 HA3 GLY A 102 -20.364 -7.975 6.511 1.00 0.00 H new TER 1568 GLY A 102