USER MOD reduce.3.24.130724 H: found=0, std=0, add=1117, rem=0, adj=29 USER MOD reduce.3.24.130724 removed 1118 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 122 LYS NZ :NH3+ 148:sc= -4.13! (180deg=-3.49!) USER MOD Set 1.2: A 126 ASN : amide:sc= -3.04 K(o=-7.2,f=-8.4!) USER MOD Set 2.1: A 21 GLN : amide:sc= -2.33! C(o=-2.2!,f=-6.2!) USER MOD Set 2.2: A 25 TYR OH : rot 98:sc= 0.0932 USER MOD Set 3.1: A 19 THR OG1 : rot 84:sc= -4.88! USER MOD Set 3.2: A 32 GLN : amide:sc= -16.6! C(o=-21!,f=-18!) USER MOD Single : A 8 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 12 THR OG1 : rot 180:sc= -0.55 USER MOD Single : A 13 SER OG : rot 62:sc= -1.06 USER MOD Single : A 26 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 27 ASN : amide:sc= -0.8 K(o=-0.8,f=-3!) USER MOD Single : A 28 LYS NZ :NH3+ 179:sc= -1.43 (180deg=-1.46) USER MOD Single : A 29 LYS NZ :NH3+ 157:sc= 0 (180deg=-0.000934) USER MOD Single : A 31 MET CE :methyl -158:sc= -1.99 (180deg=-2.85!) USER MOD Single : A 34 THR OG1 : rot 180:sc= 0 USER MOD Single : A 38 CYS SG : rot 56:sc= 0.182! USER MOD Single : A 45 SER OG : rot 83:sc= 0.877 USER MOD Single : A 49 SER OG : rot 180:sc= -0.349! USER MOD Single : A 50 SER OG : rot -150:sc= -0.72! USER MOD Single : A 53 LYS NZ :NH3+ -118:sc= -9.55! (180deg=-10.4!) USER MOD Single : A 54 GLN : amide:sc= -7.76! C(o=-7.8!,f=-3.9!) USER MOD Single : A 55 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 56 MET CE :methyl -140:sc= -2.2 (180deg=-7.98!) USER MOD Single : A 62 SER OG : rot -13:sc= -1.56! USER MOD Single : A 63 SER OG : rot 166:sc= -5.8! USER MOD Single : A 67 LYS NZ :NH3+ -158:sc= -6.31! (180deg=-8.58!) USER MOD Single : A 71 THR OG1 : rot -150:sc= -3.73! USER MOD Single : A 79 ASN : amide:sc= -5.46! C(o=-5.5!,f=-9.1!) USER MOD Single : A 80 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 83 THR OG1 : rot 180:sc= 0 USER MOD Single : A 84 SER OG : rot 60:sc= -1.38! USER MOD Single : A 93 LYS NZ :NH3+ 167:sc= -14.8! (180deg=-16.5!) USER MOD Single : A 96 THR OG1 : rot -90:sc= -0.999! USER MOD Single : A 97 MET CE :methyl -126:sc= -0.472 (180deg=-4.37!) USER MOD Single : A 98 LYS NZ :NH3+ -123:sc= -1.57! (180deg=-2.24!) USER MOD Single : A 99 TYR OH : rot -149:sc= -1.8 USER MOD Single : A 104 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 106 GLN : amide:sc= -1.28 X(o=-1.3,f=-1.4!) USER MOD Single : A 111 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 123 SER OG : rot 180:sc= 0.0986 USER MOD Single : A 132 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 133 SER OG : rot -10:sc= 0.294 USER MOD Single : A 141 SER