USER MOD reduce.3.24.130724 H: found=0, std=0, add=942, rem=0, adj=39 USER MOD reduce.3.24.130724 removed 944 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 23 TYR OH : rot -158:sc= 0.617 USER MOD Set 1.2: A 122 MET CE :methyl 134:sc= -0.945 (180deg=-2.71) USER MOD Set 2.1: A 8 LYS NZ :NH3+ 159:sc= 1.78 (180deg=0.721) USER MOD Set 2.2: A 25 TYR OH : rot 180:sc= 0.574 USER MOD Set 2.3: A 115 MET CE :methyl -155:sc= -0.942 (180deg=-3.28!) USER MOD Set 3.1: A 111 LYS NZ :NH3+ 152:sc= 1.22 (180deg=1.08) USER MOD Set 3.2: A 114 THR OG1 : rot -90:sc= 0.511 USER MOD Set 3.3: A 117 GLN : amide:sc= 0.816 K(o=2.5,f=2) USER MOD Set 4.1: A 33 GLN : amide:sc= -0.0542 K(o=-0.13,f=-1.2) USER MOD Set 4.2: A 88 MET CE :methyl 174:sc= -0.0719 (180deg=-0.0939) USER MOD Set 5.1: A 64 LYS NZ :NH3+ -172:sc= 0.758 (180deg=-0.0797) USER MOD Set 5.2: A 65 ASN : amide:sc= -1.18! C(o=-0.42!,f=-12!) USER MOD Set 6.1: A 13 ASN : amide:sc= 0.602 K(o=1.8,f=-6.2!) USER MOD Set 6.2: A 128 LYS NZ :NH3+ 179:sc= 1.22 (180deg=0) USER MOD Set 7.1: A 9 LYS NZ :NH3+ -153:sc= 1.31 (180deg=-0.00642) USER MOD Set 7.2: A 22 THR OG1 : rot 103:sc= 2.31 USER MOD Single : A 7 SER OG : rot 180:sc= 0 USER MOD Single : A 11 SER OG : rot 32:sc= 0.205 USER MOD Single : A 15 ASN : amide:sc= -0.0506 K(o=-0.051,f=-0.98) USER MOD Single : A 17 THR OG1 : rot 180:sc= 0 USER MOD Single : A 26 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 29 LYS NZ :NH3+ 177:sc= 1.23 (180deg=1.13) USER MOD Single : A 32 LYS NZ :NH3+ -164:sc= 1.27 (180deg=1.01) USER MOD Single : A 34 SER OG : rot 180:sc= 0 USER MOD Single : A 35 SER OG : rot 180:sc= 0 USER MOD Single : A 37 THR OG1 : rot 180:sc= 0 USER MOD Single : A 38 LYS NZ :NH3+ -162:sc= 1.33 (180deg=1.06) USER MOD Single : A 40 GLN : amide:sc= -0.0839 X(o=-0.084,f=-0.19) USER MOD Single : A 43 SER OG : rot 150:sc= -0.099 USER MOD Single : A 47 THR OG1 : rot 180:sc= 0 USER MOD Single : A 48 THR OG1 : rot 180:sc= 0.00918 USER MOD Single : A 49 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 54 LYS NZ :NH3+ 154:sc= 1.25 (180deg=0.913) USER MOD Single : A 55 THR OG1 : rot 180:sc= 0 USER MOD Single : A 60 SER OG : rot 67:sc= 0.169 USER MOD Single : A 62 LYS NZ :NH3+ 163:sc= -0.0692 (180deg=-0.341) USER MOD Single : A 63 TYR OH : rot 180:sc= 0 USER MOD Single : A 72 LYS NZ :NH3+ -163:sc= 0 (180deg=-0.0955) USER MOD Single : A 74 THR OG1 : rot -34:sc= -2.83! USER MOD Single : A 75 TYR OH : rot -140:sc= -2.34! USER MOD Single : A 76 THR OG1 : rot 139:sc= 0.297 USER MOD Single : A 78 THR OG1 : rot 74:sc= 1.27 USER MOD Single : A 79 TYR OH : rot 180:sc= -0.362 USER MOD Single : A 81 GLN : amide:sc= 0 K(o=0,f=-1.9!) USER MOD Single : A 83 ASN : amide:sc= -4.24! K(o=-4.2!,f=-0.99) USER MOD Single : A 85 THR OG1 : rot 78:sc= 0.0621 USER MOD Single : A 90 LYS NZ :NH3+ 168:sc=-0.00808 (180deg=-0.129) USER MOD Single : A 94 LYS NZ :NH3+ -169:sc= -0.0337 (180deg=-0.214) USER MOD Single : A 97 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 110 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 118 MET CE :methyl 143:sc= 0 (180deg=-3.09!) USER MOD Single : A 123 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 131 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD ----------------------------------------------------------------- ATOM 61 N GLU A 5 12.961 0.045 13.095 1.00 0.00 N ATOM 62 CA GLU A 5 11.931 -0.196 12.099 1.00 0.00 C ATOM 63 C GLU A 5 11.745 1.071 11.282 1.00 0.00 C ATOM 64 O GLU A 5 11.225 2.068 11.788 1.00 0.00 O ATOM 65 CB GLU A 5 10.606 -0.572 12.766 1.00 0.00 C ATOM 66 CG GLU A 5 10.704 -1.744 13.726 1.00 0.00 C ATOM 67 CD GLU A 5 9.376 -2.050 14.386 1.00 0.00 C ATOM 68 OE1 GLU A 5 8.864 -1.183 15.121 1.00 0.00 O ATOM 69 OE2 GLU A 5 8.842 -3.160 14.178 1.00 0.00 O ATOM 0 HA GLU A 5 12.237 -1.023 11.459 1.00 0.00 H new ATOM 0 HB2 GLU A 5 10.225 0.295 13.306 1.00 0.00 H new ATOM 0 HB3 GLU A 5 9.877 -0.811 11.992 1.00 0.00 H new ATOM 0 HG2 GLU A 5 11.053 -2.625 13.188 1.00 0.00 H new ATOM 0 HG3 GLU A 5 11.447 -1.524 14.492 1.00 0.00 H new ATOM 76 N GLU A 6 12.166 1.050 10.032 1.00 0.00 N ATOM 77 CA GLU A 6 12.145 2.261 9.239 1.00 0.00 C ATOM 78 C GLU A 6 10.905 2.296 8.375 1.00 0.00 C ATOM 79 O GLU A 6 10.486 1.280 7.820 1.00 0.00 O ATOM 80 CB GLU A 6 13.402 2.402 8.377 1.00 0.00 C ATOM 81 CG GLU A 6 13.476 3.744 7.662 1.00 0.00 C ATOM 82 CD GLU A 6 14.810 3.996 6.995 1.00 0.00 C ATOM 83 OE1 GLU A 6 15.845 3.925 7.689 1.00 0.00 O ATOM 84 OE2 GLU A 6 14.829 4.305 5.787 1.00 0.00 O ATOM 0 H GLU A 6 12.521 0.223 9.552 1.00 0.00 H new ATOM 0 HA GLU A 6 12.127 3.106 9.927 1.00 0.00 H new ATOM 0 HB2 GLU A 6 14.284 2.281 9.006 1.00 0.00 H new ATOM 0 HB3 GLU A 6 13.424 1.600 7.639 1.00 0.00 H new ATOM 0 HG2 GLU A 6 12.688 3.791 6.911 1.00 0.00 H new ATOM 0 HG3 GLU A 6 13.280 4.541 8.379 1.00 0.00 H new ATOM 91 N SER A 7 10.315 3.472 8.288 1.00 0.00 N ATOM 92 CA SER A 7 9.108 3.661 7.522 1.00 0.00 C ATOM 93 C SER A 7 9.438 4.308 6.185 1.00 0.00 C ATOM 94 O SER A 7 9.888 5.454 6.126 1.00 0.00 O ATOM 95 CB SER A 7 8.131 4.533 8.310 1.00 0.00 C ATOM 96 OG SER A 7 7.990 4.054 9.638 1.00 0.00 O ATOM 0 H SER A 7 10.660 4.316 8.745 1.00 0.00 H new ATOM 0 HA SER A 7 8.644 2.693 7.334 1.00 0.00 H new ATOM 0 HB2 SER A 7 8.487 5.563 8.326 1.00 0.00 H new ATOM 0 HB3 SER A 7 7.160 4.538 7.815 1.00 0.00 H new ATOM 0 HG SER A 7 7.362 4.626 10.127 1.00 0.00 H new ATOM 102 N LYS A 8 9.220 3.567 5.119 1.00 0.00 N ATOM 103 CA LYS A 8 9.448 4.071 3.781 1.00 0.00 C ATOM 104 C LYS A 8 8.127 4.195 3.060 1.00 0.00 C ATOM 105 O LYS A 8 7.624 3.229 2.497 1.00 0.00 O ATOM 106 CB LYS A 8 10.370 3.128 3.003 1.00 0.00 C ATOM 107 CG LYS A 8 11.838 3.218 3.395 1.00 0.00 C ATOM 108 CD LYS A 8 12.569 4.263 2.567 1.00 0.00 C ATOM 109 CE LYS A 8 14.058 4.284 2.874 1.00 0.00 C ATOM 110 NZ LYS A 8 14.697 2.953 2.685 1.00 0.00 N ATOM 0 H LYS A 8 8.882 2.605 5.154 1.00 0.00 H new ATOM 0 HA LYS A 8 9.925 5.049 3.849 1.00 0.00 H new ATOM 0 HB2 LYS A 8 10.029 2.103 3.151 1.00 0.00 H new ATOM 0 HB3 LYS A 8 10.277 3.345 1.939 1.00 0.00 H new ATOM 0 HG2 LYS A 8 11.919 3.468 4.453 1.00 0.00 H new ATOM 0 HG3 LYS A 8 12.313 2.246 3.259 1.00 0.00 H new ATOM 0 HD2 LYS A 8 12.419 4.057 1.507 1.00 0.00 H new ATOM 0 HD3 LYS A 8 12.143 5.247 2.764 1.00 0.00 H new ATOM 0 HE2 LYS A 8 14.548 5.014 2.230 1.00 0.00 H new ATOM 0 HE3 LYS A 8 14.209 4.614 3.902 1.00 0.00 H new ATOM 0 HZ1 LYS A 8 15.721 3.075 2.554 1.00 0.00 H new ATOM 0 HZ2 LYS A 8 14.523 2.362 3.523 1.00 0.00 H new ATOM 0 HZ3 LYS A 8 14.293 2.490 1.846 1.00 0.00 H new ATOM 124 N LYS A 9 7.552 5.376 3.106 1.00 0.00 N ATOM 125 CA LYS A 9 6.320 5.637 2.395 1.00 0.00 C ATOM 126 C LYS A 9 6.658 6.108 0.994 1.00 0.00 C ATOM 127 O LYS A 9 7.673 6.759 0.789 1.00 0.00 O ATOM 128 CB LYS A 9 5.489 6.697 3.134 1.00 0.00 C ATOM 129 CG LYS A 9 4.090 6.902 2.566 1.00 0.00 C ATOM 130 CD LYS A 9 3.404 8.119 3.177 1.00 0.00 C ATOM 131 CE LYS A 9 3.177 7.968 4.677 1.00 0.00 C ATOM 132 NZ LYS A 9 2.128 6.960 4.989 1.00 0.00 N ATOM 0 H LYS A 9 7.918 6.172 3.629 1.00 0.00 H new ATOM 0 HA LYS A 9 5.726 4.725 2.341 1.00 0.00 H new ATOM 0 HB2 LYS A 9 5.405 6.410 4.182 1.00 0.00 H new ATOM 0 HB3 LYS A 9 6.023 7.647 3.105 1.00 0.00 H new ATOM 0 HG2 LYS A 9 4.151 7.024 1.485 1.00 0.00 H new ATOM 0 HG3 LYS A 9 3.488 6.013 2.753 1.00 0.00 H new ATOM 0 HD2 LYS A 9 4.011 9.005 2.992 1.00 0.00 H new ATOM 0 HD3 LYS A 9 2.446 8.279 2.682 1.00 0.00 H new ATOM 0 HE2 LYS A 9 4.112 7.677 5.157 1.00 0.00 H new ATOM 0 HE3 LYS A 9 2.889 8.931 5.098 1.00 0.00 H new ATOM 0 HZ1 LYS A 9 1.684 7.192 5.900 1.00 0.00 H new ATOM 0 HZ2 LYS A 9 1.406 6.967 4.240 1.00 0.00 H new ATOM 0 HZ3 LYS A 9 2.560 6.015 5.045 1.00 0.00 H new ATOM 146 N PHE A 10 5.854 5.727 0.030 1.00 0.00 N ATOM 147 CA PHE A 10 5.945 6.311 -1.288 1.00 0.00 C ATOM 148 C PHE A 10 4.546 6.697 -1.708 1.00 0.00 C ATOM 149 O PHE A 10 3.585 6.001 -1.379 1.00 0.00 O ATOM 150 CB PHE A 10 6.595 5.358 -2.307 1.00 0.00 C ATOM 151 CG PHE A 10 5.669 4.334 -2.899 1.00 0.00 C ATOM 152 CD1 PHE A 10 4.920 4.630 -4.029 1.00 0.00 C ATOM 153 CD2 PHE A 10 5.553 3.077 -2.338 1.00 0.00 C ATOM 154 CE1 PHE A 10 4.075 3.692 -4.583 1.00 0.00 C ATOM 155 CE2 PHE A 10 4.708 2.136 -2.890 1.00 0.00 C ATOM 156 CZ PHE A 10 3.968 2.443 -4.013 1.00 0.00 C ATOM 0 H PHE A 10 5.130 5.016 0.133 1.00 0.00 H new ATOM 0 HA PHE A 10 6.592 7.188 -1.257 1.00 0.00 H new ATOM 0 HB2 PHE A 10 7.021 5.951 -3.116 1.00 0.00 H new ATOM 0 HB3 PHE A 10 7.422 4.840 -1.821 1.00 0.00 H new ATOM 0 HD1 PHE A 10 5.000 5.608 -4.480 1.00 0.00 H new ATOM 0 HD2 PHE A 10 6.129 2.828 -1.459 1.00 0.00 H new ATOM 0 HE1 PHE A 10 3.498 3.936 -5.463 1.00 0.00 H new ATOM 0 HE2 PHE A 10 4.626 1.157 -2.442 1.00 0.00 H new ATOM 0 HZ PHE A 10 3.307 1.706 -4.444 1.00 0.00 H new ATOM 166 N SER A 11 4.417 7.802 -2.396 1.00 0.00 N ATOM 167 CA SER A 11 3.110 8.296 -2.747 1.00 0.00 C ATOM 168 C SER A 11 2.986 8.396 -4.261 1.00 0.00 C ATOM 169 O SER A 11 3.589 9.269 -4.888 1.00 0.00 O ATOM 170 CB SER A 11 2.883 9.646 -2.060 1.00 0.00 C ATOM 171 OG SER A 11 3.698 10.662 -2.624 1.00 0.00 O ATOM 0 H SER A 11 5.196 8.374 -2.723 1.00 0.00 H new ATOM 0 HA SER A 11 2.338 7.608 -2.403 1.00 0.00 H new ATOM 0 HB2 SER A 11 1.834 9.929 -2.149 1.00 0.00 H new ATOM 0 HB3 SER A 11 3.099 9.554 -0.996 1.00 0.00 H new ATOM 0 HG SER A 11 3.842 10.476 -3.575 1.00 0.00 H new ATOM 177 N ALA A 12 2.237 7.481 -4.849 1.00 0.00 N ATOM 178 CA ALA A 12 2.064 7.457 -6.290 1.00 0.00 C ATOM 179 C ALA A 12 0.663 7.903 -6.667 1.00 0.00 C ATOM 180 O ALA A 12 -0.316 7.211 -6.395 1.00 0.00 O ATOM 181 CB ALA A 12 2.354 6.072 -6.840 1.00 0.00 C ATOM 0 H ALA A 12 1.738 6.744 -4.350 1.00 0.00 H new ATOM 0 HA ALA A 12 2.775 8.155 -6.733 1.00 0.00 H new ATOM 0 HB1 ALA A 12 2.219 6.074 -7.922 1.00 0.00 H new ATOM 0 HB2 ALA A 12 3.381 5.794 -6.603 1.00 0.00 H new ATOM 0 HB3 ALA A 12 1.671 5.352 -6.391 1.00 0.00 H new ATOM 187 N ASN A 13 0.573 9.068 -7.281 1.00 0.00 N ATOM 188 CA ASN A 13 -0.710 9.624 -7.677 1.00 0.00 C ATOM 189 C ASN A 13 -1.005 9.241 -9.116 1.00 0.00 C ATOM 190 O ASN A 13 -0.617 9.949 -10.050 1.00 0.00 O ATOM 191 CB ASN A 13 -0.711 11.151 -7.535 1.00 0.00 C ATOM 192 CG ASN A 13 -0.266 11.620 -6.161 1.00 0.00 C ATOM 193 OD1 ASN A 13 0.926 11.817 -5.919 1.00 0.00 O ATOM 194 ND2 ASN A 13 -1.215 11.814 -5.257 1.00 0.00 N ATOM 0 H ASN A 13 1.376 9.651 -7.518 1.00 0.00 H new ATOM 0 HA ASN A 13 -1.482 9.219 -7.023 1.00 0.00 H new ATOM 0 HB2 ASN A 13 -0.053 11.581 -8.290 1.00 0.00 H new ATOM 0 HB3 ASN A 13 -1.714 11.528 -7.734 1.00 0.00 H new ATOM 0 HD21 ASN A 13 -0.970 12.138 -4.321 1.00 0.00 H new ATOM 0 HD22 ASN A 13 -2.191 11.639 -5.497 1.00 0.00 H new ATOM 201 N LEU A 14 -1.651 8.103 -9.300 1.00 0.00 N ATOM 202 CA LEU A 14 -1.944 7.610 -10.633 1.00 0.00 C ATOM 203 C LEU A 14 -3.440 7.681 -10.936 1.00 0.00 C ATOM 204 O LEU A 14 -4.239 6.908 -10.411 1.00 0.00 O ATOM 205 CB LEU A 14 -1.378 6.191 -10.824 1.00 0.00 C ATOM 206 CG LEU A 14 -1.408 5.271 -9.592 1.00 0.00 C ATOM 207 CD1 LEU A 14 -2.699 4.468 -9.538 1.00 0.00 C ATOM 208 CD2 LEU A 14 -0.198 4.346 -9.592 1.00 0.00 C ATOM 0 H LEU A 14 -1.982 7.504 -8.544 1.00 0.00 H new ATOM 0 HA LEU A 14 -1.448 8.259 -11.355 1.00 0.00 H new ATOM 0 HB2 LEU A 14 -1.935 5.706 -11.626 1.00 0.00 H new ATOM 0 HB3 LEU A 14 -0.345 6.278 -11.160 1.00 0.00 H new ATOM 0 HG LEU A 14 -1.368 5.896 -8.700 1.00 0.00 H new ATOM 0 HD11 LEU A 14 -2.692 3.827 -8.657 1.00 0.00 H new ATOM 0 HD12 LEU A 14 -3.549 5.149 -9.485 1.00 0.00 H new ATOM 0 HD13 LEU A 14 -2.782 3.853 -10.434 1.00 0.00 H new ATOM 0 HD21 LEU A 14 -0.233 3.701 -8.714 1.00 0.00 H new ATOM 0 HD22 LEU A 14 -0.209 3.733 -10.493 1.00 0.00 H new ATOM 0 HD23 LEU A 14 0.715 4.941 -9.569 1.00 0.00 H new ATOM 220 N ASN A 15 -3.800 8.660 -11.763 1.00 0.00 N ATOM 221 CA ASN A 15 -5.179 8.864 -12.212 1.00 0.00 C ATOM 222 C ASN A 15 -6.140 8.986 -11.026 1.00 0.00 C ATOM 223 O ASN A 15 -7.086 8.206 -10.886 1.00 0.00 O ATOM 224 CB ASN A 15 -5.614 7.728 -13.147 1.00 0.00 C ATOM 225 CG ASN A 15 -6.922 8.027 -13.857 1.00 0.00 C ATOM 226 OD1 ASN A 15 -7.266 9.187 -14.091 1.00 0.00 O ATOM 227 ND2 ASN A 15 -7.651 6.984 -14.223 1.00 0.00 N ATOM 0 H ASN A 15 -3.141 9.339 -12.144 1.00 0.00 H new ATOM 0 HA ASN A 15 -5.215 9.802 -12.765 1.00 0.00 H new ATOM 0 HB2 ASN A 15 -4.834 7.553 -13.888 1.00 0.00 H new ATOM 0 HB3 ASN A 15 -5.719 6.808 -12.571 1.00 0.00 H new ATOM 0 HD21 ASN A 15 -8.532 7.126 -14.717 1.00 0.00 H new ATOM 0 HD22 ASN A 15 -7.332 6.039 -14.011 1.00 0.00 H new ATOM 234 N GLY A 16 -5.863 9.948 -10.153 1.00 0.00 N ATOM 235 CA GLY A 16 -6.730 10.207 -9.016 1.00 0.00 C ATOM 236 C GLY A 16 -6.508 9.235 -7.872 1.00 0.00 C ATOM 237 O GLY A 16 -6.947 9.470 -6.748 1.00 0.00 O ATOM 0 H GLY A 16 -5.048 10.558 -10.213 1.00 0.00 H new ATOM 0 HA2 GLY A 16 -6.561 11.224 -8.661 1.00 0.00 H new ATOM 0 HA3 GLY A 16 -7.770 10.150 -9.338 1.00 0.00 H new ATOM 241 N THR A 17 -5.829 8.138 -8.150 1.00 0.00 N ATOM 242 CA THR A 17 -5.568 7.140 -7.136 1.00 0.00 C ATOM 243 C THR A 17 -4.215 7.390 -6.482 1.00 0.00 C ATOM 244 O THR A 17 -3.169 7.158 -7.090 1.00 0.00 O ATOM 245 CB THR A 17 -5.608 5.726 -7.739 1.00 0.00 C ATOM 246 OG1 THR A 17 -6.810 5.572 -8.508 1.00 0.00 O ATOM 247 CG2 THR A 17 -5.566 4.667 -6.650 1.00 0.00 C ATOM 0 H THR A 17 -5.449 7.918 -9.071 1.00 0.00 H new ATOM 0 