OG : rot 92:sc= 0.463! USER MOD ----------------------------------------------------------------- ATOM 105 N VAL A 7 113.841 3.770 -14.223 1.00 0.00 N ATOM 106 CA VAL A 7 113.971 5.029 -13.439 1.00 0.00 C ATOM 107 C VAL A 7 115.442 5.399 -13.279 1.00 0.00 C ATOM 108 O VAL A 7 115.819 6.547 -13.403 1.00 0.00 O ATOM 109 CB VAL A 7 113.358 4.825 -12.052 1.00 0.00 C ATOM 110 CG1 VAL A 7 111.996 4.148 -12.189 1.00 0.00 C ATOM 111 CG2 VAL A 7 114.280 3.942 -11.210 1.00 0.00 C ATOM 0 HA VAL A 7 113.453 5.830 -13.966 1.00 0.00 H new ATOM 0 HB VAL A 7 113.236 5.793 -11.566 1.00 0.00 H new ATOM 0 HG11 VAL A 7 111.561 4.003 -11.200 1.00 0.00 H new ATOM 0 HG12 VAL A 7 111.336 4.776 -12.788 1.00 0.00 H new ATOM 0 HG13 VAL A 7 112.118 3.181 -12.677 1.00 0.00 H new ATOM 0 HG21 VAL A 7 113.843 3.797 -10.222 1.00 0.00 H new ATOM 0 HG22 VAL A 7 114.403 2.975 -11.698 1.00 0.00 H new ATOM 0 HG23 VAL A 7 115.253 4.424 -11.109 1.00 0.00 H new ATOM 121 N LYS A 8 116.275 4.444 -12.976 1.00 0.00 N ATOM 122 CA LYS A 8 117.713 4.764 -12.778 1.00 0.00 C ATOM 123 C LYS A 8 117.817 5.804 -11.662 1.00 0.00 C ATOM 124 O LYS A 8 118.892 6.198 -11.256 1.00 0.00 O ATOM 125 CB LYS A 8 118.301 5.333 -14.070 1.00 0.00 C ATOM 126 CG LYS A 8 117.756 4.552 -15.267 1.00 0.00 C ATOM 127 CD LYS A 8 118.512 4.964 -16.532 1.00 0.00 C ATOM 128 CE LYS A 8 117.622 4.737 -17.755 1.00 0.00 C ATOM 129 NZ LYS A 8 118.435 4.885 -18.995 1.00 0.00 N ATOM 0 H LYS A 8 116.024 3.463 -12.858 1.00 0.00 H new ATOM 0 HA LYS A 8 118.267 3.864 -12.511 1.00 0.00 H new ATOM 0 HB2 LYS A 8 118.045 6.388 -14.164 1.00 0.00 H new ATOM 0 HB3 LYS A 8 119.389 5.269 -14.046 1.00 0.00 H new ATOM 0 HG2 LYS A 8 117.867 3.481 -15.097 1.00 0.00 H new ATOM 0 HG3 LYS A 8 116.690 4.747 -15.387 1.00 0.00 H new ATOM 0 HD2 LYS A 8 118.802 6.013 -16.470 1.00 0.00 H new ATOM 0 HD3 LYS A 8 119.430 4.384 -16.625 1.00 0.00 H new ATOM 0 HE2 LYS A 8 117.178 3.742 -17.715 1.00 0.00 H new ATOM 0 HE3 LYS A 8 116.800 5.453 -17.758 1.00 0.00 H new ATOM 0 HZ1 LYS A 8 117.830 4.731 -19.827 1.00 0.00 H new ATOM 0 HZ2 LYS A 8 118.839 5.843 -19.033 1.00 0.00 H new ATOM 0 HZ3 LYS A 8 119.204 4.185 -18.991 1.00 0.00 H new ATOM 143 N GLY A 9 116.691 6.246 -11.163 1.00 0.00 N ATOM 144 CA GLY A 9 116.691 7.258 -10.072 1.00 0.00 C ATOM 145 C GLY A 9 115.753 8.406 -10.441 1.00 0.00 C ATOM 146 O GLY A 9 116.172 9.416 -10.970 1.00 0.00 O ATOM 0 H GLY A 9 115.766 5.945 -11.469 1.00 0.00 H new ATOM 0 HA2 GLY A 9 116.371 6.799 -9.136 1.00 0.00 H new ATOM 0 HA3 GLY A 9 117.701 7.636 -9.913 1.00 0.00 H new ATOM 150 N ALA A 10 114.484 8.256 -10.164 1.00 0.00 N ATOM 151 CA ALA A 10 113.508 9.334 -10.497 1.00 0.00 C ATOM 152 C ALA A 10 112.123 8.713 -10.667 1.00 0.00 C ATOM 153 O ALA A 10 111.344 9.119 -11.507 1.00 0.00 O ATOM 154 CB ALA A 10 113.921 10.021 -11.802 1.00 0.00 C ATOM 0 H ALA A 10 114.081 7.431 -9.720 1.00 0.00 H new ATOM 0 HA ALA A 10 113.489 10.072 -9.695 1.00 0.00 H new ATOM 0 HB1 ALA A 10 113.205 10.808 -12.041 1.00 0.00 H new ATOM 0 HB2 ALA A 10 114.913 10.456 -11.686 1.00 0.00 H new ATOM 0 HB3 ALA A 10 113.938 9.289 -12.609 1.00 0.00 H new ATOM 160 N LEU A 11 111.817 7.722 -9.879 1.00 0.00 N ATOM 161 CA LEU A 11 110.491 7.057 -9.989 1.00 0.00 C ATOM 162 C LEU A 11 109.375 8.059 -9.695 1.00 0.00 C ATOM 163 O LEU A 11 109.608 9.243 -9.553 1.00 0.00 O ATOM 164 CB LEU A 11 110.429 5.896 -8.994 1.00 0.00 C ATOM 165 CG LEU A 11 110.090 6.408 -7.589 1.00 0.00 C ATOM 166 CD1 LEU A 11 110.360 5.297 -6.577 1.00 0.00 C ATOM 167 CD2 LEU A 11 110.961 7.617 -7.233 1.00 0.00 C ATOM 0 H LEU A 11 112.432 7.342 -9.159 1.00 0.00 H new ATOM 0 HA LEU A 11 110.358 6.677 -11.002 1.00 0.00 H new ATOM 0 HB2 LEU A 11 109.678 5.174 -9.315 1.00 0.00 H new ATOM 0 HB3 LEU A 11 111.386 5.374 -8.976 1.00 0.00 H new ATOM 0 HG LEU A 11 109.041 6.704 -7.566 1.00 0.00 H new ATOM 0 HD11 LEU A 11 110.122 5.652 -5.574 1.00 0.00 H new ATOM 0 HD12 LEU A 11 109.740 4.432 -6.812 1.00 0.00 H new ATOM 0 HD13 LEU A 11 111.411 5.013 -6.621 1.00 0.00 H new ATOM 0 HD21 LEU A 11 110.706 7.967 -6.233 1.00 0.00 H new ATOM 0 HD22 LEU A 11 112.012 7.329 -7.260 1.00 0.00 H new ATOM 0 HD23 LEU A 11 110.785 8.417 -7.953 1.00 0.00 H new ATOM 179 N THR A 12 108.161 7.591 -9.608 1.00 0.00 N ATOM 180 CA THR A 12 107.024 8.513 -9.328 1.00 0.00 C ATOM 181 C THR A 12 107.405 9.486 -8.208 1.00 0.00 C ATOM 182 O THR A 12 108.421 9.339 -7.558 1.00 0.00 O ATOM 183 CB THR A 12 105.803 7.697 -8.897 1.00 0.00 C ATOM 184 OG1 THR A 12 104.839 8.563 -8.313 1.00 0.00 O ATOM 185 CG2 THR A 12 106.227 6.640 -7.877 1.00 0.00 C ATOM 0 H THR A 12 107.907 6.609 -9.719 1.00 0.00 H new ATOM 0 HA THR A 12 106.790 9.078 -10.230 1.00 0.00 H new ATOM 0 HB THR A 12 105.369 7.204 -9.767 1.00 0.00 H new ATOM 0 HG1 THR A 12 104.056 8.042 -8.038 1.00 0.00 H new ATOM 0 HG21 THR A 12 105.356 6.060 -7.571 1.00 0.00 H new ATOM 0 HG22 THR A 12 106.966 5.976 -8.326 1.00 0.00 H new ATOM 0 HG23 THR A 12 106.662 7.129 -7.005 1.00 0.00 H new ATOM 193 N SER A 13 106.589 10.479 -7.981 1.00 0.00 N ATOM 194 CA SER A 13 106.880 11.473 -6.907 1.00 0.00 C ATOM 195 C SER A 13 106.906 10.772 -5.545 1.00 0.00 C ATOM 196 O SER A 13 106.933 11.408 -4.510 1.00 0.00 O ATOM 197 CB SER A 13 105.796 12.550 -6.906 1.00 0.00 C