HA THR A 17 -6.347 7.215 -6.377 1.00 0.00 H new ATOM 0 HB THR A 17 -4.734 5.597 -8.378 1.00 0.00 H new ATOM 0 HG1 THR A 17 -6.838 4.672 -8.895 1.00 0.00 H new ATOM 0 HG21 THR A 17 -5.596 3.677 -7.104 1.00 0.00 H new ATOM 0 HG22 THR A 17 -4.647 4.774 -6.073 1.00 0.00 H new ATOM 0 HG23 THR A 17 -6.425 4.789 -5.990 1.00 0.00 H new ATOM 255 N GLU A 18 -4.241 7.897 -5.259 1.00 0.00 N ATOM 256 CA GLU A 18 -3.018 8.170 -4.524 1.00 0.00 C ATOM 257 C GLU A 18 -2.622 6.941 -3.725 1.00 0.00 C ATOM 258 O GLU A 18 -3.132 6.715 -2.629 1.00 0.00 O ATOM 259 CB GLU A 18 -3.196 9.353 -3.570 1.00 0.00 C ATOM 260 CG GLU A 18 -4.134 10.431 -4.084 1.00 0.00 C ATOM 261 CD GLU A 18 -4.138 11.666 -3.204 1.00 0.00 C ATOM 262 OE1 GLU A 18 -3.359 11.713 -2.226 1.00 0.00 O ATOM 263 OE2 GLU A 18 -4.927 12.591 -3.477 1.00 0.00 O ATOM 0 H GLU A 18 -5.097 8.128 -4.755 1.00 0.00 H new ATOM 0 HA GLU A 18 -2.239 8.421 -5.244 1.00 0.00 H new ATOM 0 HB2 GLU A 18 -3.573 8.983 -2.617 1.00 0.00 H new ATOM 0 HB3 GLU A 18 -2.220 9.798 -3.375 1.00 0.00 H new ATOM 0 HG2 GLU A 18 -3.841 10.711 -5.096 1.00 0.00 H new ATOM 0 HG3 GLU A 18 -5.145 10.029 -4.145 1.00 0.00 H new ATOM 270 N ILE A 19 -1.738 6.137 -4.277 1.00 0.00 N ATOM 271 CA ILE A 19 -1.299 4.940 -3.590 1.00 0.00 C ATOM 272 C ILE A 19 -0.068 5.248 -2.756 1.00 0.00 C ATOM 273 O ILE A 19 1.033 5.419 -3.279 1.00 0.00 O ATOM 274 CB ILE A 19 -1.001 3.781 -4.567 1.00 0.00 C ATOM 275 CG1 ILE A 19 -2.256 3.456 -5.384 1.00 0.00 C ATOM 276 CG2 ILE A 19 -0.525 2.551 -3.803 1.00 0.00 C ATOM 277 CD1 ILE A 19 -2.108 2.259 -6.299 1.00 0.00 C ATOM 0 H ILE A 19 -1.312 6.288 -5.191 1.00 0.00 H new ATOM 0 HA ILE A 19 -2.113 4.616 -2.942 1.00 0.00 H new ATOM 0 HB ILE A 19 -0.207 4.086 -5.249 1.00 0.00 H new ATOM 0 HG12 ILE A 19 -3.085 3.276 -4.700 1.00 0.00 H new ATOM 0 HG13 ILE A 19 -2.521 4.327 -5.983 1.00 0.00 H new ATOM 0 HG21 ILE A 19 -0.319 1.743 -4.506 1.00 0.00 H new ATOM 0 HG22 ILE A 19 0.384 2.794 -3.253 1.00 0.00 H new ATOM 0 HG23 ILE A 19 -1.299 2.235 -3.104 1.00 0.00 H new ATOM 0 HD11 ILE A 19 -3.040 2.097 -6.840 1.00 0.00 H new ATOM 0 HD12 ILE A 19 -1.302 2.442 -7.010 1.00 0.00 H new ATOM 0 HD13 ILE A 19 -1.875 1.375 -5.706 1.00 0.00 H new ATOM 289 N ALA A 20 -0.279 5.364 -1.457 1.00 0.00 N ATOM 290 CA ALA A 20 0.797 5.641 -0.531 1.00 0.00 C ATOM 291 C ALA A 20 1.097 4.409 0.301 1.00 0.00 C ATOM 292 O ALA A 20 0.387 4.103 1.257 1.00 0.00 O ATOM 293 CB ALA A 20 0.444 6.820 0.363 1.00 0.00 C ATOM 0 H ALA A 20 -1.196 5.269 -1.020 1.00 0.00 H new ATOM 0 HA ALA A 20 1.689 5.903 -1.100 1.00 0.00 H new ATOM 0 HB1 ALA A 20 1.266 7.013 1.053 1.00 0.00 H new ATOM 0 HB2 ALA A 20 0.271 7.704 -0.251 1.00 0.00 H new ATOM 0 HB3 ALA A 20 -0.458 6.590 0.929 1.00 0.00 H new ATOM 299 N ILE A 21 2.131 3.685 -0.083 1.00 0.00 N ATOM 300 CA ILE A 21 2.509 2.482 0.631 1.00 0.00 C ATOM 301 C ILE A 21 3.653 2.772 1.596 1.00 0.00 C ATOM 302 O ILE A 21 4.724 3.228 1.194 1.00 0.00 O ATOM 303 CB ILE A 21 2.900 1.339 -0.329 1.00 0.00 C ATOM 304 CG1 ILE A 21 1.732 1.005 -1.264 1.00 0.00 C ATOM 305 CG2 ILE A 21 3.325 0.109 0.460 1.00 0.00 C ATOM 306 CD1 ILE A 21 2.045 -0.084 -2.269 1.00 0.00 C ATOM 0 H ILE A 21 2.722 3.909 -0.883 1.00 0.00 H new ATOM 0 HA ILE A 21 1.637 2.154 1.197 1.00 0.00 H new ATOM 0 HB ILE A 21 3.743 1.666 -0.937 1.00 0.00 H new ATOM 0 HG12 ILE A 21 0.875 0.698 -0.664 1.00 0.00 H new ATOM 0 HG13 ILE A 21 1.438 1.908 -1.800 1.00 0.00 H new ATOM 0 HG21 ILE A 21 3.598 -0.689 -0.230 1.00 0.00 H new ATOM 0 HG22 ILE A 21 4.182 0.357 1.086 1.00 0.00 H new ATOM 0 HG23 ILE A 21 2.499 -0.222 1.090 1.00 0.00 H new ATOM 0 HD11 ILE A 21 1.171 -0.264 -2.894 1.00 0.00 H new ATOM 0 HD12 ILE A 21 2.881 0.228 -2.895 1.00 0.00 H new ATOM 0 HD13 ILE A 21 2.309 -1.001 -1.742 1.00 0.00 H new ATOM 318 N THR A 22 3.395 2.530 2.868 1.00 0.00 N ATOM 319 CA THR A 22 4.372 2.735 3.914 1.00 0.00 C ATOM 320 C THR A 22 5.038 1.412 4.284 1.00 0.00 C ATOM 321 O THR A 22 4.436 0.565 4.948 1.00 0.00 O ATOM 322 CB THR A 22 3.705 3.341 5.164 1.00 0.00 C ATOM 323 OG1 THR A 22 2.825 4.406 4.773 1.00 0.00 O ATOM 324 CG2 THR A 22 4.752 3.875 6.133 1.00 0.00 C ATOM 0 H THR A 22 2.496 2.184 3.203 1.00 0.00 H new ATOM 0 HA THR A 22 5.128 3.427 3.543 1.00 0.00 H new ATOM 0 HB THR A 22 3.137 2.558 5.665 1.00 0.00 H new ATOM 0 HG1 THR A 22 1.897 4.093 4.807 1.00 0.00 H new ATOM 0 HG21 THR A 22 4.257 4.298 7.007 1.00 0.00 H new ATOM 0 HG22 THR A 22 5.407 3.062 6.445 1.00 0.00 H new ATOM 0 HG23 THR A 22 5.342 4.648 5.641 1.00 0.00 H new ATOM 332 N TYR A 23 6.263 1.227 3.821 1.00 0.00 N ATOM 333 CA TYR A 23 7.022 0.025 4.120 1.00 0.00 C ATOM 334 C TYR A 23 7.707 0.146 5.469 1.00 0.00 C ATOM 335 O TYR A 23 8.660 0.907 5.617 1.00 0.00 O ATOM 336 CB TYR A 23 8.091 -0.230 3.055 1.00 0.00 C ATOM 337 CG TYR A 23 7.562 -0.322 1.647 1.00 0.00 C ATOM 338 CD1 TYR A 23 6.829 -1.421 1.228 1.00 0.00 C ATOM 339 CD2 TYR A 23 7.809 0.689 0.732 1.00 0.00 C ATOM 340 CE1 TYR A 23 6.355 -1.509 -0.062 1.00 0.00 C ATOM 341 CE2 TYR A 23 7.339 0.611 -0.558 1.00 0.00 C ATOM 342 CZ TYR A 23 6.613 -0.491 -0.953 1.00 0.00 C ATOM 343 OH TYR A 23 6.140 -0.574 -2.240 1.00 0.00 O ATOM 0 H TYR A 23 6.755 1.899 3.233 1.00 0.00 H new ATOM 0 HA TYR A 23 6.317 -0.807 4.135 1.00 0.00 H new ATOM 0 HB2 TYR A 23 8.829 0.571 3.101 1.00 0.00 H new ATOM 0 HB3 TYR A 23 8.611 -1.157 3.295 1.00 0.00 H new ATOM 0 HD1 TYR A 23 6.626 -2.221 1.924 1.00 0.00 H new ATOM 0 HD2 TYR A 23 8.380 1.553 1.037 1.00 0.00 H new ATOM 0 HE1 TYR A 23 5.784 -2.371 -0.373 1.00 0.00 H new ATOM 0 HE2 TYR A 23 7.538 1.409 -1.258 1.00 0.00 H new ATOM 0 HH TYR A 23 6.674 0.005 -2.823 1.00 0.00 H new ATOM 353 N VAL A 24 7.213 -0.580 6.450 1.00 0.00 N ATOM 354 CA VAL A 24 7.916 -0.706 7.710 1.00 0.00 C ATOM 355 C VAL A 24 8.728 -1.984 7.682 1.00 0.00 C ATOM 356 O VAL A 24 8.196 -3.090 7.824 1.00 0.00 O ATOM 357 CB VAL A 24 6.967 -0.686 8.931 1.00 0.00 C ATOM 358 CG1 VAL A 24 7.690 -1.138 10.196 1.00 0.00 C ATOM 359 CG2 VAL A 24 6.415 0.714 9.124 1.00 0.00 C ATOM 0 H VAL A 24 6.331 -1.090 6.400 1.00 0.00 H new ATOM 0 HA VAL A 24 8.570 0.158 7.825 1.00 0.00 H new ATOM 0 HB VAL A 24 6.148 -1.380 8.742 1.00 0.00 H new ATOM 0 HG11 VAL A 24 6.999 -1.114 11.038 1.00 0.00 H new ATOM 0 HG12 VAL A 24 8.061 -2.154 10.060 1.00 0.00 H new ATOM 0 HG13 VAL A 24 8.528 -0.469 10.395 1.00 0.00 H new ATOM 0 HG21 VAL A 24 5.746 0.726 9.985 1.00 0.00 H new ATOM 0 HG22 VAL A 24 7.237 1.409 9.293 1.00 0.00 H new ATOM 0 HG23 VAL A 24 5.864 1.014 8.233 1.00 0.00 H new ATOM 369 N TYR A 25 10.012 -1.830 7.445 1.00 0.00 N ATOM 370 CA TYR A 25 10.883 -2.970 7.297 1.00 0.00 C ATOM 371 C TYR A 25 11.897 -3.024 8.423 1.00 0.00 C ATOM 372 O TYR A 25 12.214 -2.007 9.046 1.00 0.00 O ATOM 373 CB TYR A 25 11.582 -2.948 5.932 1.00 0.00 C ATOM 374 CG TYR A 25 12.530 -1.789 5.720 1.00 0.00 C ATOM 375 CD1 TYR A 25 12.061 -0.524 5.381 1.00 0.00 C ATOM 376 CD2 TYR A 25 13.902 -1.969 5.840 1.00 0.00 C ATOM 377 CE1 TYR A 25 12.934 0.523 5.168 1.00 0.00 C ATOM 378 CE2 TYR A 25 14.779 -0.925 5.632 1.00 0.00 C ATOM 379 CZ TYR A 25 14.291 0.317 5.294 1.00 0.00 C ATOM 380 OH TYR A 25 15.162 1.353 5.072 1.00 0.00 O ATOM 0 H TYR A 25 10.474 -0.926 7.351 1.00 0.00 H new ATOM 0 HA TYR A 25 10.273 -3.872 7.349 1.00 0.00 H new ATOM 0 HB2 TYR A 25 12.136 -3.879 5.809 1.00 0.00 H new ATOM 0 HB3 TYR A 25 10.822 -2.924 5.151 1.00 0.00 H new ATOM 0 HD1 TYR A 25 10.998 -0.359 5.283 1.00 0.00 H new ATOM 0 HD2 TYR A 25 14.289 -2.943 6.101 1.00 0.00 H new ATOM 0 HE1 TYR A 25 12.556 1.499 4.904 1.00 0.00 H new ATOM 0 HE2 TYR A 25 15.843 -1.081 5.734 1.00 0.00 H new ATOM 0 HH TYR A 25 16.082 1.041 5.203 1.00 0.00 H new ATOM 390 N LYS A 26 12.387 -4.219 8.682 1.00 0.00 N ATOM 391 CA LYS A 26 13.370 -4.439 9.721 1.00 0.00 C ATOM 392 C LYS A 26 14.475 -5.322 9.169 1.00 0.00 C ATOM 393 O LYS A 26 14.270 -6.514 8.936 1.00 0.00 O ATOM 394 CB LYS A 26 12.710 -5.089 10.937 1.00 0.00 C ATOM 395 CG LYS A 26 13.619 -5.205 12.148 1.00 0.00 C ATOM 396 CD LYS A 26 12.905 -5.861 13.320 1.00 0.00 C ATOM 397 CE LYS A 26 11.646 -5.099 13.709 1.00 0.00 C ATOM 398 NZ LYS A 26 10.993 -5.677 14.914 1.00 0.00 N ATOM 0 H LYS A 26 12.115 -5.063 8.179 1.00 0.00 H new ATOM 0 HA LYS A 26 13.797 -3.488 10.039 1.00 0.00 H new ATOM 0 HB2 LYS A 26 11.829 -4.509 11.212 1.00 0.00 H new ATOM 0 HB3 LYS A 26 12.363 -6.084 10.660 1.00 0.00 H new ATOM 0 HG2 LYS A 26 14.502 -5.787 11.887 1.00 0.00 H new ATOM 0 HG3 LYS A 26 13.966 -4.214 12.440 1.00 0.00 H new ATOM 0 HD2 LYS A 26 12.644 -6.887 13.059 1.00 0.00 H new ATOM 0 HD3 LYS A 26 13.579 -5.911 14.175 1.00 0.00 H new ATOM 0 HE2 LYS A 26 11.898 -4.056 13.899 1.00 0.00 H new ATOM 0 HE3 LYS A 26 10.944 -5.111 12.876 1.00 0.00 H new ATOM 0 HZ1 LYS A 26 10.140 -5.128 15.144 1.00 0.00 H new ATOM 0 HZ2 LYS A 26 10.728 -6.665 14.725 1.00 0.00 H new ATOM 0 HZ3 LYS A 26 11.653 -5.643 15.717 1.00 0.00 H new ATOM 412 N GLY A 27 15.636 -4.730 8.948 1.00 0.00 N ATOM 413 CA GLY A 27 16.701 -5.425 8.262 1.00 0.00 C ATOM 414 C GLY A 27 16.528 -5.333 6.761 1.00 0.00 C ATOM 415 O GLY A 27 16.508 -4.234 6.206 1.00 0.00 O ATOM 0 H GLY A 27 15.860 -3.777 9.233 1.00 0.00 H new ATOM 0 HA2 GLY A 27 17.662 -4.998 8.548 1.00 0.00 H new ATOM 0 HA3 GLY A 27 16.713 -6.471 8.567 1.00 0.00 H new ATOM 419 N ASP A 28 16.367 -6.469 6.102 1.00 0.00 N ATOM 420 CA ASP A 28 16.213 -6.480 4.651 1.00 0.00 C ATOM 421 C ASP A 28 14.826 -6.937 4.234 1.00 0.00 C ATOM 422 O ASP A 28 14.477 -6.870 3.057 1.00 0.00 O ATOM 423 CB ASP A 28 17.270 -7.365 3.992 1.00 0.00 C ATOM 424 CG ASP A 28 18.387 -6.552 3.377 1.00 0.00 C ATOM 425 OD1 ASP A 28 19.274 -6.090 4.123 1.00 0.00 O ATOM 426 OD2 ASP A 28 18.389 -6.371 2.141 1.00 0.00 O ATOM 0 H ASP A 28 16.339 -7.389 6.541 1.00 0.00 H new ATOM 0 HA ASP A 28 16.349 -5.453 4.311 1.00 0.00 H new ATOM 0 HB2 ASP A 28 17.685 -8.048 4.734 1.00 0.00 H new ATOM 0 HB3 ASP A 28 16.801 -7.977 3.222 1.00 0.00 H new ATOM 431 N LYS A 29 14.032 -7.409 5.183 1.00 0.00 N ATOM 432 CA LYS A 29 12.671 -7.807 4.870 1.00 0.00 C ATOM 433 C LYS A 29 11.699 -6.707 5.258 1.00 0.00 C ATOM 434 O LYS A 29 11.787 -6.146 6.353 1.00 0.00 O ATOM 435 CB LYS A 29 12.264 -9.091 5.596 1.00 0.00 C ATOM 436 CG LYS A 29 11.201 -9.872 4.835 1.00 0.00 C ATOM 437 CD LYS A 29 10.424 -10.826 5.728 1.00 0.00 C ATOM 438 CE LYS A 29 11.309 -11.897 6.342 1.00 0.00 C ATOM 439 NZ LYS A 29 10.512 -12.867 7.138 1.00 0.00 N ATOM 0 H LYS A 29 14.301 -7.524 6.160 1.00 0.00 H new ATOM 0 HA LYS A 29 12.636 -7.988 3.796 1.00 0.00 H new ATOM 0 HB2 LYS A 29 13.143 -9.720 5.737 1.00 0.00 H new ATOM 0 HB3 LYS A 29 11.888 -8.841 6.588 1.00 0.00 H new ATOM 0 HG2 LYS A 29 10.508 -9.173 4.367 1.00 0.00 H new ATOM 0 HG3 LYS A 29 11.675 -10.437 4.032 1.00 0.00 H new ATOM 0 HD2 LYS A 29 9.938 -10.260 6.523 1.00 0.00 H new ATOM 0 HD3 LYS A 29 9.634 -11.301 5.146 1.00 0.00 H new ATOM 0 HE2 LYS A 29 11.845 -12.425 5.553 1.00 0.00 H new ATOM 0 HE3 LYS A 29 12.059 -11.430 6.980 1.00 0.00 H new ATOM 0 HZ1 LYS A 29 11.137 -13.614 7.502 1.00 0.00 H new ATOM 0 HZ2 LYS A 29 10.061 -12.374 7.935 1.00 0.00 H new ATOM 0 HZ3 LYS A 29 9.779 -13.292 6.535 1.00 0.00 H new ATOM 453 N VAL A 30 10.777 -6.396 4.360 1.00 0.00 N ATOM 454 CA VAL A 30 9.690 -5.494 4.687 1.00 0.00 C ATOM 455 C VAL A 30 8.637 -6.269 5.458 1.00 0.00 C ATOM 456 O VAL A 30 7.862 -7.020 4.878 1.00 0.00 O ATOM 457 CB VAL A 30 9.047 -4.866 3.436 1.00 0.00 C ATOM 458 CG1 VAL A 30 8.037 -3.807 3.841 1.00 0.00 C ATOM 459 CG2 VAL A 30 10.107 -4.280 2.517 1.00 0.00 C ATOM 0 H VAL A 30 10.761 -6.754 3.405 1.00 0.00 H new ATOM 0 HA VAL A 30 10.097 -4.678 5.284 1.00 0.00 H new ATOM 0 HB VAL A 30 8.526 -5.649 2.886 1.00 0.00 H new ATOM 0 HG11 VAL A 30 7.590 -3.371 2.948 1.00 0.00 H new ATOM 0 HG12 VAL A 30 7.258 -4.262 4.452 1.00 0.00 H new ATOM 0 HG13 VAL A 30 8.538 -3.027 4.414 1.00 0.00 H new ATOM 0 HG21 VAL A 30 9.628 -3.843 1.641 1.00 0.00 H new ATOM 0 HG22 VAL A 30 10.664 -3.509 3.049 1.00 0.00 H new ATOM 0 HG23 VAL A 30 10.791 -5.068 2.201 1.00 0.00 H new ATOM 469 N LEU A 31 8.633 -6.104 6.768 1.00 0.00 N ATOM 470 CA LEU A 31 7.794 -6.920 7.631 1.00 0.00 C ATOM 471 C LEU A 31 6.358 -6.416 7.656 1.00 0.00 C ATOM 472 O LEU A 31 5.429 -7.183 7.903 1.00 0.00 O ATOM 473 CB LEU A 31 8.387 -6.965 9.039 1.00 0.00 C ATOM 474 CG LEU A 31 9.799 -7.555 9.107 1.00 0.00 C ATOM 475 CD1 LEU A 31 10.318 -7.571 10.529 1.00 0.00 C ATOM 476 CD2 LEU A 31 9.816 -8.959 8.530 1.00 0.00 C ATOM 0 H LEU A 31 9.200 -5.413 7.259 1.00 0.00 H new ATOM 0 HA LEU A 31 7.769 -7.932 7.227 1.00 0.00 H new ATOM 0 HB2 LEU A 31 8.408 -5.954 9.445 1.00 0.00 H new ATOM 0 HB3 LEU A 31 7.729 -7.552 9.680 1.00 0.00 H new ATOM 0 HG LEU A 31 10.455 -6.919 8.512 1.00 0.00 H new ATOM 0 HD11 LEU A 31 11.322 -7.995 10.545 1.00 0.00 H new ATOM 0 HD12 LEU A 31 10.348 -6.553 10.917 1.00 0.00 H new ATOM 0 HD13 LEU A 31 9.658 -8.177 11.150 1.00 0.00 H new ATOM 0 HD21 LEU A 31 10.827 -9.363 8.586 1.00 0.00 H new ATOM 0 HD22 LEU A 31 9.139 -9.595 9.100 1.00 0.00 H new ATOM 0 HD23 LEU A 31 9.495 -8.928 7.489 1.00 0.00 H new ATOM 488 N LYS A 32 6.175 -5.131 7.396 1.00 0.00 N ATOM 489 CA LYS A 32 4.838 -4.562 7.326 1.00 0.00 C ATOM 490 C LYS A 32 4.716 -3.625 6.134 1.00 0.00 C ATOM 491 O LYS A 32 5.394 -2.600 6.060 1.00 0.00 O ATOM 492 CB LYS A 32 4.503 -3.808 8.616 1.00 0.00 C ATOM 493 CG LYS A 32 4.444 -4.696 9.847 1.00 0.00 C ATOM 494 CD LYS A 32 4.193 -3.887 11.107 1.00 0.00 C ATOM 495 CE LYS A 32 4.164 -4.772 12.340 1.00 0.00 C ATOM 496 NZ LYS A 32 3.033 -5.739 12.318 1.00 0.00 N ATOM 0 H LYS A 32 6.930 -4.466 7.231 1.00 0.00 H new ATOM 0 HA LYS A 32 4.130 -5.381 7.204 1.00 0.00 H new ATOM 0 HB2 LYS A 32 5.250 -3.030 8.776 1.00 0.00 H new ATOM 0 HB3 LYS A 32 3.543 -3.307 8.494 1.00 0.00 H new ATOM 0 HG2 LYS A 32 3.653 -5.436 9.725 1.00 0.00 H new ATOM 0 HG3 LYS A 32 5.381 -5.244 9.946 1.00 0.00 H new ATOM 0 HD2 LYS A 32 4.972 -3.133 11.218 1.00 0.00 H new ATOM 0 HD3 LYS A 32 3.246 -3.356 11.017 1.00 0.00 H new ATOM 0 HE2 LYS A 32 5.104 -5.318 12.414 1.00 0.00 H new ATOM 0 HE3 LYS A 32 4.087 -4.148 13.230 1.00 0.00 H new ATOM 0 HZ1 LYS A 32 2.888 -6.126 13.273 1.00 0.00 H new ATOM 0 HZ2 LYS A 32 2.168 -5.254 12.006 1.00 0.00 H new ATOM 0 HZ3 LYS A 32 3.252 -6.514 11.660 1.00 0.00 H new ATOM 510 N GLN A 33 3.843 -3.977 5.208 1.00 0.00 N ATOM 511 CA GLN A 33 3.594 -3.152 4.043 1.00 0.00 C ATOM 512 C GLN A 33 2.226 -2.500 4.162 1.00 0.00 C ATOM 513 O GLN A 33 1.197 -3.146 3.957 1.00 0.00 O ATOM 514 CB GLN A 33 3.687 -3.987 2.760 1.00 0.00 C ATOM 515 CG GLN A 33 3.391 -3.198 1.494 1.00 0.00 C ATOM 516 CD GLN A 33 3.611 -4.005 0.229 1.00 0.00 C ATOM 517 OE1 GLN A 33 4.466 -4.884 0.180 1.00 0.00 O ATOM 518 NE2 GLN A 33 2.837 -3.710 -0.806 1.00 0.00 N ATOM 0 H GLN A 33 3.292 -4.835 5.242 1.00 0.00 H new ATOM 0 HA GLN A 33 4.354 -2.372 3.991 1.00 0.00 H new ATOM 0 HB2 GLN A 33 4.687 -4.413 2.686 1.00 0.00 H new ATOM 0 HB3 GLN A 33 2.989 -4.822 2.829 1.00 0.00 H new ATOM 0 HG2 GLN A 33 2.358 -2.851 1.522 1.00 0.00 H new ATOM 0 HG3 GLN A 33 4.025 -2.312 1.468 1.00 0.00 H new ATOM 0 HE21 GLN A 33 2.137 -2.972 -0.726 1.00 0.00 H new ATOM 0 HE22 GLN A 33 2.941 -4.221 -1.683 1.00 0.00 H new ATOM 527 N SER A 34 2.213 -1.235 4.528 1.00 0.00 N ATOM 528 CA SER A 34 0.969 -0.499 4.634 1.00 0.00 C ATOM 529 C SER A 34 0.589 0.060 3.277 1.00 0.00 C ATOM 530 O SER A 34 1.143 1.052 2.829 1.00 0.00 O ATOM 531 CB SER A 34 1.093 0.629 5.655 1.00 0.00 C ATOM 532 OG SER A 34 1.411 0.123 6.941 1.00 0.00 O ATOM 0 H SER A 34 3.048 -0.695 4.757 1.00 0.00 H new ATOM 0 HA SER A 34 0.188 -1.179 4.973 1.00 0.00 H new ATOM 0 HB2 SER A 34 1.865 1.329 5.336 1.00 0.00 H new ATOM 0 HB3 SER A 34 0.157 1.186 5.701 1.00 0.00 H new ATOM 0 HG SER A 34 1.486 0.866 7.575 1.00 0.00 H new ATOM 538 N SER A 35 -0.358 -0.578 2.623 1.00 0.00 N ATOM 539 CA SER A 35 -0.771 -0.154 1.305 1.00 0.00 C ATOM 540 C SER A 35 -2.018 0.707 1.431 1.00 0.00 C ATOM 541 O SER A 35 -3.138 0.208 1.489 1.00 0.00 O ATOM 542 CB SER A 35 -1.039 -1.373 0.412 1.00 0.00 C ATOM 543 OG SER A 35 -1.295 -0.982 -0.924 1.00 0.00 O ATOM 0 H SER A 35 -0.856 -1.392 2.984 1.00 0.00 H new ATOM 0 HA SER A 35 0.024 0.431 0.842 1.00 0.00 H new ATOM 0 HB2 SER A 35 -0.180 -2.043 0.439 1.00 0.00 H new ATOM 0 HB3 SER A 35 -1.891 -1.931 0.800 1.00 0.00 H new ATOM 0 HG SER A 35 -1.461 -1.778 -1.472 1.00 0.00 H new ATOM 549 N GLU A 36 -1.802 2.006 1.520 1.00 0.00 N ATOM 550 CA GLU A 36 -2.885 2.945 1.725 1.00 0.00 C ATOM 551 C GLU A 36 -3.288 3.569 0.390 1.00 0.00 C ATOM 552 O GLU A 36 -2.661 4.519 -0.084 1.00 0.00 O ATOM 553 CB GLU A 36 -2.438 4.014 2.717 1.00 0.00 C ATOM 554 CG GLU A 36 -1.932 3.452 4.039 1.00 0.00 C ATOM 555 CD GLU A 36 -1.031 4.422 4.783 1.00 0.00 C ATOM 556 OE1 GLU A 36 -1.538 5.446 5.287 1.00 0.00 O ATOM 557 OE2 GLU A 36 0.189 4.164 4.878 1.00 0.00 O ATOM 0 H GLU A 36 -0.879 2.436 1.453 1.00 0.00 H new ATOM 0 HA GLU A 36 -3.754 2.430 2.133 1.00 0.00 H new ATOM 0 HB2 GLU A 36 -1.649 4.612 2.261 1.00 0.00 H new ATOM 0 HB3 GLU A 36 -3.274 4.686 2.914 1.00 0.00 H new ATOM 0 HG2 GLU A 36 -2.783 3.197 4.670 1.00 0.00 H new ATOM 0 HG3 GLU A 36 -1.386 2.527 3.851 1.00 0.00 H new ATOM 564 N THR A 37 -4.317 3.008 -0.223 1.00 0.00 N ATOM 565 CA THR A 37 -4.752 3.437 -1.543 1.00 0.00 C ATOM 566 C THR A 37 -5.872 4.472 -1.445 1.00 0.00 C ATOM 567 O THR A 37 -7.001 4.148 -1.080 1.00 0.00 O ATOM 568 CB THR A 37 -5.222 2.226 -2.373 1.00 0.00 C ATOM 569 OG1 THR A 37 -4.160 1.266 -2.466 1.00 0.00 O ATOM 570 CG2 THR A 37 -5.654 2.645 -3.768 1.00 0.00 C ATOM 0 H THR A 37 -4.870 2.249 0.175 1.00 0.00 H new ATOM 0 HA THR A 37 -3.901 3.901 -2.042 1.00 0.00 H new ATOM 0 HB THR A 37 -6.082 1.783 -1.871 1.00 0.00 H new ATOM 0 HG1 THR A 37 -4.460 0.496 -2.992 1.00 0.00 H new ATOM 0 HG21 THR A 37 -5.980 1.768 -4.327 1.00 0.00 H new ATOM 0 HG22 THR A 37 -6.478 3.355 -3.696 1.00 0.00 H new ATOM 0 HG23 THR A 37 -4.815 3.113 -4.283 1.00 0.00 H new ATOM 578 N LYS A 38 -5.549 5.721 -1.751 1.00 0.00 N ATOM 579 CA LYS A 38 -6.525 6.799 -1.694 1.00 0.00 C ATOM 580 C LYS A 38 -7.191 6.989 -3.051 1.00 0.00 C ATOM 581 O LYS A 38 -6.606 7.565 -3.968 1.00 0.00 O ATOM 582 CB LYS A 38 -5.859 8.100 -1.256 1.00 0.00 C ATOM 583 CG LYS A 38 -6.849 9.209 -0.944 1.00 0.00 C ATOM 584 CD LYS A 38 -6.157 10.551 -0.805 1.00 0.00 C ATOM 585 CE LYS A 38 -5.115 10.548 0.301 1.00 0.00 C ATOM 586 NZ LYS A 38 -4.315 11.800 0.292 1.00 0.00 N ATOM 0 H LYS A 38 -4.616 6.013 -2.042 1.00 0.00 H new ATOM 0 HA LYS A 38 -7.287 6.530 -0.963 1.00 0.00 H new ATOM 0 HB2 LYS A 38 -5.249 7.908 -0.373 1.00 0.00 H new ATOM 0 HB3 LYS A 38 -5.184 8.437 -2.043 1.00 0.00 H new ATOM 0 HG2 LYS A 38 -7.596 9.264 -1.736 1.00 0.00 H new ATOM 0 HG3 LYS A 38 -7.380 8.975 -0.021 1.00 0.00 H new ATOM 0 HD2 LYS A 38 -5.680 10.812 -1.750 1.00 0.00 H new ATOM 0 HD3 LYS A 38 -6.900 11.321 -0.600 1.00 0.00 H new ATOM 0 HE2 LYS A 38 -5.607 10.435 1.267 1.00 0.00 H new ATOM 0 HE3 LYS A 38 -4.454 9.690 0.178 1.00 0.00 H new ATOM 0 HZ1 LYS A 38 -3.438 11.656 0.832 1.00 0.00 H new ATOM 0 HZ2 LYS A 38 -4.080 12.055 -0.689 1.00 0.00 H new ATOM 0 HZ3 LYS A 38 -4.866 12.567 0.726 1.00 0.00 H new ATOM 600 N ILE A 39 -8.412 6.503 -3.174 1.00 0.00 N ATOM 601 CA ILE A 39 -9.143 6.584 -4.429 1.00 0.00 C ATOM 602 C ILE A 39 -10.143 7.733 -4.388 1.00 0.00 C ATOM 603 O ILE A 39 -10.976 7.803 -3.483 1.00 0.00 O ATOM 604 CB ILE A 39 -9.900 5.268 -4.711 1.00 0.00 C ATOM 605 CG1 ILE A 39 -8.951 4.072 -4.600 1.00 0.00 C ATOM 606 CG2 ILE A 39 -10.542 5.310 -6.091 1.00 0.00 C ATOM 607 CD1 ILE A 39 -9.655 2.733 -4.660 1.00 0.00 C ATOM 0 H ILE A 39 -8.922 6.046 -2.418 1.00 0.00 H new ATOM 0 HA ILE A 39 -8.418 6.757 -5.225 1.00 0.00 H new ATOM 0 HB ILE A 39 -10.688 5.155 -3.966 1.00 0.00 H new ATOM 0 HG12 ILE A 39 -8.218 4.124 -5.405 1.00 0.00 H new ATOM 0 HG13 ILE A 39 -8.400 4.142 -3.662 1.00 0.00 H new ATOM 0 HG21 ILE A 39 -11.072 4.375 -6.274 1.00 0.00 H new ATOM 0 HG22 ILE A 39 -11.245 6.141 -6.140 1.00 0.00 H new ATOM 0 HG23 ILE A 39 -9.769 5.444 -6.848 1.00 0.00 H new ATOM 0 HD11 ILE A 39 -8.921 1.932 -4.575 1.00 0.00 H new ATOM 0 HD12 ILE A 39 -10.368 2.660 -3.839 1.00 0.00 H new ATOM 0 HD13 ILE A 39 -10.184 2.642 -5.609 1.00 0.00 H new ATOM 619 N GLN A 40 -10.053 8.644 -5.350 1.00 0.00 N ATOM 620 CA GLN A 40 -11.030 9.721 -5.448 1.00 0.00 C ATOM 621 C GLN A 40 -12.345 9.149 -5.962 1.00 0.00 C ATOM 622 O GLN A 40 -12.347 8.137 -6.668 1.00 0.00 O ATOM 623 CB GLN A 40 -10.557 10.835 -6.390 1.00 0.00 C ATOM 624 CG GLN A 40 -9.157 11.374 -6.115 1.00 0.00 C ATOM 625 CD GLN A 40 -8.903 11.706 -4.657 1.00 0.00 C ATOM 626 OE1 GLN A 40 -9.217 12.799 -4.189 1.00 0.00 O ATOM 627 NE2 GLN A 40 -8.282 10.784 -3.939 1.00 0.00 N ATOM 0 H GLN A 40 -9.324 8.659 -6.064 1.00 0.00 H new ATOM 0 HA GLN A 40 -11.159 10.156 -4.457 1.00 0.00 H new ATOM 0 HB2 GLN A 40 -10.589 10.460 -7.413 1.00 0.00 H new ATOM 0 HB3 GLN A 40 -11.264 11.662 -6.331 1.00 0.00 H new ATOM 0 HG2 GLN A 40 -8.424 10.637 -6.443 1.00 0.00 H new ATOM 0 HG3 GLN A 40 -8.999 12.270 -6.715 1.00 0.00 H new ATOM 0 HE21 GLN A 40 -8.037 9.888 -4.361 1.00 0.00 H new ATOM 0 HE22 GLN A 40 -8.048 10.969 -2.964 1.00 0.00 H new ATOM 636 N PHE A 41 -13.461 9.784 -5.619 1.00 0.00 N ATOM 637 CA PHE A 41 -14.766 9.321 -6.089 1.00 0.00 C ATOM 638 C PHE A 41 -14.830 9.326 -7.612 1.00 0.00 C ATOM 639 O PHE A 41 -15.499 8.490 -8.215 1.00 0.00 O ATOM 640 CB PHE A 41 -15.900 10.175 -5.512 1.00 0.00 C ATOM 641 CG PHE A 41 -16.206 9.887 -4.066 1.00 0.00 C ATOM 642 CD1 PHE A 41 -15.617 8.813 -3.414 1.00 0.00 C ATOM 643 CD2 PHE A 41 -17.084 10.693 -3.360 1.00 0.00 C ATOM 644 CE1 PHE A 41 -15.899 8.551 -2.087 1.00 0.00 C ATOM 645 CE2 PHE A 41 -17.369 10.433 -2.032 1.00 0.00 C ATOM 646 CZ PHE A 41 -16.774 9.362 -1.396 1.00 0.00 C ATOM 0 H PHE A 41 -13.491 10.612 -5.024 1.00 0.00 H new ATOM 0 HA PHE A 41 -14.895 8.297 -5.738 1.00 0.00 H new ATOM 0 HB2 PHE A 41 -15.637 11.228 -5.615 1.00 0.00 H new ATOM 0 HB3 PHE A 41 -16.801 10.012 -6.103 1.00 0.00 H new ATOM 0 HD1 PHE A 41 -14.930 8.175 -3.950 1.00 0.00 H new ATOM 0 HD2 PHE A 41 -17.551 11.533 -3.852 1.00 0.00 H new ATOM 0 HE1 PHE A 41 -15.434 7.711 -1.591 1.00 0.00 H new ATOM 0 HE2 PHE A 41 -18.057 11.068 -1.493 1.00 0.00 H new ATOM 0 HZ PHE A 41 -16.994 9.160 -0.358 1.00 0.00 H new ATOM 656 N ALA A 42 -14.100 10.246 -8.229 1.00 0.00 N ATOM 657 CA ALA A 42 -14.059 10.352 -9.682 1.00 0.00 C ATOM 658 C ALA A 42 -13.309 9.175 -10.307 1.00 0.00 C ATOM 659 O ALA A 42 -13.542 8.824 -11.462 1.00 0.00 O ATOM 660 CB ALA A 42 -13.415 11.667 -10.088 1.00 0.00 C ATOM 0 H ALA A 42 -13.525 10.934 -7.742 1.00 0.00 H new ATOM 0 HA ALA A 42 -15.084 10.325 -10.053 1.00 0.00 H new ATOM 0 HB1 ALA A 42 -13.388 11.739 -11.175 1.00 0.00 H new ATOM 0 HB2 ALA A 42 -13.995 12.496 -9.684 1.00 0.00 H new ATOM 0 HB3 ALA A 42 -12.399 11.711 -9.696 1.00 0.00 H new ATOM 666 N SER A 43 -12.414 8.567 -9.539 1.00 0.00 N ATOM 667 CA SER A 43 -11.622 7.447 -10.029 1.00 0.00 C ATOM 668 C SER A 43 -12.404 6.139 -9.915 1.00 0.00 C ATOM 669 O SER A 43 -12.336 5.282 -10.796 1.00 0.00 O ATOM 670 CB SER A 43 -10.319 7.347 -9.236 1.00 0.00 C ATOM 671 OG SER A 43 -9.689 8.613 -9.129 1.00 0.00 O ATOM 0 H SER A 43 -12.218 8.831 -8.573 1.00 0.00 H new ATOM 0 HA SER A 43 -11.392 7.619 -11.081 1.00 0.00 H new ATOM 0 HB2 SER A 43 -10.525 6.954 -8.240 1.00 0.00 H new ATOM 0 HB3 SER A 43 -9.646 6.642 -9.724 1.00 0.00 H new ATOM 0 HG SER A 43 -9.183 8.657 -8.291 1.00 0.00 H new ATOM 677 N ILE A 44 -13.149 5.997 -8.823 1.00 0.00 N ATOM 678 CA ILE A 44 -13.911 4.778 -8.570 1.00 0.00 C ATOM 679 C ILE A 44 -15.284 4.830 -9.250 1.00 0.00 C ATOM 680 O ILE A 44 -15.847 3.799 -9.617 1.00 0.00 O ATOM 681 CB ILE A 44 -14.076 4.526 -7.048 1.00 0.00 C ATOM 682 CG1 ILE A 44 -14.893 3.255 -6.789 1.00 0.00 C ATOM 683 CG2 ILE A 44 -14.718 5.727 -6.368 1.00 0.00 C ATOM 684 CD1 ILE A 44 -15.059 2.923 -5.321 1.00 0.00 C ATOM 0 H ILE A 44 -13.241 6.710 -8.100 1.00 0.00 H new ATOM 0 HA ILE A 44 -13.348 3.949 -8.997 1.00 0.00 H new ATOM 0 HB ILE A 44 -13.084 4.383 -6.621 1.00 0.00 H new ATOM 0 HG12 ILE A 44 -15.879 3.370 -7.239 1.00 0.00 H new ATOM 0 HG13 ILE A 44 -14.410 2.416 -7.289 1.00 0.00 H new ATOM 0 HG21 ILE A 44 -14.824 5.528 -5.302 1.00 0.00 H new ATOM 0 HG22 ILE A 44 -14.090 6.606 -6.512 1.00 0.00 H new ATOM 0 HG23 ILE A 44 -15.701 5.909 -6.802 1.00 0.00 H new ATOM 0 HD11 ILE A 44 -15.648 2.011 -5.218 1.00 0.00 H new ATOM 0 HD12 ILE A 44 -14.079 2.775 -4.868 1.00 0.00 H new ATOM 0 HD13 ILE A 44 -15.570 3.744 -4.818 1.00 0.00 H new ATOM 696 N GLY A 45 -15.810 6.035 -9.431 1.00 0.00 N ATOM 697 CA GLY A 45 -17.108 6.190 -10.061 1.00 0.00 C ATOM 698 C GLY A 45 -18.239 6.155 -9.055 1.00 0.00 C ATOM 699 O GLY A 45 -19.393 5.904 -9.409 1.00 0.00 O ATOM 0 H GLY A 45 -15.361 6.908 -9.153 1.00 0.00 H new ATOM 0 HA2 GLY A 45 -17.136 7.135 -10.604 1.00 0.00 H new ATOM 0 HA3 GLY A 45 -17.251 5.396 -10.794 1.00 0.00 H new ATOM 703 N ALA A 46 -17.908 6.406 -7.797 1.00 0.00 N ATOM 704 CA ALA A 46 -18.895 6.400 -6.730 1.00 0.00 C ATOM 705 C ALA A 46 -19.481 7.789 -6.538 1.00 0.00 C ATOM 706 O ALA A 46 -18.746 8.765 -6.401 1.00 0.00 O ATOM 707 CB ALA A 46 -18.273 5.903 -5.436 1.00 0.00 C ATOM 0 H ALA A 46 -16.958 6.617 -7.490 1.00 0.00 H new ATOM 0 HA ALA A 46 -19.701 5.722 -7.010 1.00 0.00 H new ATOM 0 HB1 ALA A 46 -19.025 5.904 -4.647 1.00 0.00 H new ATOM 0 HB2 ALA A 46 -17.898 4.889 -5.578 1.00 0.00 H new ATOM 0 HB3 ALA A 46 -17.449 6.558 -5.153 1.00 0.00 H new ATOM 713 N THR A 47 -20.802 7.869 -6.537 1.00 0.00 N ATOM 714 CA THR A 47 -21.488 9.143 -6.396 1.00 0.00 C ATOM 715 C THR A 47 -21.309 9.715 -4.988 1.00 0.00 C ATOM 716 O THR A 47 -21.025 10.904 -4.817 1.00 0.00 O ATOM 717 CB THR A 47 -22.991 8.984 -6.702 1.00 0.00 C ATOM 718 OG1 THR A 47 -23.163 8.256 -7.928 1.00 0.00 O ATOM 719 CG2 THR A 47 -23.676 10.338 -6.815 1.00 0.00 C ATOM 0 H THR A 47 -21.422 7.065 -6.633 1.00 0.00 H new ATOM 0 HA THR A 47 -21.046 9.837 -7.111 1.00 0.00 H new ATOM 0 HB THR A 47 -23.448 8.435 -5.878 1.00 0.00 H new ATOM 0 HG1 THR A 47 -24.119 8.156 -8.118 1.00 0.00 H new ATOM 0 HG21 THR A 47 -24.735 10.193 -7.031 1.00 0.00 H new ATOM 0 HG22 THR A 47 -23.568 10.880 -5.875 1.00 0.00 H new ATOM 0 HG23 THR A 47 -23.217 10.912 -7.620 1.00 0.00 H new ATOM 727 N THR A 48 -21.461 8.859 -3.984 1.00 0.00 N ATOM 728 CA THR A 48 -21.388 9.288 -2.595 1.00 0.00 C ATOM 729 C THR A 48 -20.496 8.360 -1.777 1.00 0.00 C ATOM 730 O THR A 48 -19.947 7.388 -2.302 1.00 0.00 O ATOM 731 CB THR A 48 -22.790 9.318 -1.956 1.00 0.00 C ATOM 732 OG1 THR A 48 -23.440 8.054 -2.163 1.00 0.00 O ATOM 733 CG2 THR A 48 -23.637 10.439 -2.541 1.00 0.00 C ATOM 0 H THR A 48 -21.636 7.862 -4.108 1.00 0.00 H new ATOM 0 HA THR A 48 -20.962 10.291 -2.591 1.00 0.00 H new ATOM 0 HB THR A 48 -22.678 9.503 -0.888 1.00 0.00 H new ATOM 0 HG1 THR A 48 -24.331 8.073 -1.755 1.00 0.00 H new ATOM 0 HG21 THR A 48 -24.620 10.435 -2.071 1.00 0.00 H new ATOM 0 HG22 THR A 48 -23.150 11.397 -2.357 1.00 0.00 H new ATOM 0 HG23 THR A 48 -23.748 10.289 -3.615 1.00 0.00 H new ATOM 741 N LYS A 49 -20.373 8.657 -0.488 1.00 0.00 N ATOM 742 CA LYS A 49 -19.589 7.837 0.430 1.00 0.00 C ATOM 743 C LYS A 49 -20.299 6.506 0.649 1.00 0.00 C ATOM 744 O LYS A 49 -19.666 5.463 0.810 1.00 0.00 O ATOM 745 CB LYS A 49 -19.424 8.570 1.764 1.00 0.00 C ATOM 746 CG LYS A 49 -18.924 9.997 1.613 1.00 0.00 C ATOM 747 CD LYS A 49 -19.211 10.821 2.856 1.00 0.00 C ATOM 748 CE LYS A 49 -18.872 12.288 2.645 1.00 0.00 C ATOM 749 NZ LYS A 49 -19.335 13.131 3.778 1.00 0.00 N ATOM 0 H LYS A 49 -20.811 9.468 -0.051 1.00 0.00 H new ATOM 0 HA LYS A 49 -18.603 7.652 0.005 1.00 0.00 H new ATOM 0 HB2 LYS A 49 -20.382 8.582 2.284 1.00 0.00 H new ATOM 0 HB3 LYS A 49 -18.728 8.014 2.392 1.00 0.00 H new ATOM 0 HG2 LYS A 49 -17.851 9.989 1.420 1.00 0.00 H new ATOM 0 HG3 LYS A 49 -19.400 10.461 0.749 1.00 0.00 H new ATOM 0 HD2 LYS A 49 -20.264 10.725 3.122 1.00 0.00 H new ATOM 0 HD3 LYS A 49 -18.633 10.430 3.694 1.00 0.00 H new ATOM 0 HE2 LYS A 49 -17.794 12.398 2.527 1.00 0.00 H new ATOM 0 HE3 LYS A 49 -19.331 12.638 1.721 1.00 0.00 H new ATOM 0 HZ1 LYS A 49 -19.085 14.124 3.597 1.00 0.00 H new ATOM 0 HZ2 LYS A 49 -20.367 13.046 3.875 1.00 0.00 H new ATOM 0 HZ3 LYS A 49 -18.877 12.814 4.656 1.00 0.00 H new ATOM 763 N GLU A 50 -21.626 6.570 0.638 1.00 0.00 N ATOM 764 CA GLU A 50 -22.474 5.393 0.774 1.00 0.00 C ATOM 765 C GLU A 50 -22.210 4.437 -0.385 1.00 0.00 C ATOM 766 O GLU A 50 -21.953 3.244 -0.187 1.00 0.00 O ATOM 767 CB GLU A 50 -23.944 5.842 0.790 1.00 0.00 C ATOM 768 CG GLU A 50 -24.940 4.802 1.291 1.00 0.00 C ATOM 769 CD GLU A 50 -25.171 3.659 0.323 1.00 0.00 C ATOM 770 OE1 GLU A 50 -25.518 3.920 -0.850 1.00 0.00 O ATOM 771 OE2 GLU A 50 -25.016 2.492 0.733 1.00 0.00 O ATOM 0 H GLU A 50 -22.144 7.442 0.534 1.00 0.00 H new ATOM 0 HA GLU A 50 -22.252 4.871 1.704 1.00 0.00 H new ATOM 0 HB2 GLU A 50 -24.028 6.731 1.415 1.00 0.00 H new ATOM 0 HB3 GLU A 50 -24.228 6.135 -0.221 1.00 0.00 H new ATOM 0 HG2 GLU A 50 -24.583 4.397 2.238 1.00 0.00 H new ATOM 0 HG3 GLU A 50 -25.892 5.292 1.493 1.00 0.00 H new ATOM 778 N ASP A 51 -22.241 4.988 -1.593 1.00 0.00 N ATOM 779 CA ASP A 51 -22.024 4.208 -2.805 1.00 0.00 C ATOM 780 C ASP A 51 -20.602 3.655 -2.843 1.00 0.00 C ATOM 781 O ASP A 51 -20.374 2.531 -3.287 1.00 0.00 O ATOM 782 CB ASP A 51 -22.284 5.071 -4.039 1.00 0.00 C ATOM 783 CG ASP A 51 -22.344 4.256 -5.313 1.00 0.00 C ATOM 784 OD1 ASP A 51 -23.449 3.805 -5.682 1.00 0.00 O ATOM 785 OD2 ASP A 51 -21.297 4.074 -5.960 1.00 0.00 O ATOM 0 H ASP A 51 -22.416 5.979 -1.759 1.00 0.00 H new ATOM 0 HA ASP A 51 -22.720 3.370 -2.804 1.00 0.00 H new ATOM 0 HB2 ASP A 51 -23.223 5.609 -3.911 1.00 0.00 H new ATOM 0 HB3 ASP A 51 -21.497 5.820 -4.127 1.00 0.00 H new ATOM 790 N ALA A 52 -19.654 4.450 -2.356 1.00 0.00 N ATOM 791 CA ALA A 52 -18.258 4.036 -2.300 1.00 0.00 C ATOM 792 C ALA A 52 -18.084 2.819 -1.399 1.00 0.00 C ATOM 793 O ALA A 52 -17.351 1.886 -1.735 1.00 0.00 O ATOM 794 CB ALA A 52 -17.385 5.183 -1.816 1.00 0.00 C ATOM 0 H ALA A 52 -19.829 5.387 -1.994 1.00 0.00 H new ATOM 0 HA ALA A 52 -17.946 3.759 -3.307 1.00 0.00 H new ATOM 0 HB1 ALA A 52 -16.345 4.858 -1.779 1.00 0.00 H new ATOM 0 HB2 ALA A 52 -17.478 6.025 -2.501 1.00 0.00 H new ATOM 0 HB3 ALA A 52 -17.705 5.488 -0.820 1.00 0.00 H new ATOM 800 N ALA A 53 -18.768 2.827 -0.260 1.00 0.00 N ATOM 801 CA ALA A 53 -18.702 1.713 0.678 1.00 0.00 C ATOM 802 C ALA A 53 -19.225 0.432 0.040 1.00 0.00 C ATOM 803 O ALA A 53 -18.666 -0.641 0.246 1.00 0.00 O ATOM 804 CB ALA A 53 -19.478 2.030 1.947 1.00 0.00 C ATOM 0 H ALA A 53 -19.374 3.592 0.036 1.00 0.00 H new ATOM 0 HA ALA A 53 -17.656 1.560 0.943 1.00 0.00 H new ATOM 0 HB1 ALA A 53 -19.415 1.185 2.633 1.00 0.00 H new ATOM 0 HB2 ALA A 53 -19.054 2.915 2.422 1.00 0.00 H new ATOM 0 HB3 ALA A 53 -20.522 2.218 1.698 1.00 0.00 H new ATOM 810 N LYS A 54 -20.282 0.560 -0.758 1.00 0.00 N ATOM 811 CA LYS A 54 -20.867 -0.587 -1.452 1.00 0.00 C ATOM 812 C LYS A 54 -19.853 -1.281 -2.356 1.00 0.00 C ATOM 813 O LYS A 54 -19.981 -2.471 -2.642 1.00 0.00 O ATOM 814 CB LYS A 54 -22.084 -0.155 -2.272 1.00 0.00 C ATOM 815 CG LYS A 54 -23.383 -0.204 -1.491 1.00 0.00 C ATOM 816 CD LYS A 54 -24.540 0.377 -2.286 1.00 0.00 C ATOM 817 CE LYS A 54 -25.881 -0.017 -1.688 1.00 0.00 C ATOM 818 NZ LYS A 54 -25.936 0.221 -0.221 1.00 0.00 N ATOM 0 H LYS A 54 -20.752 1.447 -0.941 1.00 0.00 H new ATOM 0 HA LYS A 54 -21.181 -1.300 -0.689 1.00 0.00 H new ATOM 0 HB2 LYS A 54 -21.926 0.860 -2.637 1.00 0.00 H new ATOM 0 HB3 LYS A 54 -22.170 -0.799 -3.148 1.00 0.00 H new ATOM 0 HG2 LYS A 54 -23.608 -1.236 -1.223 1.00 0.00 H new ATOM 0 HG3 LYS A 54 -23.268 0.349 -0.559 1.00 0.00 H new ATOM 0 HD2 LYS A 54 -24.457 1.464 -2.310 1.00 0.00 H new ATOM 0 HD3 LYS A 54 -24.484 0.030 -3.318 1.00 0.00 H new ATOM 0 HE2 LYS A 54 -26.674 0.549 -2.176 1.00 0.00 H new ATOM 0 HE3 LYS A 54 -26.071 -1.071 -1.890 1.00 0.00 H new ATOM 0 HZ1 LYS A 54 -26.923 0.369 0.070 1.00 0.00 H new ATOM 0 HZ2 LYS A 54 -25.548 -0.604 0.279 1.00 0.00 H new ATOM 0 HZ3 LYS A 54 -25.375 1.064 0.015 1.00 0.00 H new ATOM 832 N THR A 55 -18.851 -0.544 -2.802 1.00 0.00 N ATOM 833 CA THR A 55 -17.816 -1.111 -3.644 1.00 0.00 C ATOM 834 C THR A 55 -16.616 -1.571 -2.815 1.00 0.00 C ATOM 835 O THR A 55 -16.064 -2.648 -3.050 1.00 0.00 O ATOM 836 CB THR A 55 -17.353 -0.090 -4.701 1.00 0.00 C ATOM 837 OG1 THR A 55 -18.484 0.362 -5.454 1.00 0.00 O ATOM 838 CG2 THR A 55 -16.324 -0.698 -5.644 1.00 0.00 C ATOM 0 H THR A 55 -18.733 0.448 -2.595 1.00 0.00 H new ATOM 0 HA THR A 55 -18.244 -1.978 -4.147 1.00 0.00 H new ATOM 0 HB THR A 55 -16.887 0.749 -4.185 1.00 0.00 H new ATOM 0 HG1 THR A 55 -18.191 1.013 -6.126 1.00 0.00 H new ATOM 0 HG21 THR A 55 -16.018 0.048 -6.378 1.00 0.00 H new ATOM 0 HG22 THR A 55 -15.455 -1.024 -5.073 1.00 0.00 H new ATOM 0 HG23 THR A 55 -16.762 -1.554 -6.158 1.00 0.00 H new ATOM 846 N LEU A 56 -16.236 -0.768 -1.827 1.00 0.00 N ATOM 847 CA LEU A 56 -15.006 -1.006 -1.081 1.00 0.00 C ATOM 848 C LEU A 56 -15.172 -2.044 0.027 1.00 0.00 C ATOM 849 O LEU A 56 -14.262 -2.837 0.262 1.00 0.00 O ATOM 850 CB LEU A 56 -14.480 0.302 -0.494 1.00 0.00 C ATOM 851 CG LEU A 56 -14.082 1.358 -1.527 1.00 0.00 C ATOM 852 CD1 LEU A 56 -13.538 2.595 -0.836 1.00 0.00 C ATOM 853 CD2 LEU A 56 -13.056 0.798 -2.500 1.00 0.00 C ATOM 0 H LEU A 56 -16.761 0.052 -1.525 1.00 0.00 H new ATOM 0 HA LEU A 56 -14.284 -1.410 -1.791 1.00 0.00 H new ATOM 0 HB2 LEU A 56 -15.244 0.724 0.159 1.00 0.00 H new ATOM 0 HB3 LEU A 56 -13.614 0.081 0.130 1.00 0.00 H new ATOM 0 HG LEU A 56 -14.971 1.638 -2.092 1.00 0.00 H new ATOM 0 HD11 LEU A 56 -13.259 3.337 -1.584 1.00 0.00 H new ATOM 0 HD12 LEU A 56 -14.302 3.011 -0.180 1.00 0.00 H new ATOM 0 HD13 LEU A 56 -12.661 2.327 -0.247 1.00 0.00 H new ATOM 0 HD21 LEU A 56 -12.787 1.565 -3.226 1.00 0.00 H new ATOM 0 HD22 LEU A 56 -12.166 0.488 -1.952 1.00 0.00 H new ATOM 0 HD23 LEU A 56 -13.479 -0.061 -3.020 1.00 0.00 H new ATOM 865 N GLU A 57 -16.317 -2.055 0.705 1.00 0.00 N ATOM 866 CA GLU A 57 -16.522 -2.987 1.817 1.00 0.00 C ATOM 867 C GLU A 57 -16.327 -4.447 1.380 1.00 0.00 C ATOM 868 O GLU A 57 -15.540 -5.170 1.993 1.00 0.00 O ATOM 869 CB GLU A 57 -17.892 -2.802 2.477 1.00 0.00 C ATOM 870 CG GLU A 57 -18.021 -1.504 3.258 1.00 0.00 C ATOM 871 CD GLU A 57 -19.182 -1.531 4.231 1.00 0.00 C ATOM 872 OE1 GLU A 57 -18.979 -1.951 5.390 1.00 0.00 O ATOM 873 OE2 GLU A 57 -20.305 -1.141 3.846 1.00 0.00 O ATOM 0 H GLU A 57 -17.107 -1.440 0.510 1.00 0.00 H new ATOM 0 HA GLU A 57 -15.760 -2.752 2.560 1.00 0.00 H new ATOM 0 HB2 GLU A 57 -18.664 -2.832 1.708 1.00 0.00 H new ATOM 0 HB3 GLU A 57 -18.079 -3.640 3.148 1.00 0.00 H new ATOM 0 HG2 GLU A 57 -17.096 -1.318 3.804 1.00 0.00 H new ATOM 0 HG3 GLU A 57 -18.152 -0.675 2.562 1.00 0.00 H new ATOM 880 N PRO A 58 -17.019 -4.918 0.315 1.00 0.00 N ATOM 881 CA PRO A 58 -16.821 -6.280 -0.193 1.00 0.00 C ATOM 882 C PRO A 58 -15.435 -6.477 -0.815 1.00 0.00 C ATOM 883 O PRO A 58 -14.985 -7.608 -1.005 1.00 0.00 O ATOM 884 CB PRO A 58 -17.913 -6.437 -1.255 1.00 0.00 C ATOM 885 CG PRO A 58 -18.242 -5.047 -1.673 1.00 0.00 C ATOM 886 CD PRO A 58 -18.056 -4.194 -0.452 1.00 0.00 C ATOM 0 HA PRO A 58 -16.881 -7.019 0.606 1.00 0.00 H new ATOM 0 HB2 PRO A 58 -17.561 -7.031 -2.099 1.00 0.00 H new ATOM 0 HB3 PRO A 58 -18.788 -6.946 -0.850 1.00 0.00 H new ATOM 0 HG2 PRO A 58 -17.590 -4.718 -2.482 1.00 0.00 H new ATOM 0 HG3 PRO A 58 -19.266 -4.982 -2.042 1.00 0.00 H new ATOM 0 HD2 PRO A 58 -17.734 -3.186 -0.711 1.00 0.00 H new ATOM 0 HD3 PRO A 58 -18.982 -4.097 0.116 1.00 0.00 H new ATOM 894 N LEU A 59 -14.759 -5.374 -1.119 1.00 0.00 N ATOM 895 CA LEU A 59 -13.426 -5.434 -1.708 1.00 0.00 C ATOM 896 C LEU A 59 -12.395 -5.689 -0.610 1.00 0.00 C ATOM 897 O LEU A 59 -11.481 -6.493 -0.778 1.00 0.00 O ATOM 898 CB LEU A 59 -13.121 -4.133 -2.465 1.00 0.00 C ATOM 899 CG LEU A 59 -12.035 -4.224 -3.549 1.00 0.00 C ATOM 900 CD1 LEU A 59 -12.121 -3.027 -4.481 1.00 0.00 C ATOM 901 CD2 LEU A 59 -10.644 -4.299 -2.934 1.00 0.00 C ATOM 0 H LEU A 59 -15.112 -4.429 -0.968 1.00 0.00 H new ATOM 0 HA LEU A 59 -13.380 -6.254 -2.424 1.00 0.00 H new ATOM 0 HB2 LEU A 59 -14.042 -3.782 -2.930 1.00 0.00 H new ATOM 0 HB3 LEU A 59 -12.821 -3.376 -1.740 1.00 0.00 H new ATOM 0 HG LEU A 59 -12.207 -5.138 -4.117 1.00 0.00 H new ATOM 0 HD11 LEU A 59 -11.346 -3.104 -5.244 1.00 0.00 H new ATOM 0 HD12 LEU A 59 -13.100 -3.008 -4.959 1.00 0.00 H new ATOM 0 HD13 LEU A 59 -11.978 -2.110 -3.910 1.00 0.00 H new ATOM 0 HD21 LEU A 59 -9.899 -4.362 -3.727 1.00 0.00 H new ATOM 0 HD22 LEU A 59 -10.462 -3.406 -2.336 1.00 0.00 H new ATOM 0 HD23 LEU A 59 -10.574 -5.182 -2.299 1.00 0.00 H new ATOM 913 N SER A 60 -12.563 -5.021 0.525 1.00 0.00 N ATOM 914 CA SER A 60 -11.712 -5.259 1.684 1.00 0.00 C ATOM 915 C SER A 60 -11.895 -6.693 2.182 1.00 0.00 C ATOM 916 O SER A 60 -10.973 -7.305 2.728 1.00 0.00 O ATOM 917 CB SER A 60 -12.048 -4.259 2.791 1.00 0.00 C ATOM 918 OG SER A 60 -11.953 -2.927 2.317 1.00 0.00 O ATOM 0 H SER A 60 -13.281 -4.310 0.667 1.00 0.00 H new ATOM 0 HA SER A 60 -10.669 -5.123 1.397 1.00 0.00 H new ATOM 0 HB2 SER A 60 -13.056 -4.446 3.162 1.00 0.00 H new ATOM 0 HB3 SER A 60 -11.368 -4.399 3.631 1.00 0.00 H new ATOM 0 HG SER A 60 -12.657 -2.765 1.654 1.00 0.00 H new ATOM 924 N ALA A 61 -13.085 -7.237 1.943 1.00 0.00 N ATOM 925 CA ALA A 61 -13.406 -8.604 2.332 1.00 0.00 C ATOM 926 C ALA A 61 -12.634 -9.623 1.492 1.00 0.00 C ATOM 927 O ALA A 61 -12.634 -10.815 1.800 1.00 0.00 O ATOM 928 CB ALA A 61 -14.902 -8.846 2.215 1.00 0.00 C ATOM 0 H ALA A 61 -13.848 -6.746 1.478 1.00 0.00 H new ATOM 0 HA ALA A 61 -13.104 -8.735 3.371 1.00 0.00 H new ATOM 0 HB1 ALA A 61 -15.129 -9.871 2.508 1.00 0.00 H new ATOM 0 HB2 ALA A 61 -15.435 -8.155 2.869 1.00 0.00 H new ATOM 0 HB3 ALA A 61 -15.217 -8.686 1.184 1.00 0.00 H new ATOM 934 N LYS A 62 -11.982 -9.152 0.429 1.00 0.00 N ATOM 935 CA LYS A 62 -11.144 -10.018 -0.397 1.00 0.00 C ATOM 936 C LYS A 62 -9.862 -10.362 0.351 1.00 0.00 C ATOM 937 O LYS A 62 -9.222 -11.379 0.080 1.00 0.00 O ATOM 938 CB LYS A 62 -10.818 -9.352 -1.738 1.00 0.00 C ATOM 939 CG LYS A 62 -12.053 -9.016 -2.564 1.00 0.00 C ATOM 940 CD LYS A 62 -11.687 -8.421 -3.916 1.00 0.00 C ATOM 941 CE LYS A 62 -11.030 -9.449 -4.827 1.00 0.00 C ATOM 942 NZ LYS A 62 -11.937 -10.593 -5.119 1.00 0.00 N ATOM 0 H LYS A 62 -12.018 -8.180 0.121 1.00 0.00 H new ATOM 0 HA LYS A 62 -11.694 -10.936 -0.604 1.00 0.00 H new ATOM 0 HB2 LYS A 62 -10.254 -8.438 -1.553 1.00 0.00 H new ATOM 0 HB3 LYS A 62 -10.173 -10.013 -2.316 1.00 0.00 H new ATOM 0 HG2 LYS A 62 -12.646 -9.918 -2.713 1.00 0.00 H new ATOM 0 HG3 LYS A 62 -12.677 -8.311 -2.014 1.00 0.00 H new ATOM 0 HD2 LYS A 62 -12.584 -8.031 -4.396 1.00 0.00 H new ATOM 0 HD3 LYS A 62 -11.011 -7.579 -3.771 1.00 0.00 H new ATOM 0 HE2 LYS A 62 -10.737 -8.971 -5.762 1.00 0.00 H new ATOM 0 HE3 LYS A 62 -10.118 -9.819 -4.358 1.00 0.00 H new ATOM 0 HZ1 LYS A 62 -11.584 -11.113 -5.947 1.00 0.00 H new ATOM 0 HZ2 LYS A 62 -11.968 -11.230 -4.297 1.00 0.00 H new ATOM 0 HZ3 LYS A 62 -12.894 -10.236 -5.317 1.00 0.00 H new ATOM 956 N TYR A 63 -9.495 -9.503 1.297 1.00 0.00 N ATOM 957 CA TYR A 63 -8.361 -9.766 2.173 1.00 0.00 C ATOM 958 C TYR A 63 -8.789 -10.725 3.272 1.00 0.00 C ATOM 959 O TYR A 63 -8.212 -11.799 3.437 1.00 0.00 O ATOM 960 CB TYR A 63 -7.830 -8.467 2.787 1.00 0.00 C ATOM 961 CG TYR A 63 -7.189 -7.531 1.787 1.00 0.00 C ATOM 962 CD1 TYR A 63 -7.959 -6.658 1.027 1.00 0.00 C ATOM 963 CD2 TYR A 63 -5.812 -7.522 1.605 1.00 0.00 C ATOM 964 CE1 TYR A 63 -7.372 -5.803 0.114 1.00 0.00 C ATOM 965 CE2 TYR A 63 -5.219 -6.671 0.695 1.00 0.00 C ATOM 966 CZ TYR A 63 -6.002 -5.812 -0.049 1.00 0.00 C ATOM 967 OH TYR A 63 -5.413 -4.962 -0.957 1.00 0.00 O ATOM 0 H TYR A 63 -9.968 -8.617 1.476 1.00 0.00 H new ATOM 0 HA TYR A 63 -7.559 -10.213 1.586 1.00 0.00 H new ATOM 0 HB2 TYR A 63 -8.652 -7.948 3.280 1.00 0.00 H new ATOM 0 HB3 TYR A 63 -7.100 -8.713 3.558 1.00 0.00 H new ATOM 0 HD1 TYR A 63 -9.032 -6.648 1.152 1.00 0.00 H new ATOM 0 HD2 TYR A 63 -5.195 -8.192 2.185 1.00 0.00 H new ATOM 0 HE1 TYR A 63 -7.983 -5.130 -0.470 1.00 0.00 H new ATOM 0 HE2 TYR A 63 -4.147 -6.677 0.566 1.00 0.00 H new ATOM 0 HH TYR A 63 -4.442 -5.095 -0.947 1.00 0.00 H new ATOM 977 N LYS A 64 -9.811 -10.320 4.013 1.00 0.00 N ATOM 978 CA LYS A 64 -10.429 -11.154 5.038 1.00 0.00 C ATOM 979 C LYS A 64 -9.428 -11.578 6.118 1.00 0.00 C ATOM 980 O LYS A 64 -9.195 -10.841 7.077 1.00 0.00 O ATOM 981 CB LYS A 64 -11.100 -12.379 4.400 1.00 0.00 C ATOM 982 CG LYS A 64 -11.942 -13.187 5.368 1.00 0.00 C ATOM 983 CD LYS A 64 -12.545 -14.408 4.703 1.00 0.00 C ATOM 984 CE LYS A 64 -13.287 -15.270 5.708 1.00 0.00 C ATOM 985 NZ LYS A 64 -12.400 -15.700 6.821 1.00 0.00 N ATOM 0 H LYS A 64 -10.238 -9.398 3.920 1.00 0.00 H new ATOM 0 HA LYS A 64 -11.193 -10.554 5.532 1.00 0.00 H new ATOM 0 HB2 LYS A 64 -11.729 -12.048 3.574 1.00 0.00 H new ATOM 0 HB3 LYS A 64 -10.330 -13.024 3.976 1.00 0.00 H new ATOM 0 HG2 LYS A 64 -11.327 -13.499 6.212 1.00 0.00 H new ATOM 0 HG3 LYS A 64 -12.739 -12.560 5.768 1.00 0.00 H new ATOM 0 HD2 LYS A 64 -13.228 -14.095 3.914 1.00 0.00 H new ATOM 0 HD3 LYS A 64 -11.757 -14.994 4.229 1.00 0.00 H new ATOM 0 HE2 LYS A 64 -14.133 -14.714 6.111 1.00 0.00 H new ATOM 0 HE3 LYS A 64 -13.693 -16.148 5.206 1.00 0.00 H new ATOM 0 HZ1 LYS A 64 -12.898 -16.394 7.414 1.00 0.00 H new ATOM 0 HZ2 LYS A 64 -11.539 -16.133 6.431 1.00 0.00 H new ATOM 0 HZ3 LYS A 64 -12.142 -14.874 7.398 1.00 0.00 H new ATOM 999 N ASN A 65 -8.822 -12.749 5.952 1.00 0.00 N ATOM 1000 CA ASN A 65 -7.921 -13.291 6.964 1.00 0.00 C ATOM 1001 C ASN A 65 -6.701 -13.946 6.327 1.00 0.00 C ATOM 1002 O ASN A 65 -6.237 -14.984 6.797 1.00 0.00 O ATOM 1003 CB ASN A 65 -8.641 -14.320 7.847 1.00 0.00 C ATOM 1004 CG ASN A 65 -9.776 -13.728 8.662 1.00 0.00 C ATOM 1005 OD1 ASN A 65 -10.933 -13.743 8.239 1.00 0.00 O ATOM 1006 ND2 ASN A 65 -9.458 -13.200 9.836 1.00 0.00 N ATOM 0 H ASN A 65 -8.938 -13.340 5.129 1.00 0.00 H new ATOM 0 HA ASN A 65 -7.592 -12.454 7.580 1.00 0.00 H new ATOM 0 HB2 ASN A 65 -9.034 -15.117 7.216 1.00 0.00 H new ATOM 0 HB3 ASN A 65 -7.918 -14.776 8.523 1.00 0.00 H new ATOM 0 HD21 ASN A 65 -10.183 -12.787 10.423 1.00 0.00 H new ATOM 0 HD22 ASN A 65 -8.488 -13.206 10.152 1.00 0.00 H new ATOM 1013 N ILE A 66 -6.180 -13.334 5.263 1.00 0.00 N ATOM 1014 CA ILE A 66 -4.959 -13.830 4.612 1.00 0.00 C ATOM 1015 C ILE A 66 -3.809 -13.882 5.611 1.00 0.00 C ATOM 1016 O ILE A 66 -3.014 -14.823 5.631 1.00 0.00 O ATOM 1017 CB ILE A 66 -4.526 -12.926 3.435 1.00 0.00 C ATOM 1018 CG1 ILE A 66 -5.652 -12.792 2.414 1.00 0.00 C ATOM 1019 CG2 ILE A 66 -3.268 -13.471 2.769 1.00 0.00 C ATOM 1020 CD1 ILE A 66 -5.310 -11.889 1.251 1.00 0.00 C ATOM 0 H ILE A 66 -6.579 -12.499 4.833 1.00 0.00 H new ATOM 0 HA ILE A 66 -5.188 -14.826 4.234 1.00 0.00 H new ATOM 0 HB ILE A 66 -4.303 -11.937 3.834 1.00 0.00 H new ATOM 0 HG12 ILE A 66 -5.905 -13.781 2.033 1.00 0.00 H new ATOM 0 HG13 ILE A 66 -6.540 -12.406 2.914 1.00 0.00 H new ATOM 0 HG21 ILE A 66 -2.982 -12.819 1.944 1.00 0.00 H new ATOM 0 HG22 ILE A 66 -2.458 -13.511 3.498 1.00 0.00 H new ATOM 0 HG23 ILE A 66 -3.463 -14.474 2.389 1.00 0.00 H new ATOM 0 HD11 ILE A 66 -6.157 -11.841 0.566 1.00 0.00 H new ATOM 0 HD12 ILE A 66 -5.086 -10.889 1.621 1.00 0.00 H new ATOM 0 HD13 ILE A 66 -4.441 -12.285 0.726 1.00 0.00 H new ATOM 1032 N ALA A 67 -3.751 -12.860 6.446 1.00 0.00 N ATOM 1033 CA ALA A 67 -2.674 -12.682 7.401 1.00 0.00 C ATOM 1034 C ALA A 67 -3.070 -11.587 8.371 1.00 0.00 C ATOM 1035 O ALA A 67 -4.255 -11.420 8.667 1.00 0.00 O ATOM 1036 CB ALA A 67 -1.392 -12.309 6.674 1.00 0.00 C ATOM 0 H ALA A 67 -4.457 -12.124 6.480 1.00 0.00 H new ATOM 0 HA ALA A 67 -2.498 -13.609 7.946 1.00 0.00 H new ATOM 0 HB1 ALA A 67 -0.588 -12.177 7.398 1.00 0.00 H new ATOM 0 HB2 ALA A 67 -1.125 -13.103 5.976 1.00 0.00 H new ATOM 0 HB3 ALA A 67 -1.542 -11.379 6.125 1.00 0.00 H new ATOM 1042 N GLY A 68 -2.095 -10.826 8.845 1.00 0.00 N ATOM 1043 CA GLY A 68 -2.402 -9.645 9.625 1.00 0.00 C ATOM 1044 C GLY A 68 -2.831 -8.498 8.731 1.00 0.00 C ATOM 1045 O GLY A 68 -2.407 -7.359 8.921 1.00 0.00 O ATOM 0 H GLY A 68 -1.101 -11.004 8.704 1.00 0.00 H new ATOM 0 HA2 GLY A 68 -3.195 -9.872 10.337 1.00 0.00 H new ATOM 0 HA3 GLY A 68 -1.527 -9.351 10.205 1.00 0.00 H new ATOM 1049 N VAL A 69 -3.676 -8.814 7.752 1.00 0.00 N ATOM 1050 CA VAL A 69 -4.117 -7.841 6.767 1.00 0.00 C ATOM 1051 C VAL A 69 -5.266 -7.006 7.317 1.00 0.00 C ATOM 1052 O VAL A 69 -6.422 -7.423 7.335 1.00 0.00 O ATOM 1053 CB VAL A 69 -4.523 -8.521 5.432 1.00 0.00 C ATOM 1054 CG1 VAL A 69 -3.284 -8.973 4.676 1.00 0.00 C ATOM 1055 CG2 VAL A 69 -5.450 -9.705 5.671 1.00 0.00 C ATOM 0 H VAL A 69 -4.069 -9.746 7.623 1.00 0.00 H new ATOM 0 HA VAL A 69 -3.276 -7.181 6.556 1.00 0.00 H new ATOM 0 HB VAL A 69 -5.062 -7.787 4.833 1.00 0.00 H new ATOM 0 HG11 VAL A 69 -3.581 -9.449 3.741 1.00 0.00 H new ATOM 0 HG12 VAL A 69 -2.655 -8.110 4.460 1.00 0.00 H new ATOM 0 HG13 VAL A 69 -2.726 -9.685 5.284 1.00 0.00 H new ATOM 0 HG21 VAL A 69 -5.715 -10.158 4.716 1.00 0.00 H new ATOM 0 HG22 VAL A 69 -4.945 -10.442 6.295 1.00 0.00 H new ATOM 0 HG23 VAL A 69 -6.355 -9.363 6.174 1.00 0.00 H new ATOM 1065 N GLU A 70 -4.917 -5.822 7.783 1.00 0.00 N ATOM 1066 CA GLU A 70 -5.869 -4.937 8.423 1.00 0.00 C ATOM 1067 C GLU A 70 -6.333 -3.865 7.439 1.00 0.00 C ATOM 1068 O GLU A 70 -5.567 -2.970 7.084 1.00 0.00 O ATOM 1069 CB GLU A 70 -5.211 -4.300 9.651 1.00 0.00 C ATOM 1070 CG GLU A 70 -6.185 -3.617 10.590 1.00 0.00 C ATOM 1071 CD GLU A 70 -7.264 -4.562 11.077 1.00 0.00 C ATOM 1072 OE1 GLU A 70 -6.979 -5.383 11.973 1.00 0.00 O ATOM 1073 OE2 GLU A 70 -8.396 -4.501 10.559 1.00 0.00 O ATOM 0 H GLU A 70 -3.969 -5.448 7.729 1.00 0.00 H new ATOM 0 HA GLU A 70 -6.744 -5.504 8.741 1.00 0.00 H new ATOM 0 HB2 GLU A 70 -4.672 -5.071 10.202 1.00 0.00 H new ATOM 0 HB3 GLU A 70 -4.473 -3.571 9.317 1.00 0.00 H new ATOM 0 HG2 GLU A 70 -5.642 -3.215 11.446 1.00 0.00 H new ATOM 0 HG3 GLU A 70 -6.647 -2.772 10.080 1.00 0.00 H new ATOM 1080 N GLU A 71 -7.573 -3.971 6.983 1.00 0.00 N ATOM 1081 CA GLU A 71 -8.112 -3.030 6.011 1.00 0.00 C ATOM 1082 C GLU A 71 -8.980 -1.979 6.695 1.00 0.00 C ATOM 1083 O GLU A 71 -10.081 -2.268 7.167 1.00 0.00 O ATOM 1084 CB GLU A 71 -8.905 -3.752 4.908 1.00 0.00 C ATOM 1085 CG GLU A 71 -9.163 -5.236 5.163 1.00 0.00 C ATOM 1086 CD GLU A 71 -10.175 -5.498 6.263 1.00 0.00 C ATOM 1087 OE1 GLU A 71 -9.786 -5.474 7.450 1.00 0.00 O ATOM 1088 OE2 GLU A 71 -11.356 -5.753 5.948 1.00 0.00 O ATOM 0 H GLU A 71 -8.226 -4.700 7.271 1.00 0.00 H new ATOM 0 HA GLU A 71 -7.268 -2.526 5.540 1.00 0.00 H new ATOM 0 HB2 GLU A 71 -9.864 -3.249 4.782 1.00 0.00 H new ATOM 0 HB3 GLU A 71 -8.365 -3.649 3.967 1.00 0.00 H new ATOM 0 HG2 GLU A 71 -9.514 -5.699 4.241 1.00 0.00 H new ATOM 0 HG3 GLU A 71 -8.222 -5.720 5.424 1.00 0.00 H new ATOM 1095 N LYS A 72 -8.462 -0.762 6.762 1.00 0.00 N ATOM 1096 CA LYS A 72 -9.166 0.347 7.387 1.00 0.00 C ATOM 1097 C LYS A 72 -9.640 1.334 6.322 1.00 0.00 C ATOM 1098 O LYS A 72 -8.850 2.101 5.767 1.00 0.00 O ATOM 1099 CB LYS A 72 -8.240 1.031 8.399 1.00 0.00 C ATOM 1100 CG LYS A 72 -8.873 2.177 9.175 1.00 0.00 C ATOM 1101 CD LYS A 72 -7.911 2.705 10.229 1.00 0.00 C ATOM 1102 CE LYS A 72 -8.502 3.855 11.031 1.00 0.00 C ATOM 1103 NZ LYS A 72 -8.709 5.067 10.198 1.00 0.00 N ATOM 0 H LYS A 72 -7.546 -0.516 6.387 1.00 0.00 H new ATOM 0 HA LYS A 72 -10.044 -0.026 7.914 1.00 0.00 H new ATOM 0 HB2 LYS A 72 -7.886 0.283 9.108 1.00 0.00 H new ATOM 0 HB3 LYS A 72 -7.365 1.409 7.871 1.00 0.00 H new ATOM 0 HG2 LYS A 72 -9.147 2.980 8.490 1.00 0.00 H new ATOM 0 HG3 LYS A 72 -9.792 1.837 9.652 1.00 0.00 H new ATOM 0 HD2 LYS A 72 -7.639 1.896 10.906 1.00 0.00 H new ATOM 0 HD3 LYS A 72 -6.993 3.038 9.745 1.00 0.00 H new ATOM 0 HE2 LYS A 72 -9.454 3.545 11.462 1.00 0.00 H new ATOM 0 HE3 LYS A 72 -7.839 4.095 11.862 1.00 0.00 H new ATOM 0 HZ1 LYS A 72 -8.833 5.895 10.815 1.00 0.00 H new ATOM 0 HZ2 LYS A 72 -7.881 5.213 9.585 1.00 0.00 H new ATOM 0 HZ3 LYS A 72 -9.558 4.943 9.610 1.00 0.00 H new ATOM 1117 N LEU A 73 -10.929 1.290 6.021 1.00 0.00 N ATOM 1118 CA LEU A 73 -11.509 2.147 4.998 1.00 0.00 C ATOM 1119 C LEU A 73 -11.790 3.538 5.544 1.00 0.00 C ATOM 1120 O LEU A 73 -12.619 3.712 6.437 1.00 0.00 O ATOM 1121 CB LEU A 73 -12.798 1.527 4.460 1.00 0.00 C ATOM 1122 CG LEU A 73 -12.605 0.269 3.614 1.00 0.00 C ATOM 1123 CD1 LEU A 73 -13.944 -0.370 3.287 1.00 0.00 C ATOM 1124 CD2 LEU A 73 -11.860 0.612 2.335 1.00 0.00 C ATOM 0 H LEU A 73 -11.597 0.666 6.474 1.00 0.00 H new ATOM 0 HA LEU A 73 -10.788 2.238 4.185 1.00 0.00 H new ATOM 0 HB2 LEU A 73 -13.446 1.284 5.302 1.00 0.00 H new ATOM 0 HB3 LEU A 73 -13.320 2.273 3.861 1.00 0.00 H new ATOM 0 HG LEU A 73 -12.016 -0.447 4.187 1.00 0.00 H new ATOM 0 HD11 LEU A 73 -13.783 -1.264 2.684 1.00 0.00 H new ATOM 0 HD12 LEU A 73 -14.453 -0.643 4.212 1.00 0.00 H new ATOM 0 HD13 LEU A 73 -14.558 0.337 2.730 1.00 0.00 H new ATOM 0 HD21 LEU A 73 -11.727 -0.290 1.738 1.00 0.00 H new ATOM 0 HD22 LEU A 73 -12.433 1.343 1.765 1.00 0.00 H new ATOM 0 HD23 LEU A 73 -10.884 1.030 2.583 1.00 0.00 H new ATOM 1136 N THR A 74 -11.097 4.528 5.005 1.00 0.00 N ATOM 1137 CA THR A 74 -11.273 5.899 5.444 1.00 0.00 C ATOM 1138 C THR A 74 -12.013 6.721 4.394 1.00 0.00 C ATOM 1139 O THR A 74 -11.478 7.014 3.325 1.00 0.00 O ATOM 1140 CB THR A 74 -9.923 6.569 5.770 1.00 0.00 C ATOM 1141 OG1 THR A 74 -9.005 6.401 4.686 1.00 0.00 O ATOM 1142 CG2 THR A 74 -9.316 5.983 7.028 1.00 0.00 C ATOM 0 H THR A 74 -10.408 4.406 4.263 1.00 0.00 H new ATOM 0 HA THR A 74 -11.871 5.866 6.355 1.00 0.00 H new ATOM 0 HB THR A 74 -10.112 7.631 5.927 1.00 0.00 H new ATOM 0 HG1 THR A 74 -9.155 5.530 4.262 1.00 0.00 H new ATOM 0 HG21 THR A 74 -8.365 6.473 7.235 1.00 0.00 H new ATOM 0 HG22 THR A 74 -9.995 6.139 7.866 1.00 0.00 H new ATOM 0 HG23 THR A 74 -9.151 4.915 6.889 1.00 0.00 H new ATOM 1150 N TYR A 75 -13.251 7.068 4.694 1.00 0.00 N ATOM 1151 CA TYR A 75 -14.034 7.930 3.825 1.00 0.00 C ATOM 1152 C TYR A 75 -13.953 9.357 4.350 1.00 0.00 C ATOM 1153 O TYR A 75 -14.612 9.701 5.332 1.00 0.00 O ATOM 1154 CB TYR A 75 -15.490 7.452 3.768 1.00 0.00 C ATOM 1155 CG TYR A 75 -15.635 6.001 3.354 1.00 0.00 C ATOM 1156 CD1 TYR A 75 -15.726 5.645 2.015 1.00 0.00 C ATOM 1157 CD2 TYR A 75 -15.670 4.986 4.305 1.00 0.00 C ATOM 1158 CE1 TYR A 75 -15.851 4.323 1.635 1.00 0.00 C ATOM 1159 CE2 TYR A 75 -15.791 3.662 3.932 1.00 0.00 C ATOM 1160 CZ TYR A 75 -15.882 3.336 2.597 1.00 0.00 C ATOM 1161 OH TYR A 75 -15.998 2.017 2.223 1.00 0.00 O ATOM 0 H TYR A 75 -13.739 6.765 5.537 1.00 0.00 H new ATOM 0 HA TYR A 75 -13.634 7.894 2.812 1.00 0.00 H new ATOM 0 HB2 TYR A 75 -15.948 7.589 4.748 1.00 0.00 H new ATOM 0 HB3 TYR A 75 -16.042 8.078 3.067 1.00 0.00 H new ATOM 0 HD1 TYR A 75 -15.699 6.415 1.258 1.00 0.00 H new ATOM 0 HD2 TYR A 75 -15.601 5.238 5.353 1.00 0.00 H new ATOM 0 HE1 TYR A 75 -15.924 4.064 0.589 1.00 0.00 H new ATOM 0 HE2 TYR A 75 -15.814 2.886 4.683 1.00 0.00 H new ATOM 0 HH TYR A 75 -16.600 1.553 2.842 1.00 0.00 H new ATOM 1171 N THR A 76 -13.133 10.178 3.710 1.00 0.00 N ATOM 1172 CA THR A 76 -12.811 11.490 4.249 1.00 0.00 C ATOM 1173 C THR A 76 -13.807 12.547 3.793 1.00 0.00 C ATOM 1174 O THR A 76 -14.218 13.403 4.577 1.00 0.00 O ATOM 1175 CB THR A 76 -11.384 11.908 3.849 1.00 0.00 C ATOM 1176 OG1 THR A 76 -10.465 10.852 4.160 1.00 0.00 O ATOM 1177 CG2 THR A 76 -10.963 13.177 4.573 1.00 0.00 C ATOM 0 H THR A 76 -12.681 9.960 2.822 1.00 0.00 H new ATOM 0 HA THR A 76 -12.871 11.416 5.335 1.00 0.00 H new ATOM 0 HB THR A 76 -11.374 12.103 2.777 1.00 0.00 H new ATOM 0 HG1 THR A 76 -9.818 10.756 3.430 1.00 0.00 H new ATOM 0 HG21 THR A 76 -9.951 13.449 4.272 1.00 0.00 H new ATOM 0 HG22 THR A 76 -11.648 13.986 4.318 1.00 0.00 H new ATOM 0 HG23 THR A 76 -10.988 13.007 5.649 1.00 0.00 H new ATOM 1185 N ASP A 77 -14.196 12.474 2.529 1.00 0.00 N ATOM 1186 CA ASP A 77 -15.128 13.443 1.955 1.00 0.00 C ATOM 1187 C ASP A 77 -15.507 13.057 0.530 1.00 0.00 C ATOM 1188 O ASP A 77 -16.562 12.477 0.302 1.00 0.00 O ATOM 1189 CB ASP A 77 -14.527 14.855 1.980 1.00 0.00 C ATOM 1190 CG ASP A 77 -15.418 15.882 1.316 1.00 0.00 C ATOM 1191 OD1 ASP A 77 -16.515 16.162 1.837 1.00 0.00 O ATOM 1192 OD2 ASP A 77 -15.017 16.422 0.268 1.00 0.00 O ATOM 0 H ASP A 77 -13.882 11.754 1.878 1.00 0.00 H new ATOM 0 HA ASP A 77 -16.032 13.438 2.564 1.00 0.00 H new ATOM 0 HB2 ASP A 77 -14.347 15.150 3.014 1.00 0.00 H new ATOM 0 HB3 ASP A 77 -13.559 14.842 1.479 1.00 0.00 H new ATOM 1197 N THR A 78 -14.625 13.350 -0.417 1.00 0.00 N ATOM 1198 CA THR A 78 -14.887 13.058 -1.821 1.00 0.00 C ATOM 1199 C THR A 78 -13.877 12.025 -2.323 1.00 0.00 C ATOM 1200 O THR A 78 -13.649 11.852 -3.523 1.00 0.00 O ATOM 1201 CB THR A 78 -14.835 14.347 -2.676 1.00 0.00 C ATOM 1202 OG1 THR A 78 -15.623 15.371 -2.053 1.00 0.00 O ATOM 1203 CG2 THR A 78 -15.374 14.109 -4.083 1.00 0.00 C ATOM 0 H THR A 78 -13.722 13.790 -0.239 1.00 0.00 H new ATOM 0 HA THR A 78 -15.892 12.647 -1.916 1.00 0.00 H new ATOM 0 HB THR A 78 -13.791 14.654 -2.748 1.00 0.00 H new ATOM 0 HG1 THR A 78 -15.148 15.718 -1.270 1.00 0.00 H new ATOM 0 HG21 THR A 78 -15.322 15.036 -4.654 1.00 0.00 H new ATOM 0 HG22 THR A 78 -14.775 13.344 -4.577 1.00 0.00 H new ATOM 0 HG23 THR A 78 -16.410 13.777 -4.024 1.00 0.00 H new ATOM 1211 N TYR A 79 -13.282 11.323 -1.377 1.00 0.00 N ATOM 1212 CA TYR A 79 -12.358 10.254 -1.686 1.00 0.00 C ATOM 1213 C TYR A 79 -12.333 9.257 -0.545 1.00 0.00 C ATOM 1214 O TYR A 79 -12.672 9.596 0.596 1.00 0.00 O ATOM 1215 CB TYR A 79 -10.950 10.797 -1.954 1.00 0.00 C ATOM 1216 CG TYR A 79 -10.320 11.536 -0.793 1.00 0.00 C ATOM 1217 CD1 TYR A 79 -9.599 10.854 0.179 1.00 0.00 C ATOM 1218 CD2 TYR A 79 -10.433 12.914 -0.679 1.00 0.00 C ATOM 1219 CE1 TYR A 79 -9.011 11.525 1.232 1.00 0.00 C ATOM 1220 CE2 TYR A 79 -9.845 13.592 0.369 1.00 0.00 C ATOM 1221 CZ TYR A 79 -9.135 12.893 1.321 1.00 0.00 C ATOM 1222 OH TYR A 79 -8.549 13.567 2.367 1.00 0.00 O ATOM 0 H TYR A 79 -13.426 11.478 -0.379 1.00 0.00 H new ATOM 0 HA TYR A 79 -12.698 9.755 -2.594 1.00 0.00 H new ATOM 0 HB2 TYR A 79 -10.302 9.965 -2.231 1.00 0.00 H new ATOM 0 HB3 TYR A 79 -10.992 11.467 -2.812 1.00 0.00 H new ATOM 0 HD1 TYR A 79 -9.497 9.781 0.110 1.00 0.00 H new ATOM 0 HD2 TYR A 79 -10.990 13.465 -1.422 1.00 0.00 H new ATOM 0 HE1 TYR A 79 -8.457 10.980 1.982 1.00 0.00 H new ATOM 0 HE2 TYR A 79 -9.941 14.665 0.443 1.00 0.00 H new ATOM 0 HH TYR A 79 -8.731 14.526 2.281 1.00 0.00 H new ATOM 1232 N ALA A 80 -11.941 8.040 -0.859 1.00 0.00 N ATOM 1233 CA ALA A 80 -11.865 6.986 0.128 1.00 0.00 C ATOM 1234 C ALA A 80 -10.501 6.324 0.081 1.00 0.00 C ATOM 1235 O ALA A 80 -10.057 5.870 -0.974 1.00 0.00 O ATOM 1236 CB ALA A 80 -12.965 5.967 -0.106 1.00 0.00 C ATOM 0 H ALA A 80 -11.668 7.756 -1.800 1.00 0.00 H new ATOM 0 HA ALA A 80 -12.004 7.419 1.119 1.00 0.00 H new ATOM 0 HB1 ALA A 80 -12.896 5.179 0.644 1.00 0.00 H new ATOM 0 HB2 ALA A 80 -13.936 6.456 -0.031 1.00 0.00 H new ATOM 0 HB3 ALA A 80 -12.854 5.533 -1.100 1.00 0.00 H new ATOM 1242 N GLN A 81 -9.827 6.292 1.215 1.00 0.00 N ATOM 1243 CA GLN A 81 -8.518 5.676 1.293 1.00 0.00 C ATOM 1244 C GLN A 81 -8.621 4.310 1.935 1.00 0.00 C ATOM 1245 O GLN A 81 -9.080 4.182 3.078 1.00 0.00 O ATOM 1246 CB GLN A 81 -7.556 6.549 2.098 1.00 0.00 C ATOM 1247 CG GLN A 81 -6.111 6.079 2.033 1.00 0.00 C ATOM 1248 CD GLN A 81 -5.164 6.979 2.802 1.00 0.00 C ATOM 1249 OE1 GLN A 81 -4.620 7.937 2.257 1.00 0.00 O ATOM 1250 NE2 GLN A 81 -4.960 6.673 4.074 1.00 0.00 N ATOM 0 H GLN A 81 -10.165 6.685 2.094 1.00 0.00 H new ATOM 0 HA GLN A 81 -8.131 5.570 0.279 1.00 0.00 H new ATOM 0 HB2 GLN A 81 -7.613 7.573 1.730 1.00 0.00 H new ATOM 0 HB3 GLN A 81 -7.878 6.566 3.139 1.00 0.00 H new ATOM 0 HG2 GLN A 81 -6.045 5.066 2.431 1.00 0.00 H new ATOM 0 HG3 GLN A 81 -5.795 6.033 0.991 1.00 0.00 H new ATOM 0 HE21 GLN A 81 -5.432 5.869 4.487 1.00 0.00 H new ATOM 0 HE22 GLN A 81 -4.331 7.242 4.641 1.00 0.00 H new ATOM 1259 N GLU A 82 -8.219 3.291 1.206 1.00 0.00 N ATOM 1260 CA GLU A 82 -8.134 1.958 1.754 1.00 0.00 C ATOM 1261 C GLU A 82 -6.805 1.814 2.476 1.00 0.00 C ATOM 1262 O GLU A 82 -5.776 1.549 1.851 1.00 0.00 O ATOM 1263 CB GLU A 82 -8.265 0.894 0.658 1.00 0.00 C ATOM 1264 CG GLU A 82 -9.493 1.054 -0.223 1.00 0.00 C ATOM 1265 CD GLU A 82 -9.612 -0.051 -1.257 1.00 0.00 C ATOM 1266 OE1 GLU A 82 -10.201 -1.105 -0.937 1.00 0.00 O ATOM 1267 OE2 GLU A 82 -9.114 0.136 -2.389 1.00 0.00 O ATOM 0 H GLU A 82 -7.945 3.363 0.226 1.00 0.00 H new ATOM 0 HA GLU A 82 -8.957 1.806 2.452 1.00 0.00 H new ATOM 0 HB2 GLU A 82 -7.375 0.924 0.030 1.00 0.00 H new ATOM 0 HB3 GLU A 82 -8.292 -0.091 1.125 1.00 0.00 H new ATOM 0 HG2 GLU A 82 -10.386 1.061 0.402 1.00 0.00 H new ATOM 0 HG3 GLU A 82 -9.450 2.018 -0.729 1.00 0.00 H new ATOM 1274 N ASN A 83 -6.812 2.047 3.777 1.00 0.00 N ATOM 1275 CA ASN A 83 -5.609 1.922 4.582 1.00 0.00 C ATOM 1276 C ASN A 83 -5.370 0.452 4.854 1.00 0.00 C ATOM 1277 O ASN A 83 -5.899 -0.103 5.816 1.00 0.00 O ATOM 1278 CB ASN A 83 -5.751 2.704 5.897 1.00 0.00 C ATOM 1279 CG ASN A 83 -4.455 2.852 6.694 1.00 0.00 C ATOM 1280 OD1 ASN A 83 -4.289 3.825 7.430 1.00 0.00 O ATOM 1281 ND2 ASN A 83 -3.535 1.901 6.576 1.00 0.00 N ATOM 0 H ASN A 83 -7.642 2.325 4.301 1.00 0.00 H new ATOM 0 HA ASN A 83 -4.758 2.341 4.045 1.00 0.00 H new ATOM 0 HB2 ASN A 83 -6.140 3.697 5.673 1.00 0.00 H new ATOM 0 HB3 ASN A 83 -6.492 2.205 6.522 1.00 0.00 H new ATOM 0 HD21 ASN A 83 -2.664 1.966 7.103 1.00 0.00 H new ATOM 0 HD22 ASN A 83 -3.700 1.106 5.959 1.00 0.00 H new ATOM 1288 N VAL A 84 -4.603 -0.182 3.992 1.00 0.00 N ATOM 1289 CA VAL A 84 -4.394 -1.615 4.101 1.00 0.00 C ATOM 1290 C VAL A 84 -3.103 -1.895 4.848 1.00 0.00 C ATOM 1291 O VAL A 84 -2.073 -1.312 4.558 1.00 0.00 O ATOM 1292 CB VAL A 84 -4.358 -2.301 2.719 1.00 0.00 C ATOM 1293 CG1 VAL A 84 -4.167 -3.804 2.864 1.00 0.00 C ATOM 1294 CG2 VAL A 84 -5.627 -2.000 1.937 1.00 0.00 C ATOM 0 H VAL A 84 -4.117 0.265 3.214 1.00 0.00 H new ATOM 0 HA VAL A 84 -5.238 -2.028 4.654 1.00 0.00 H new ATOM 0 HB VAL A 84 -3.508 -1.901 2.166 1.00 0.00 H new ATOM 0 HG11 VAL A 84 -4.145 -4.265 1.876 1.00 0.00 H new ATOM 0 HG12 VAL A 84 -3.227 -4.003 3.379 1.00 0.00 H new ATOM 0 HG13 VAL A 84 -4.992 -4.222 3.441 1.00 0.00 H new ATOM 0 HG21 VAL A 84 -5.581 -2.493 0.966 1.00 0.00 H new ATOM 0 HG22 VAL A 84 -6.491 -2.368 2.490 1.00 0.00 H new ATOM 0 HG23 VAL A 84 -5.719 -0.923 1.794 1.00 0.00 H new ATOM 1304 N THR A 85 -3.171 -2.761 5.832 1.00 0.00 N ATOM 1305 CA THR A 85 -1.998 -3.113 6.598 1.00 0.00 C ATOM 1306 C THR A 85 -1.623 -4.564 6.331 1.00 0.00 C ATOM 1307 O THR A 85 -2.279 -5.476 6.824 1.00 0.00 O ATOM 1308 CB THR A 85 -2.253 -2.901 8.099 1.00 0.00 C ATOM 1309 OG1 THR A 85 -2.965 -1.670 8.301 1.00 0.00 O ATOM 1310 CG2 THR A 85 -0.946 -2.854 8.863 1.00 0.00 C ATOM 0 H THR A 85 -4.027 -3.235 6.121 1.00 0.00 H new ATOM 0 HA THR A 85 -1.173 -2.469 6.293 1.00 0.00 H new ATOM 0 HB THR A 85 -2.847 -3.737 8.468 1.00 0.00 H new ATOM 0 HG1 THR A 85 -3.911 -1.799 8.079 1.00 0.00 H new ATOM 0 HG21 THR A 85 -1.149 -2.703 9.923 1.00 0.00 H new ATOM 0 HG22 THR A 85 -0.411 -3.794 8.726 1.00 0.00 H new ATOM 0 HG23 THR A 85 -0.336 -2.031 8.490 1.00 0.00 H new ATOM 1318 N ILE A 86 -0.599 -4.773 5.518 1.00 0.00 N ATOM 1319 CA ILE A 86 -0.186 -6.119 5.146 1.00 0.00 C ATOM 1320 C ILE A 86 1.015 -6.565 5.976 1.00 0.00 C ATOM 1321 O ILE A 86 2.121 -6.046 5.814 1.00 0.00 O ATOM 1322 CB ILE A 86 0.169 -6.207 3.644 1.00 0.00 C ATOM 1323 CG1 ILE A 86 -0.990 -5.681 2.789 1.00 0.00 C ATOM 1324 CG2 ILE A 86 0.502 -7.643 3.261 1.00 0.00 C ATOM 1325 CD1 ILE A 86 -0.687 -5.642 1.306 1.00 0.00 C ATOM 0 H ILE A 86 -0.038 -4.029 5.103 1.00 0.00 H new ATOM 0 HA ILE A 86 -1.029 -6.781 5.344 1.00 0.00 H new ATOM 0 HB ILE A 86 1.046 -5.586 3.458 1.00 0.00 H new ATOM 0 HG12 ILE A 86 -1.866 -6.309 2.955 1.00 0.00 H new ATOM 0 HG13 ILE A 86 -1.250 -4.677 3.124 1.00 0.00 H new ATOM 0 HG21 ILE A 86 0.750 -7.689 2.201 1.00 0.00 H new ATOM 0 HG22 ILE A 86 1.353 -7.988 3.848 1.00 0.00 H new ATOM 0 HG23 ILE A 86 -0.359 -8.282 3.460 1.00 0.00 H new ATOM 0 HD11 ILE A 86 -1.554 -5.259 0.767 1.00 0.00 H new ATOM 0 HD12 ILE A 86 0.168 -4.991 1.126 1.00 0.00 H new ATOM 0 HD13 ILE A 86 -0.457 -6.648 0.955 1.00 0.00 H new ATOM 1337 N ASP A 87 0.786 -7.509 6.877 1.00 0.00 N ATOM 1338 CA ASP A 87 1.857 -8.051 7.704 1.00 0.00 C ATOM 1339 C ASP A 87 2.555 -9.189 6.965 1.00 0.00 C ATOM 1340 O ASP A 87 1.975 -10.259 6.757 1.00 0.00 O ATOM 1341 CB ASP A 87 1.297 -8.546 9.039 1.00 0.00 C ATOM 1342 CG ASP A 87 2.382 -8.871 10.045 1.00 0.00 C ATOM 1343 OD1 ASP A 87 2.927 -9.993 10.002 1.00 0.00 O ATOM 1344 OD2 ASP A 87 2.684 -8.007 10.898 1.00 0.00 O ATOM 0 H ASP A 87 -0.132 -7.917 7.055 1.00 0.00 H new ATOM 0 HA ASP A 87 2.583 -7.264 7.906 1.00 0.00 H new ATOM 0 HB2 ASP A 87 0.637 -7.785 9.456 1.00 0.00 H new ATOM 0 HB3 ASP A 87 0.690 -9.435 8.866 1.00 0.00 H new ATOM 1349 N MET A 88 3.803 -8.955 6.580 1.00 0.00 N ATOM 1350 CA MET A 88 4.539 -9.878 5.716 1.00 0.00 C ATOM 1351 C MET A 88 5.171 -11.021 6.500 1.00 0.00 C ATOM 1352 O MET A 88 5.885 -11.853 5.938 1.00 0.00 O ATOM 1353 CB MET A 88 5.624 -9.135 4.940 1.00 0.00 C ATOM 1354 CG MET A 88 5.082 -8.181 3.890 1.00 0.00 C ATOM 1355 SD MET A 88 4.148 -9.031 2.606 1.00 0.00 S ATOM 1356 CE MET A 88 3.734 -7.655 1.543 1.00 0.00 C ATOM 0 H MET A 88 4.333 -8.128 6.854 1.00 0.00 H new ATOM 0 HA MET A 88 3.815 -10.305 5.022 1.00 0.00 H new ATOM 0 HB2 MET A 88 6.241 -8.575 5.642 1.00 0.00 H new ATOM 0 HB3 MET A 88 6.274 -9.863 4.455 1.00 0.00 H new ATOM 0 HG2 MET A 88 4.442 -7.441 4.371 1.00 0.00 H new ATOM 0 HG3 MET A 88 5.910 -7.638 3.434 1.00 0.00 H new ATOM 0 HE1 MET A 88 3.245 -8.026 0.642 1.00 0.00 H new ATOM 0 HE2 MET A 88 3.061 -6.978 2.069 1.00 0.00 H new ATOM 0 HE3 MET A 88 4.644 -7.121 1.269 1.00 0.00 H new ATOM 1366 N GLU A 89 4.911 -11.069 7.791 1.00 0.00 N ATOM 1367 CA GLU A 89 5.406 -12.160 8.611 1.00 0.00 C ATOM 1368 C GLU A 89 4.391 -13.294 8.658 1.00 0.00 C ATOM 1369 O GLU A 89 4.696 -14.397 9.109 1.00 0.00 O ATOM 1370 CB GLU A 89 5.722 -11.666 10.021 1.00 0.00 C ATOM 1371 CG GLU A 89 7.052 -10.940 10.127 1.00 0.00 C ATOM 1372 CD GLU A 89 8.231 -11.891 10.074 1.00 0.00 C ATOM 1373 OE1 GLU A 89 8.712 -12.202 8.965 1.00 0.00 O ATOM 1374 OE2 GLU A 89 8.673 -12.345 11.151 1.00 0.00 O ATOM 0 H GLU A 89 4.363 -10.371 8.294 1.00 0.00 H new ATOM 0 HA GLU A 89 6.325 -12.539 8.164 1.00 0.00 H new ATOM 0 HB2 GLU A 89 4.926 -10.998 10.350 1.00 0.00 H new ATOM 0 HB3 GLU A 89 5.727 -12.517 10.703 1.00 0.00 H new ATOM 0 HG2 GLU A 89 7.134 -10.217 9.316 1.00 0.00 H new ATOM 0 HG3 GLU A 89 7.083 -10.377 11.060 1.00 0.00 H new ATOM 1381 N LYS A 90 3.186 -13.026 8.173 1.00 0.00 N ATOM 1382 CA LYS A 90 2.118 -14.012 8.230 1.00 0.00 C ATOM 1383 C LYS A 90 1.434 -14.180 6.871 1.00 0.00 C ATOM 1384 O LYS A 90 0.519 -14.991 6.730 1.00 0.00 O ATOM 1385 CB LYS A 90 1.094 -13.591 9.291 1.00 0.00 C ATOM 1386 CG LYS A 90 0.103 -14.680 9.669 1.00 0.00 C ATOM 1387 CD LYS A 90 -0.943 -14.164 10.643 1.00 0.00 C ATOM 1388 CE LYS A 90 -1.895 -15.265 11.080 1.00 0.00 C ATOM 1389 NZ LYS A 90 -1.211 -16.311 11.886 1.00 0.00 N ATOM 0 H LYS A 90 2.926 -12.140 7.739 1.00 0.00 H new ATOM 0 HA LYS A 90 2.553 -14.975 8.499 1.00 0.00 H new ATOM 0 HB2 LYS A 90 1.626 -13.273 10.187 1.00 0.00 H new ATOM 0 HB3 LYS A 90 0.543 -12.725 8.924 1.00 0.00 H new ATOM 0 HG2 LYS A 90 -0.388 -15.055 8.771 1.00 0.00 H new ATOM 0 HG3 LYS A 90 0.636 -15.520 10.116 1.00 0.00 H new ATOM 0 HD2 LYS A 90 -0.449 -13.742 11.518 1.00 0.00 H new ATOM 0 HD3 LYS A 90 -1.509 -13.358 10.176 1.00 0.00 H new ATOM 0 HE2 LYS A 90 -2.706 -14.831 11.664 1.00 0.00 H new ATOM 0 HE3 LYS A 90 -2.346 -15.724 10.200 1.00 0.00 H new ATOM 0 HZ1 LYS A 90 -1.922 -16.927 12.330 1.00 0.00 H new ATOM 0 HZ2 LYS A 90 -0.598 -16.880 11.268 1.00 0.00 H new ATOM 0 HZ3 LYS A 90 -0.634 -15.859 12.624 1.00 0.00 H new ATOM 1403 N VAL A 91 1.888 -13.427 5.870 1.00 0.00 N ATOM 1404 CA VAL A 91 1.232 -13.410 4.559 1.00 0.00 C ATOM 1405 C VAL A 91 1.148 -14.785 3.917 1.00 0.00 C ATOM 1406 O VAL A 91 2.139 -15.509 3.822 1.00 0.00 O ATOM 1407 CB VAL A 91 1.925 -12.470 3.552 1.00 0.00 C ATOM 1408 CG1 VAL A 91 1.387 -11.058 3.672 1.00 0.00 C ATOM 1409 CG2 VAL A 91 3.433 -12.486 3.737 1.00 0.00 C ATOM 0 H VAL A 91 2.706 -12.821 5.939 1.00 0.00 H new ATOM 0 HA VAL A 91 0.228 -13.044 4.775 1.00 0.00 H new ATOM 0 HB VAL A 91 1.704 -12.836 2.549 1.00 0.00 H new ATOM 0 HG11 VAL A 91 1.891 -10.414 2.952 1.00 0.00 H new ATOM 0 HG12 VAL A 91 0.316 -11.058 3.471 1.00 0.00 H new ATOM 0 HG13 VAL A 91 1.566 -10.685 4.680 1.00 0.00 H new ATOM 0 HG21 VAL A 91 3.895 -11.814 3.014 1.00 0.00 H new ATOM 0 HG22 VAL A 91 3.679 -12.157 4.747 1.00 0.00 H new ATOM 0 HG23 VAL A 91 3.808 -13.498 3.583 1.00 0.00 H new ATOM 1419 N ASP A 92 -0.052 -15.136 3.489 1.00 0.00 N ATOM 1420 CA ASP A 92 -0.249 -16.301 2.650 1.00 0.00 C ATOM 1421 C ASP A 92 -0.206 -15.874 1.195 1.00 0.00 C ATOM 1422 O ASP A 92 -1.132 -15.228 0.699 1.00 0.00 O ATOM 1423 CB ASP A 92 -1.584 -16.981 2.954 1.00 0.00 C ATOM 1424 CG ASP A 92 -1.853 -18.137 2.015 1.00 0.00 C ATOM 1425 OD1 ASP A 92 -1.103 -19.134 2.069 1.00 0.00 O ATOM 1426 OD2 ASP A 92 -2.805 -18.052 1.210 1.00 0.00 O ATOM 0 H ASP A 92 -0.907 -14.627 3.711 1.00 0.00 H new ATOM 0 HA ASP A 92 0.546 -17.019 2.853 1.00 0.00 H new ATOM 0 HB2 ASP A 92 -1.582 -17.341 3.983 1.00 0.00 H new ATOM 0 HB3 ASP A 92 -2.390 -16.252 2.873 1.00 0.00 H new ATOM 1431 N PHE A 93 0.873 -16.219 0.512 1.00 0.00 N ATOM 1432 CA PHE A 93 1.074 -15.767 -0.857 1.00 0.00 C ATOM 1433 C PHE A 93 0.130 -16.478 -1.822 1.00 0.00 C ATOM 1434 O PHE A 93 -0.012 -16.074 -2.973 1.00 0.00 O ATOM 1435 CB PHE A 93 2.526 -15.967 -1.293 1.00 0.00 C ATOM 1436 CG PHE A 93 3.514 -15.112 -0.547 1.00 0.00 C ATOM 1437 CD1 PHE A 93 4.110 -15.563 0.621 1.00 0.00 C ATOM 1438 CD2 PHE A 93 3.848 -13.852 -1.019 1.00 0.00 C ATOM 1439 CE1 PHE A 93 5.019 -14.774 1.301 1.00 0.00 C ATOM 1440 CE2 PHE A 93 4.756 -13.061 -0.343 1.00 0.00 C ATOM 1441 CZ PHE A 93 5.342 -13.520 0.819 1.00 0.00 C ATOM 0 H PHE A 93 1.620 -16.808 0.880 1.00 0.00 H new ATOM 0 HA PHE A 93 0.848 -14.701 -0.884 1.00 0.00 H new ATOM 0 HB2 PHE A 93 2.794 -17.015 -1.158 1.00 0.00 H new ATOM 0 HB3 PHE A 93 2.607 -15.752 -2.358 1.00 0.00 H new ATOM 0 HD1 PHE A 93 3.861 -16.542 1.004 1.00 0.00 H new ATOM 0 HD2 PHE A 93 3.392 -13.484 -1.927 1.00 0.00 H new ATOM 0 HE1 PHE A 93 5.477 -15.138 2.209 1.00 0.00 H new ATOM 0 HE2 PHE A 93 5.008 -12.082 -0.724 1.00 0.00 H new ATOM 0 HZ PHE A 93 6.050 -12.901 1.350 1.00 0.00 H new ATOM 1451 N LYS A 94 -0.523 -17.529 -1.345 1.00 0.00 N ATOM 1452 CA LYS A 94 -1.477 -18.263 -2.163 1.00 0.00 C ATOM 1453 C LYS A 94 -2.734 -17.424 -2.381 1.00 0.00 C ATOM 1454 O LYS A 94 -3.274 -17.364 -3.487 1.00 0.00 O ATOM 1455 CB LYS A 94 -1.827 -19.602 -1.511 1.00 0.00 C ATOM 1456 CG LYS A 94 -0.610 -20.471 -1.226 1.00 0.00 C ATOM 1457 CD LYS A 94 -1.005 -21.811 -0.624 1.00 0.00 C ATOM 1458 CE LYS A 94 0.214 -22.647 -0.265 1.00 0.00 C ATOM 1459 NZ LYS A 94 1.089 -22.894 -1.442 1.00 0.00 N ATOM 0 H LYS A 94 -0.410 -17.891 -0.398 1.00 0.00 H new ATOM 0 HA LYS A 94 -1.022 -18.468 -3.132 1.00 0.00 H new ATOM 0 HB2 LYS A 94 -2.358 -19.416 -0.577 1.00 0.00 H new ATOM 0 HB3 LYS A 94 -2.510 -20.148 -2.162 1.00 0.00 H new ATOM 0 HG2 LYS A 94 -0.056 -20.636 -2.150 1.00 0.00 H new ATOM 0 HG3 LYS A 94 0.059 -19.948 -0.543 1.00 0.00 H new ATOM 0 HD2 LYS A 94 -1.608 -21.645 0.268 1.00 0.00 H new ATOM 0 HD3 LYS A 94 -1.627 -22.359 -1.332 1.00 0.00 H new ATOM 0 HE2 LYS A 94 0.786 -22.139 0.511 1.00 0.00 H new ATOM 0 HE3 LYS A 94 -0.111 -23.601 0.151 1.00 0.00 H new ATOM 0 HZ1 LYS A 94 1.800 -23.614 -1.201 1.00 0.00 H new ATOM 0 HZ2 LYS A 94 0.512 -23.231 -2.239 1.00 0.00 H new ATOM 0 HZ3 LYS A 94 1.568 -22.011 -1.710 1.00 0.00 H new ATOM 1473 N ALA A 95 -3.196 -16.770 -1.321 1.00 0.00 N ATOM 1474 CA ALA A 95 -4.314 -15.839 -1.429 1.00 0.00 C ATOM 1475 C ALA A 95 -3.840 -14.500 -1.983 1.00 0.00 C ATOM 1476 O ALA A 95 -4.570 -13.811 -2.703 1.00 0.00 O ATOM 1477 CB ALA A 95 -4.978 -15.648 -0.075 1.00 0.00 C ATOM 0 H ALA A 95 -2.815 -16.867 -0.380 1.00 0.00 H new ATOM 0 HA ALA A 95 -5.048 -16.258 -2.118 1.00 0.00 H new ATOM 0 HB1 ALA A 95 -5.810 -14.951 -0.173 1.00 0.00 H new ATOM 0 HB2 ALA A 95 -5.349 -16.607 0.287 1.00 0.00 H new ATOM 0 HB3 ALA A 95 -4.252 -15.249 0.633 1.00 0.00 H new ATOM 1483 N LEU A 96 -2.600 -14.151 -1.653 1.00 0.00 N ATOM 1484 CA LEU A 96 -1.995 -12.898 -2.094 1.00 0.00 C ATOM 1485 C LEU A 96 -1.746 -12.918 -3.599 1.00 0.00 C ATOM 1486 O LEU A 96 -1.539 -11.877 -4.215 1.00 0.00 O ATOM 1487 CB LEU A 96 -0.670 -12.676 -1.362 1.00 0.00 C ATOM 1488 CG LEU A 96 -0.080 -11.271 -1.467 1.00 0.00 C ATOM 1489 CD1 LEU A 96 -0.164 -10.565 -0.129 1.00 0.00 C ATOM 1490 CD2 LEU A 96 1.359 -11.331 -1.956 1.00 0.00 C ATOM 0 H LEU A 96 -1.988 -14.726 -1.074 1.00 0.00 H new ATOM 0 HA LEU A 96 -2.683 -12.085 -1.863 1.00 0.00 H new ATOM 0 HB2 LEU A 96 -0.815 -12.911 -0.308 1.00 0.00 H new ATOM 0 HB3 LEU A 96 0.061 -13.386 -1.749 1.00 0.00 H new ATOM 0 HG LEU A 96 -0.661 -10.703 -2.193 1.00 0.00 H new ATOM 0 HD11 LEU A 96 0.260 -9.565 -0.218 1.00 0.00 H new ATOM 0 HD12 LEU A 96 -1.207 -10.491 0.178 1.00 0.00 H new ATOM 0 HD13 LEU A 96 0.395 -11.131 0.617 1.00 0.00 H new ATOM 0 HD21 LEU A 96 1.762 -10.321 -2.025 1.00 0.00 H new ATOM 0 HD22 LEU A 96 1.957 -11.914 -1.256 1.00 0.00 H new ATOM 0 HD23 LEU A 96 1.390 -11.801 -2.939 1.00 0.00 H new ATOM 1502 N GLN A 97 -1.759 -14.113 -4.179 1.00 0.00 N ATOM 1503 CA GLN A 97 -1.576 -14.278 -5.617 1.00 0.00 C ATOM 1504 C GLN A 97 -2.626 -13.481 -6.390 1.00 0.00 C ATOM 1505 O GLN A 97 -2.369 -12.994 -7.493 1.00 0.00 O ATOM 1506 CB GLN A 97 -1.648 -15.763 -5.984 1.00 0.00 C ATOM 1507 CG GLN A 97 -1.513 -16.039 -7.472 1.00 0.00 C ATOM 1508 CD GLN A 97 -1.413 -17.520 -7.782 1.00 0.00 C ATOM 1509 OE1 GLN A 97 -0.320 -18.077 -7.838 1.00 0.00 O ATOM 1510 NE2 GLN A 97 -2.549 -18.171 -7.972 1.00 0.00 N ATOM 0 H GLN A 97 -1.895 -14.987 -3.672 1.00 0.00 H new ATOM 0 HA GLN A 97 -0.593 -13.895 -5.892 1.00 0.00 H new ATOM 0 HB2 GLN A 97 -0.860 -16.297 -5.453 1.00 0.00 H new ATOM 0 HB3 GLN A 97 -2.598 -16.167 -5.635 1.00 0.00 H new ATOM 0 HG2 GLN A 97 -2.372 -15.619 -7.995 1.00 0.00 H new ATOM 0 HG3 GLN A 97 -0.627 -15.531 -7.853 1.00 0.00 H new ATOM 0 HE21 GLN A 97 -3.437 -17.673 -7.917 1.00 0.00 H new ATOM 0 HE22 GLN A 97 -2.536 -19.171 -8.173 1.00 0.00 H new ATOM 1519 N GLY A 98 -3.804 -13.343 -5.801 1.00 0.00 N ATOM 1520 CA GLY A 98 -4.846 -12.552 -6.417 1.00 0.00 C ATOM 1521 C GLY A 98 -4.719 -11.082 -6.072 1.00 0.00 C ATOM 1522 O GLY A 98 -4.787 -10.221 -6.948 1.00 0.00 O ATOM 0 H GLY A 98 -4.056 -13.765 -4.907 1.00 0.00 H new ATOM 0 HA2 GLY A 98 -4.804 -12.676 -7.499 1.00 0.00 H new ATOM 0 HA3 GLY A 98 -5.820 -12.918 -6.092 1.00 0.00 H new ATOM 1526 N ILE A 99 -4.527 -10.800 -4.793 1.00 0.00 N ATOM 1527 CA ILE A 99 -4.366 -9.433 -4.322 1.00 0.00 C ATOM 1528 C ILE A 99 -2.976 -9.226 -3.725 1.00 0.00 C ATOM 1529 O ILE A 99 -2.726 -9.551 -2.567 1.00 0.00 O ATOM 1530 CB ILE A 99 -5.447 -9.058 -3.285 1.00 0.00 C ATOM 1531 CG1 ILE A 99 -5.591 -10.152 -2.223 1.00 0.00 C ATOM 1532 CG2 ILE A 99 -6.781 -8.816 -3.975 1.00 0.00 C ATOM 1533 CD1 ILE A 99 -6.632 -9.837 -1.173 1.00 0.00 C ATOM 0 H ILE A 99 -4.479 -11.505 -4.058 1.00 0.00 H new ATOM 0 HA ILE A 99 -4.482 -8.777 -5.185 1.00 0.00 H new ATOM 0 HB ILE A 99 -5.135 -8.139 -2.788 1.00 0.00 H new ATOM 0 HG12 ILE A 99 -5.852 -11.091 -2.712 1.00 0.00 H new ATOM 0 HG13 ILE A 99 -4.628 -10.303 -1.735 1.00 0.00 H new ATOM 0 HG21 ILE A 99 -7.533 -8.553 -3.231 1.00 0.00 H new ATOM 0 HG22 ILE A 99 -6.678 -8.001 -4.691 1.00 0.00 H new ATOM 0 HG23 ILE A 99 -7.090 -9.721 -4.498 1.00 0.00 H new ATOM 0 HD11 ILE A 99 -6.681 -10.654 -0.453 1.00 0.00 H new ATOM 0 HD12 ILE A 99 -6.362 -8.915 -0.658 1.00 0.00 H new ATOM 0 HD13 ILE A 99 -7.604 -9.715 -1.650 1.00 0.00 H new ATOM 1648 N ASP A 108 8.263 -10.913 -8.832 1.00 0.00 N ATOM 1649 CA ASP A 108 8.874 -10.415 -7.604 1.00 0.00 C ATOM 1650 C ASP A 108 8.069 -10.852 -6.385 1.00 0.00 C ATOM 1651 O ASP A 108 8.630 -11.129 -5.324 1.00 0.00 O ATOM 1652 CB ASP A 108 8.995 -8.887 -7.641 1.00 0.00 C ATOM 1653 CG ASP A 108 10.197 -8.421 -8.437 1.00 0.00 C ATOM 1654 OD1 ASP A 108 11.337 -8.776 -8.065 1.00 0.00 O ATOM 1655 OD2 ASP A 108 10.007 -7.714 -9.445 1.00 0.00 O ATOM 0 HA ASP A 108 9.875 -10.840 -7.528 1.00 0.00 H new ATOM 0 HB2 ASP A 108 8.089 -8.464 -8.075 1.00 0.00 H new ATOM 0 HB3 ASP A 108 9.068 -8.506 -6.622 1.00 0.00 H new ATOM 1660 N ALA A 109 6.754 -10.928 -6.543 1.00 0.00 N ATOM 1661 CA ALA A 109 5.884 -11.386 -5.467 1.00 0.00 C ATOM 1662 C ALA A 109 6.074 -12.882 -5.227 1.00 0.00 C ATOM 1663 O ALA A 109 6.016 -13.355 -4.094 1.00 0.00 O ATOM 1664 CB ALA A 109 4.429 -11.073 -5.786 1.00 0.00 C ATOM 0 H ALA A 109 6.267 -10.679 -7.404 1.00 0.00 H new ATOM 0 HA ALA A 109 6.155 -10.855 -4.554 1.00 0.00 H new ATOM 0 HB1 ALA A 109 3.795 -11.422 -4.971 1.00 0.00 H new ATOM 0 HB2 ALA A 109 4.306 -9.997 -5.906 1.00 0.00 H new ATOM 0 HB3 ALA A 109 4.143 -11.576 -6.710 1.00 0.00 H new ATOM 1670 N LYS A 110 6.330 -13.614 -6.307 1.00 0.00 N ATOM 1671 CA LYS A 110 6.579 -15.053 -6.235 1.00 0.00 C ATOM 1672 C LYS A 110 8.051 -15.315 -5.913 1.00 0.00 C ATOM 1673 O LYS A 110 8.509 -16.459 -5.887 1.00 0.00 O ATOM 1674 CB LYS A 110 6.221 -15.712 -7.571 1.00 0.00 C ATOM 1675 CG LYS A 110 4.814 -15.398 -8.061 1.00 0.00 C ATOM 1676 CD LYS A 110 4.608 -15.880 -9.487 1.00 0.00 C ATOM 1677 CE LYS A 110 3.265 -15.432 -10.043 1.00 0.00 C ATOM 1678 NZ LYS A 110 3.126 -15.763 -11.487 1.00 0.00 N ATOM 0 H LYS A 110 6.371 -13.231 -7.252 1.00 0.00 H new ATOM 0 HA LYS A 110 5.959 -15.478 -5.446 1.00 0.00 H new ATOM 0 HB2 LYS A 110 6.938 -15.390 -8.326 1.00 0.00 H new ATOM 0 HB3 LYS A 110 6.327 -16.792 -7.471 1.00 0.00 H new ATOM 0 HG2 LYS A 110 4.084 -15.872 -7.405 1.00 0.00 H new ATOM 0 HG3 LYS A 110 4.639 -14.323 -8.009 1.00 0.00 H new ATOM 0 HD2 LYS A 110 5.409 -15.498 -10.120 1.00 0.00 H new ATOM 0 HD3 LYS A 110 4.669 -16.968 -9.516 1.00 0.00 H new ATOM 0 HE2 LYS A 110 2.462 -15.910 -9.482 1.00 0.00 H new ATOM 0 HE3 LYS A 110 3.155 -14.356 -9.904 1.00 0.00 H new ATOM 0 HZ1 LYS A 110 2.198 -15.442 -11.829 1.00 0.00 H new ATOM 0 HZ2 LYS A 110 3.877 -15.287 -12.026 1.00 0.00 H new ATOM 0 HZ3 LYS A 110 3.206 -16.792 -11.617 1.00 0.00 H new ATOM 1692 N LYS A 111 8.779 -14.238 -5.676 1.00 0.00 N ATOM 1693 CA LYS A 111 10.211 -14.297 -5.436 1.00 0.00 C ATOM 1694 C LYS A 111 10.517 -14.168 -3.949 1.00 0.00 C ATOM 1695 O LYS A 111 11.400 -14.846 -3.418 1.00 0.00 O ATOM 1696 CB LYS A 111 10.884 -13.160 -6.206 1.00 0.00 C ATOM 1697 CG LYS A 111 12.375 -13.019 -5.975 1.00 0.00 C ATOM 1698 CD LYS A 111 12.922 -11.827 -6.741 1.00 0.00 C ATOM 1699 CE LYS A 111 12.636 -11.946 -8.230 1.00 0.00 C ATOM 1700 NZ LYS A 111 12.922 -10.686 -8.965 1.00 0.00 N ATOM 0 H LYS A 111 8.393 -13.294 -5.644 1.00 0.00 H new ATOM 0 HA LYS A 111 10.593 -15.260 -5.776 1.00 0.00 H new ATOM 0 HB2 LYS A 111 10.710 -13.311 -7.271 1.00 0.00 H new ATOM 0 HB3 LYS A 111 10.400 -12.222 -5.934 1.00 0.00 H new ATOM 0 HG2 LYS A 111 12.574 -12.897 -4.910 1.00 0.00 H new ATOM 0 HG3 LYS A 111 12.886 -13.928 -6.292 1.00 0.00 H new ATOM 0 HD2 LYS A 111 12.477 -10.910 -6.356 1.00 0.00 H new ATOM 0 HD3 LYS A 111 13.997 -11.752 -6.580 1.00 0.00 H new ATOM 0 HE2 LYS A 111 13.238 -12.752 -8.649 1.00 0.00 H new ATOM 0 HE3 LYS A 111 11.591 -12.219 -8.376 1.00 0.00 H new ATOM 0 HZ1 LYS A 111 13.176 -10.908 -9.949 1.00 0.00 H new ATOM 0 HZ2 LYS A 111 12.078 -10.079 -8.954 1.00 0.00 H new ATOM 0 HZ3 LYS A 111 13.712 -10.189 -8.507 1.00 0.00 H new ATOM 1714 N GLY A 112 9.775 -13.300 -3.287 1.00 0.00 N ATOM 1715 CA GLY A 112 10.050 -12.983 -1.904 1.00 0.00 C ATOM 1716 C GLY A 112 10.395 -11.521 -1.754 1.00 0.00 C ATOM 1717 O GLY A 112 11.463 -11.081 -2.181 1.00 0.00 O ATOM 0 H GLY A 112 8.979 -12.804 -3.687 1.00 0.00 H new ATOM 0 HA2 GLY A 112 9.181 -13.222 -1.290 1.00 0.00 H new ATOM 0 HA3 GLY A 112 10.875 -13.596 -1.542 1.00 0.00 H new ATOM 1721 N ILE A 113 9.485 -10.767 -1.168 1.00 0.00 N ATOM 1722 CA ILE A 113 9.620 -9.323 -1.109 1.00 0.00 C ATOM 1723 C ILE A 113 10.661 -8.891 -0.081 1.00 0.00 C ATOM 1724 O ILE A 113 10.488 -9.073 1.125 1.00 0.00 O ATOM 1725 CB ILE A 113 8.267 -8.650 -0.807 1.00 0.00 C ATOM 1726 CG1 ILE A 113 7.267 -8.953 -1.931 1.00 0.00 C ATOM 1727 CG2 ILE A 113 8.438 -7.147 -0.625 1.00 0.00 C ATOM 1728 CD1 ILE A 113 7.763 -8.564 -3.313 1.00 0.00 C ATOM 0 H ILE A 113 8.642 -11.131 -0.725 1.00 0.00 H new ATOM 0 HA ILE A 113 9.962 -8.997 -2.091 1.00 0.00 H new ATOM 0 HB ILE A 113 7.876 -9.056 0.126 1.00 0.00 H new ATOM 0 HG12 ILE A 113 7.038 -10.019 -1.924 1.00 0.00 H new ATOM 0 HG13 ILE A 113 6.335 -8.426 -1.728 1.00 0.00 H new ATOM 0 HG21 ILE A 113 7.470 -6.694 -0.413 1.00 0.00 H new ATOM 0 HG22 ILE A 113 9.118 -6.956 0.205 1.00 0.00 H new ATOM 0 HG23 ILE A 113 8.849 -6.714 -1.537 1.00 0.00 H new ATOM 0 HD11 ILE A 113 7.003 -8.808 -4.055 1.00 0.00 H new ATOM 0 HD12 ILE A 113 7.964 -7.493 -3.339 1.00 0.00 H new ATOM 0 HD13 ILE A 113 8.678 -9.111 -3.538 1.00 0.00 H new ATOM 1740 N THR A 114 11.752 -8.335 -0.583 1.00 0.00 N ATOM 1741 CA THR A 114 12.784 -7.759 0.257 1.00 0.00 C ATOM 1742 C THR A 114 12.723 -6.240 0.151 1.00 0.00 C ATOM 1743 O THR A 114 11.983 -5.703 -0.677 1.00 0.00 O ATOM 1744 CB THR A 114 14.183 -8.239 -0.175 1.00 0.00 C ATOM 1745 OG1 THR A 114 14.472 -7.763 -1.496 1.00 0.00 O ATOM 1746 CG2 THR A 114 14.271 -9.759 -0.154 1.00 0.00 C ATOM 0 H THR A 114 11.945 -8.271 -1.583 1.00 0.00 H new ATOM 0 HA THR A 114 12.611 -8.078 1.285 1.00 0.00 H new ATOM 0 HB THR A 114 14.912 -7.840 0.530 1.00 0.00 H new ATOM 0 HG1 THR A 114 14.167 -8.421 -2.155 1.00 0.00 H new ATOM 0 HG21 THR A 114 15.269 -10.070 -0.463 1.00 0.00 H new ATOM 0 HG22 THR A 114 14.075 -10.121 0.855 1.00 0.00 H new ATOM 0 HG23 THR A 114 13.533 -10.176 -0.839 1.00 0.00 H new ATOM 1754 N MET A 115 13.491 -5.539 0.972 1.00 0.00 N ATOM 1755 CA MET A 115 13.560 -4.094 0.852 1.00 0.00 C ATOM 1756 C MET A 115 14.424 -3.723 -0.343 1.00 0.00 C ATOM 1757 O MET A 115 14.193 -2.706 -0.995 1.00 0.00 O ATOM 1758 CB MET A 115 14.105 -3.443 2.121 1.00 0.00 C ATOM 1759 CG MET A 115 13.934 -1.934 2.109 1.00 0.00 C ATOM 1760 SD MET A 115 12.204 -1.463 1.904 1.00 0.00 S ATOM 1761 CE MET A 115 12.358 0.282 1.554 1.00 0.00 C ATOM 0 H MET A 115 14.064 -5.939 1.714 1.00 0.00 H new ATOM 0 HA MET A 115 12.547 -3.719 0.704 1.00 0.00 H new ATOM 0 HB2 MET A 115 13.593 -3.858 2.989 1.00 0.00 H new ATOM 0 HB3 MET A 115 15.162 -3.687 2.227 1.00 0.00 H new ATOM 0 HG2 MET A 115 14.317 -1.516 3.040 1.00 0.00 H new ATOM 0 HG3 MET A 115 14.526 -1.507 1.300 1.00 0.00 H new ATOM 0 HE1 MET A 115 11.437 0.792 1.836 1.00 0.00 H new ATOM 0 HE2 MET A 115 13.190 0.695 2.123 1.00 0.00 H new ATOM 0 HE3 MET A 115 12.541 0.425 0.489 1.00 0.00 H new ATOM 1771 N ALA A 116 15.410 -4.570 -0.632 1.00 0.00 N ATOM 1772 CA ALA A 116 16.243 -4.400 -1.815 1.00 0.00 C ATOM 1773 C ALA A 116 15.376 -4.445 -3.066 1.00 0.00 C ATOM 1774 O ALA A 116 15.591 -3.690 -4.015 1.00 0.00 O ATOM 1775 CB ALA A 116 17.320 -5.473 -1.868 1.00 0.00 C ATOM 0 H ALA A 116 15.650 -5.381 -0.061 1.00 0.00 H new ATOM 0 HA ALA A 116 16.737 -3.430 -1.764 1.00 0.00 H new ATOM 0 HB1 ALA A 116 17.932 -5.330 -2.758 1.00 0.00 H new ATOM 0 HB2 ALA A 116 17.948 -5.402 -0.980 1.00 0.00 H new ATOM 0 HB3 ALA A 116 16.852 -6.457 -1.904 1.00 0.00 H new ATOM 1781 N GLN A 117 14.397 -5.346 -3.049 1.00 0.00 N ATOM 1782 CA GLN A 117 13.367 -5.393 -4.076 1.00 0.00 C ATOM 1783 C GLN A 117 12.665 -4.057 -4.153 1.00 0.00 C ATOM 1784 O GLN A 117 12.787 -3.364 -5.143 1.00 0.00 O ATOM 1785 CB GLN A 117 12.353 -6.497 -3.762 1.00 0.00 C ATOM 1786 CG GLN A 117 12.165 -7.497 -4.889 1.00 0.00 C ATOM 1787 CD GLN A 117 13.439 -8.246 -5.221 1.00 0.00 C ATOM 1788 OE1 GLN A 117 14.289 -8.475 -4.357 1.00 0.00 O ATOM 1789 NE2 GLN A 117 13.573 -8.645 -6.472 1.00 0.00 N ATOM 0 H GLN A 117 14.298 -6.059 -2.326 1.00 0.00 H new ATOM 0 HA GLN A 117 13.835 -5.611 -5.036 1.00 0.00 H new ATOM 0 HB2 GLN A 117 12.675 -7.029 -2.867 1.00 0.00 H new ATOM 0 HB3 GLN A 117 11.391 -6.039 -3.531 1.00 0.00 H new ATOM 0 HG2 GLN A 117 11.390 -8.211 -4.611 1.00 0.00 H new ATOM 0 HG3 GLN A 117 11.813 -6.975 -5.778 1.00 0.00 H new ATOM 0 HE21 GLN A 117 12.846 -8.434 -7.155 1.00 0.00 H new ATOM 0 HE22 GLN A 117 14.404 -9.164 -6.756 1.00 0.00 H new ATOM 1798 N MET A 118 11.976 -3.682 -3.086 1.00 0.00 N ATOM 1799 CA MET A 118 11.194 -2.450 -3.070 1.00 0.00 C ATOM 1800 C MET A 118 11.995 -1.230 -3.523 1.00 0.00 C ATOM 1801 O MET A 118 11.517 -0.472 -4.347 1.00 0.00 O ATOM 1802 CB MET A 118 10.582 -2.211 -1.690 1.00 0.00 C ATOM 1803 CG MET A 118 9.435 -3.155 -1.390 1.00 0.00 C ATOM 1804 SD MET A 118 8.213 -3.172 -2.717 1.00 0.00 S ATOM 1805 CE MET A 118 7.027 -4.354 -2.089 1.00 0.00 C ATOM 0 H MET A 118 11.941 -4.213 -2.216 1.00 0.00 H new ATOM 0 HA MET A 118 10.391 -2.584 -3.795 1.00 0.00 H new ATOM 0 HB2 MET A 118 11.353 -2.329 -0.929 1.00 0.00 H new ATOM 0 HB3 MET A 118 10.227 -1.182 -1.627 1.00 0.00 H new ATOM 0 HG2 MET A 118 9.823 -4.163 -1.241 1.00 0.00 H new ATOM 0 HG3 MET A 118 8.955 -2.858 -0.458 1.00 0.00 H new ATOM 0 HE1 MET A 118 6.019 -4.036 -2.356 1.00 0.00 H new ATOM 0 HE2 MET A 118 7.225 -5.334 -2.523 1.00 0.00 H new ATOM 0 HE3 MET A 118 7.113 -4.414 -1.004 1.00 0.00 H new ATOM 1815 N GLU A 119 13.208 -1.049 -3.015 1.00 0.00 N ATOM 1816 CA GLU A 119 14.038 0.095 -3.413 1.00 0.00 C ATOM 1817 C GLU A 119 14.219 0.151 -4.938 1.00 0.00 C ATOM 1818 O GLU A 119 13.827 1.123 -5.594 1.00 0.00 O ATOM 1819 CB GLU A 119 15.407 0.026 -2.726 1.00 0.00 C ATOM 1820 CG GLU A 119 15.366 0.298 -1.228 1.00 0.00 C ATOM 1821 CD GLU A 119 15.017 1.738 -0.897 1.00 0.00 C ATOM 1822 OE1 GLU A 119 15.218 2.616 -1.761 1.00 0.00 O ATOM 1823 OE2 GLU A 119 14.552 2.000 0.234 1.00 0.00 O ATOM 0 H GLU A 119 13.641 -1.671 -2.332 1.00 0.00 H new ATOM 0 HA GLU A 119 13.524 1.003 -3.098 1.00 0.00 H new ATOM 0 HB2 GLU A 119 15.836 -0.962 -2.893 1.00 0.00 H new ATOM 0 HB3 GLU A 119 16.075 0.747 -3.197 1.00 0.00 H new ATOM 0 HG2 GLU A 119 14.634 -0.363 -0.764 1.00 0.00 H new ATOM 0 HG3 GLU A 119 16.336 0.056 -0.793 1.00 0.00 H new ATOM 1830 N LEU A 120 14.781 -0.916 -5.494 1.00 0.00 N ATOM 1831 CA LEU A 120 15.060 -0.997 -6.928 1.00 0.00 C ATOM 1832 C LEU A 120 13.771 -1.002 -7.751 1.00 0.00 C ATOM 1833 O LEU A 120 13.703 -0.435 -8.844 1.00 0.00 O ATOM 1834 CB LEU A 120 15.860 -2.271 -7.218 1.00 0.00 C ATOM 1835 CG LEU A 120 17.280 -2.294 -6.646 1.00 0.00 C ATOM 1836 CD1 LEU A 120 17.960 -3.617 -6.965 1.00 0.00 C ATOM 1837 CD2 LEU A 120 18.093 -1.130 -7.192 1.00 0.00 C ATOM 0 H LEU A 120 15.056 -1.746 -4.969 1.00 0.00 H new ATOM 0 HA LEU A 120 15.637 -0.117 -7.213 1.00 0.00 H new ATOM 0 HB2 LEU A 120 15.311 -3.124 -6.819 1.00 0.00 H new ATOM 0 HB3 LEU A 120 15.918 -2.406 -8.298 1.00 0.00 H new ATOM 0 HG LEU A 120 17.218 -2.191 -5.563 1.00 0.00 H new ATOM 0 HD11 LEU A 120 18.968 -3.617 -6.551 1.00 0.00 H new ATOM 0 HD12 LEU A 120 17.388 -4.435 -6.527 1.00 0.00 H new ATOM 0 HD13 LEU A 120 18.011 -3.748 -8.046 1.00 0.00 H new ATOM 0 HD21 LEU A 120 19.100 -1.162 -6.775 1.00 0.00 H new ATOM 0 HD22 LEU A 120 18.148 -1.202 -8.278 1.00 0.00 H new ATOM 0 HD23 LEU A 120 17.615 -0.191 -6.915 1.00 0.00 H new ATOM 1849 N VAL A 121 12.758 -1.632 -7.195 1.00 0.00 N ATOM 1850 CA VAL A 121 11.485 -1.849 -7.861 1.00 0.00 C ATOM 1851 C VAL A 121 10.633 -0.573 -7.879 1.00 0.00 C ATOM 1852 O VAL A 121 9.904 -0.318 -8.842 1.00 0.00 O ATOM 1853 CB VAL A 121 10.753 -3.030 -7.173 1.00 0.00 C ATOM 1854 CG1 VAL A 121 9.260 -3.011 -7.388 1.00 0.00 C ATOM 1855 CG2 VAL A 121 11.321 -4.357 -7.660 1.00 0.00 C ATOM 0 H VAL A 121 12.794 -2.016 -6.251 1.00 0.00 H new ATOM 0 HA VAL A 121 11.662 -2.106 -8.905 1.00 0.00 H new ATOM 0 HB VAL A 121 10.924 -2.916 -6.103 1.00 0.00 H new ATOM 0 HG11 VAL A 121 8.808 -3.864 -6.881 1.00 0.00 H new ATOM 0 HG12 VAL A 121 8.846 -2.087 -6.984 1.00 0.00 H new ATOM 0 HG13 VAL A 121 9.045 -3.068 -8.455 1.00 0.00 H new ATOM 0 HG21 VAL A 121 10.799 -5.178 -7.169 1.00 0.00 H new ATOM 0 HG22 VAL A 121 11.188 -4.435 -8.739 1.00 0.00 H new ATOM 0 HG23 VAL A 121 12.383 -4.408 -7.420 1.00 0.00 H new ATOM 1865 N MET A 122 10.747 0.245 -6.836 1.00 0.00 N ATOM 1866 CA MET A 122 10.074 1.544 -6.813 1.00 0.00 C ATOM 1867 C MET A 122 10.690 2.440 -7.874 1.00 0.00 C ATOM 1868 O MET A 122 9.989 3.171 -8.578 1.00 0.00 O ATOM 1869 CB MET A 122 10.189 2.233 -5.442 1.00 0.00 C ATOM 1870 CG MET A 122 9.490 1.525 -4.282 1.00 0.00 C ATOM 1871 SD MET A 122 7.720 1.271 -4.531 1.00 0.00 S ATOM 1872 CE MET A 122 7.700 -0.318 -5.359 1.00 0.00 C ATOM 0 H MET A 122 11.294 0.035 -6.001 1.00 0.00 H new ATOM 0 HA MET A 122 9.016 1.375 -7.012 1.00 0.00 H new ATOM 0 HB2 MET A 122 11.246 2.337 -5.196 1.00 0.00 H new ATOM 0 HB3 MET A 122 9.781 3.240 -5.527 1.00 0.00 H new ATOM 0 HG2 MET A 122 9.966 0.558 -4.122 1.00 0.00 H new ATOM 0 HG3 MET A 122 9.638 2.108 -3.373 1.00 0.00 H new ATOM 0 HE1 MET A 122 6.940 -0.955 -4.906 1.00 0.00 H new ATOM 0 HE2 MET A 122 7.471 -0.175 -6.415 1.00 0.00 H new ATOM 0 HE3 MET A 122 8.677 -0.792 -5.260 1.00 0.00 H new ATOM 1882 N LYS A 123 12.013 2.361 -7.986 1.00 0.00 N ATOM 1883 CA LYS A 123 12.753 3.134 -8.976 1.00 0.00 C ATOM 1884 C LYS A 123 12.393 2.690 -10.396 1.00 0.00 C ATOM 1885 O LYS A 123 12.415 3.491 -11.333 1.00 0.00 O ATOM 1886 CB LYS A 123 14.259 2.980 -8.727 1.00 0.00 C ATOM 1887 CG LYS A 123 15.131 3.792 -9.670 1.00 0.00 C ATOM 1888 CD LYS A 123 16.601 3.713 -9.282 1.00 0.00 C ATOM 1889 CE LYS A 123 16.847 4.315 -7.907 1.00 0.00 C ATOM 1890 NZ LYS A 123 18.293 4.351 -7.561 1.00 0.00 N ATOM 0 H LYS A 123 12.597 1.765 -7.399 1.00 0.00 H new ATOM 0 HA LYS A 123 12.480 4.185 -8.878 1.00 0.00 H new ATOM 0 HB2 LYS A 123 14.479 3.276 -7.701 1.00 0.00 H new ATOM 0 HB3 LYS A 123 14.526 1.927 -8.819 1.00 0.00 H new ATOM 0 HG2 LYS A 123 15.003 3.428 -10.689 1.00 0.00 H new ATOM 0 HG3 LYS A 123 14.807 4.833 -9.661 1.00 0.00 H new ATOM 0 HD2 LYS A 123 16.925 2.672 -9.288 1.00 0.00 H new ATOM 0 HD3 LYS A 123 17.203 4.238 -10.023 1.00 0.00 H new ATOM 0 HE2 LYS A 123 16.443 5.327 -7.877 1.00 0.00 H new ATOM 0 HE3 LYS A 123 16.310 3.735 -7.157 1.00 0.00 H new ATOM 0 HZ1 LYS A 123 18.414 4.769 -6.616 1.00 0.00 H new ATOM 0 HZ2 LYS A 123 18.675 3.384 -7.563 1.00 0.00 H new ATOM 0 HZ3 LYS A 123 18.803 4.926 -8.261 1.00 0.00 H new ATOM 1904 N ALA A 124 12.049 1.414 -10.544 1.00 0.00 N ATOM 1905 CA ALA A 124 11.683 0.858 -11.842 1.00 0.00 C ATOM 1906 C ALA A 124 10.378 1.459 -12.360 1.00 0.00 C ATOM 1907 O ALA A 124 10.316 1.953 -13.486 1.00 0.00 O ATOM 1908 CB ALA A 124 11.569 -0.657 -11.750 1.00 0.00 C ATOM 0 H ALA A 124 12.016 0.743 -9.777 1.00 0.00 H new ATOM 0 HA ALA A 124 12.470 1.114 -12.551 1.00 0.00 H new ATOM 0 HB1 ALA A 124 11.295 -1.061 -12.725 1.00 0.00 H new ATOM 0 HB2 ALA A 124 12.526 -1.076 -11.439 1.00 0.00 H new ATOM 0 HB3 ALA A 124 10.804 -0.921 -11.020 1.00 0.00 H new ATOM 1914 N ALA A 125 9.338 1.429 -11.533 1.00 0.00 N ATOM 1915 CA ALA A 125 8.035 1.955 -11.931 1.00 0.00 C ATOM 1916 C ALA A 125 8.011 3.478 -11.860 1.00 0.00 C ATOM 1917 O ALA A 125 7.087 4.120 -12.362 1.00 0.00 O ATOM 1918 CB ALA A 125 6.934 1.369 -11.061 1.00 0.00 C ATOM 0 H ALA A 125 9.370 1.048 -10.587 1.00 0.00 H new ATOM 0 HA ALA A 125 7.858 1.661 -12.966 1.00 0.00 H new ATOM 0 HB1 ALA A 125 5.971 1.773 -11.372 1.00 0.00 H new ATOM 0 HB2 ALA A 125 6.925 0.284 -11.168 1.00 0.00 H new ATOM 0 HB3 ALA A 125 7.117 1.630 -10.018 1.00 0.00 H new ATOM 1924 N GLY A 126 9.028 4.051 -11.236 1.00 0.00 N ATOM 1925 CA GLY A 126 9.113 5.491 -11.128 1.00 0.00 C ATOM 1926 C GLY A 126 8.189 6.035 -10.061 1.00 0.00 C ATOM 1927 O GLY A 126 7.494 7.029 -10.276 1.00 0.00 O ATOM 0 H GLY A 126 9.798 3.543 -10.801 1.00 0.00 H new ATOM 0 HA2 GLY A 126 10.139 5.777 -10.899 1.00 0.00 H new ATOM 0 HA3 GLY A 126 8.863 5.942 -12.088 1.00 0.00 H new ATOM 1931 N PHE A 127 8.167 5.372 -8.915 1.00 0.00 N ATOM 1932 CA PHE A 127 7.346 5.806 -7.797 1.00 0.00 C ATOM 1933 C PHE A 127 8.035 6.928 -7.032 1.00 0.00 C ATOM 1934 O PHE A 127 9.264 7.013 -7.009 1.00 0.00 O ATOM 1935 CB PHE A 127 7.049 4.636 -6.858 1.00 0.00 C ATOM 1936 CG PHE A 127 6.097 3.620 -7.429 1.00 0.00 C ATOM 1937 CD1 PHE A 127 4.885 4.014 -7.977 1.00 0.00 C ATOM 1938 CD2 PHE A 127 6.405 2.271 -7.403 1.00 0.00 C ATOM 1939 CE1 PHE A 127 4.003 3.082 -8.490 1.00 0.00 C ATOM 1940 CE2 PHE A 127 5.526 1.334 -7.911 1.00 0.00 C ATOM 1941 CZ PHE A 127 4.323 1.740 -8.455 1.00 0.00 C ATOM 0 H PHE A 127 8.711 4.528 -8.735 1.00 0.00 H new ATOM 0 HA PHE A 127 6.403 6.181 -8.195 1.00 0.00 H new ATOM 0 HB2 PHE A 127 7.986 4.139 -6.605 1.00 0.00 H new ATOM 0 HB3 PHE A 127 6.634 5.026 -5.928 1.00 0.00 H new ATOM 0 HD1 PHE A 127 4.627 5.063 -8.003 1.00 0.00 H new ATOM 0 HD2 PHE A 127 7.344 1.947 -6.980 1.00 0.00 H new ATOM 0 HE1 PHE A 127 3.065 3.403 -8.918 1.00 0.00 H new ATOM 0 HE2 PHE A 127 5.779 0.285 -7.883 1.00 0.00 H new ATOM 0 HZ PHE A 127 3.634 1.009 -8.852 1.00 0.00 H new ATOM 1951 N LYS A 128 7.239 7.787 -6.414 1.00 0.00 N ATOM 1952 CA LYS A 128 7.769 8.935 -5.690 1.00 0.00 C ATOM 1953 C LYS A 128 7.934 8.605 -4.212 1.00 0.00 C ATOM 1954 O LYS A 128 6.949 8.425 -3.494 1.00 0.00 O ATOM 1955 CB LYS A 128 6.837 10.136 -5.866 1.00 0.00 C ATOM 1956 CG LYS A 128 6.545 10.455 -7.323 1.00 0.00 C ATOM 1957 CD LYS A 128 5.647 11.672 -7.478 1.00 0.00 C ATOM 1958 CE LYS A 128 4.269 11.444 -6.878 1.00 0.00 C ATOM 1959 NZ LYS A 128 3.347 12.581 -7.146 1.00 0.00 N ATOM 0 H LYS A 128 6.222 7.712 -6.399 1.00 0.00 H new ATOM 0 HA LYS A 128 8.749 9.184 -6.096 1.00 0.00 H new ATOM 0 HB2 LYS A 128 5.898 9.939 -5.348 1.00 0.00 H new ATOM 0 HB3 LYS A 128 7.285 11.009 -5.392 1.00 0.00 H new ATOM 0 HG2 LYS A 128 7.483 10.629 -7.850 1.00 0.00 H new ATOM 0 HG3 LYS A 128 6.070 9.594 -7.793 1.00 0.00 H new ATOM 0 HD2 LYS A 128 6.114 12.531 -6.996 1.00 0.00 H new ATOM 0 HD3 LYS A 128 5.546 11.916 -8.536 1.00 0.00 H new ATOM 0 HE2 LYS A 128 3.843 10.528 -7.287 1.00 0.00 H new ATOM 0 HE3 LYS A 128 4.362 11.299 -5.802 1.00 0.00 H new ATOM 0 HZ1 LYS A 128 2.414 12.376 -6.734 1.00 0.00 H new ATOM 0 HZ2 LYS A 128 3.731 13.448 -6.719 1.00 0.00 H new ATOM 0 HZ3 LYS A 128 3.250 12.715 -8.173 1.00 0.00 H new ATOM 1973 N GLU A 129 9.182 8.527 -3.769 1.00 0.00 N ATOM 1974 CA GLU A 129 9.492 8.171 -2.393 1.00 0.00 C ATOM 1975 C GLU A 129 9.140 9.315 -1.451 1.00 0.00 C ATOM 1976 O GLU A 129 9.442 10.481 -1.723 1.00 0.00 O ATOM 1977 CB GLU A 129 10.974 7.796 -2.262 1.00 0.00 C ATOM 1978 CG GLU A 129 11.395 7.418 -0.848 1.00 0.00 C ATOM 1979 CD GLU A 129 12.269 8.471 -0.195 1.00 0.00 C ATOM 1980 OE1 GLU A 129 11.728 9.449 0.363 1.00 0.00 O ATOM 1981 OE2 GLU A 129 13.510 8.322 -0.239 1.00 0.00 O ATOM 0 H GLU A 129 10.001 8.707 -4.349 1.00 0.00 H new ATOM 0 HA GLU A 129 8.891 7.305 -2.114 1.00 0.00 H new ATOM 0 HB2 GLU A 129 11.187 6.961 -2.929 1.00 0.00 H new ATOM 0 HB3 GLU A 129 11.582 8.636 -2.599 1.00 0.00 H new ATOM 0 HG2 GLU A 129 10.505 7.262 -0.238 1.00 0.00 H new ATOM 0 HG3 GLU A 129 11.934 6.471 -0.875 1.00 0.00 H new ATOM 1988 N VAL A 130 8.486 8.969 -0.355 1.00 0.00 N ATOM 1989 CA VAL A 130 8.066 9.932 0.643 1.00 0.00 C ATOM 1990 C VAL A 130 8.425 9.429 2.047 1.00 0.00 C ATOM 1991 O VAL A 130 7.585 8.873 2.757 1.00 0.00 O ATOM 1992 CB VAL A 130 6.538 10.221 0.540 1.00 0.00 C ATOM 1993 CG1 VAL A 130 6.069 11.143 1.655 1.00 0.00 C ATOM 1994 CG2 VAL A 130 6.204 10.818 -0.813 1.00 0.00 C ATOM 0 H VAL A 130 8.231 8.006 -0.133 1.00 0.00 H new ATOM 0 HA VAL A 130 8.595 10.867 0.457 1.00 0.00 H new ATOM 0 HB VAL A 130 6.012 9.273 0.649 1.00 0.00 H new ATOM 0 HG11 VAL A 130 4.999 11.323 1.552 1.00 0.00 H new ATOM 0 HG12 VAL A 130 6.267 10.677 2.620 1.00 0.00 H new ATOM 0 HG13 VAL A 130 6.604 12.091 1.593 1.00 0.00 H new ATOM 0 HG21 VAL A 130 5.133 11.014 -0.870 1.00 0.00 H new ATOM 0 HG22 VAL A 130 6.752 11.751 -0.944 1.00 0.00 H new ATOM 0 HG23 VAL A 130 6.487 10.118 -1.599 1.00 0.00 H new ATOM 2004 N LYS A 131 9.695 9.563 2.420 1.00 0.00 N ATOM 2005 CA LYS A 131 10.114 9.220 3.775 1.00 0.00 C ATOM 2006 C LYS A 131 9.439 10.137 4.780 1.00 0.00 C ATOM 2007 O LYS A 131 9.176 11.309 4.493 1.00 0.00 O ATOM 2008 CB LYS A 131 11.634 9.296 3.948 1.00 0.00 C ATOM 2009 CG LYS A 131 12.392 8.162 3.277 1.00 0.00 C ATOM 2010 CD LYS A 131 13.847 8.115 3.725 1.00 0.00 C ATOM 2011 CE LYS A 131 13.972 7.719 5.190 1.00 0.00 C ATOM 2012 NZ LYS A 131 15.389 7.686 5.642 1.00 0.00 N ATOM 0 H LYS A 131 10.442 9.901 1.813 1.00 0.00 H new ATOM 0 HA LYS A 131 9.811 8.188 3.954 1.00 0.00 H new ATOM 0 HB2 LYS A 131 11.988 10.244 3.544 1.00 0.00 H new ATOM 0 HB3 LYS A 131 11.868 9.296 5.013 1.00 0.00 H new ATOM 0 HG2 LYS A 131 11.909 7.213 3.510 1.00 0.00 H new ATOM 0 HG3 LYS A 131 12.348 8.285 2.195 1.00 0.00 H new ATOM 0 HD2 LYS A 131 14.395 7.403 3.108 1.00 0.00 H new ATOM 0 HD3 LYS A 131 14.307 9.091 3.571 1.00 0.00 H new ATOM 0 HE2 LYS A 131 13.412 8.424 5.805 1.00 0.00 H new ATOM 0 HE3 LYS A 131 13.521 6.738 5.340 1.00 0.00 H new ATOM 0 HZ1 LYS A 131 15.427 7.412 6.645 1.00 0.00 H new ATOM 0 HZ2 LYS A 131 15.919 6.995 5.074 1.00 0.00 H new ATOM 0 HZ3 LYS A 131 15.813 8.628 5.524 1.00 0.00 H new