ATOM 198 OG SER A 13 106.311 13.735 -6.312 1.00 0.00 O ATOM 0 H SER A 13 105.726 10.646 -8.498 1.00 0.00 H new ATOM 0 HA SER A 13 107.851 11.932 -7.093 1.00 0.00 H new ATOM 0 HB2 SER A 13 105.468 12.753 -7.926 1.00 0.00 H new ATOM 0 HB3 SER A 13 104.923 12.203 -6.354 1.00 0.00 H new ATOM 0 HG SER A 13 107.068 14.063 -6.840 1.00 0.00 H new ATOM 204 N GLY A 14 106.885 9.469 -5.539 1.00 0.00 N ATOM 205 CA GLY A 14 106.893 8.723 -4.247 1.00 0.00 C ATOM 206 C GLY A 14 107.944 9.311 -3.303 1.00 0.00 C ATOM 207 O GLY A 14 107.802 9.266 -2.098 1.00 0.00 O ATOM 0 H GLY A 14 106.863 8.885 -6.375 1.00 0.00 H new ATOM 0 HA2 GLY A 14 105.908 8.774 -3.783 1.00 0.00 H new ATOM 0 HA3 GLY A 14 107.106 7.669 -4.428 1.00 0.00 H new ATOM 211 N ARG A 15 109.005 9.845 -3.835 1.00 0.00 N ATOM 212 CA ARG A 15 110.070 10.416 -2.961 1.00 0.00 C ATOM 213 C ARG A 15 109.491 11.480 -2.020 1.00 0.00 C ATOM 214 O ARG A 15 109.550 11.348 -0.814 1.00 0.00 O ATOM 215 CB ARG A 15 111.161 11.048 -3.831 1.00 0.00 C ATOM 216 CG ARG A 15 110.564 11.472 -5.173 1.00 0.00 C ATOM 217 CD ARG A 15 111.373 12.631 -5.758 1.00 0.00 C ATOM 218 NE ARG A 15 111.421 12.502 -7.242 1.00 0.00 N ATOM 219 CZ ARG A 15 112.365 13.099 -7.918 1.00 0.00 C ATOM 220 NH1 ARG A 15 113.266 13.808 -7.294 1.00 0.00 N ATOM 221 NH2 ARG A 15 112.407 12.988 -9.217 1.00 0.00 N ATOM 0 H ARG A 15 109.183 9.912 -4.837 1.00 0.00 H new ATOM 0 HA ARG A 15 110.492 9.611 -2.359 1.00 0.00 H new ATOM 0 HB2 ARG A 15 111.591 11.912 -3.323 1.00 0.00 H new ATOM 0 HB3 ARG A 15 111.971 10.336 -3.990 1.00 0.00 H new ATOM 0 HG2 ARG A 15 110.566 10.630 -5.865 1.00 0.00 H new ATOM 0 HG3 ARG A 15 109.525 11.773 -5.040 1.00 0.00 H new ATOM 0 HD2 ARG A 15 110.920 13.582 -5.479 1.00 0.00 H new ATOM 0 HD3 ARG A 15 112.383 12.627 -5.349 1.00 0.00 H new ATOM 0 HE ARG A 15 110.717 11.948 -7.729 1.00 0.00 H new ATOM 0 HH11 ARG A 15 113.233 13.896 -6.278 1.00 0.00 H new ATOM 0 HH12 ARG A 15 114.004 14.274 -7.822 1.00 0.00 H new ATOM 0 HH21 ARG A 15 111.702 12.435 -9.705 1.00 0.00 H new ATOM 0 HH22 ARG A 15 113.145 13.454 -9.745 1.00 0.00 H new ATOM 235 N GLU A 16 108.957 12.545 -2.554 1.00 0.00 N ATOM 236 CA GLU A 16 108.407 13.622 -1.675 1.00 0.00 C ATOM 237 C GLU A 16 106.987 13.282 -1.220 1.00 0.00 C ATOM 238 O GLU A 16 106.685 13.279 -0.043 1.00 0.00 O ATOM 239 CB GLU A 16 108.374 14.948 -2.445 1.00 0.00 C ATOM 240 CG GLU A 16 108.215 14.675 -3.942 1.00 0.00 C ATOM 241 CD GLU A 16 108.049 16.001 -4.687 1.00 0.00 C ATOM 242 OE1 GLU A 16 108.011 17.027 -4.028 1.00 0.00 O ATOM 243 OE2 GLU A 16 107.964 15.968 -5.903 1.00 0.00 O ATOM 0 H GLU A 16 108.877 12.718 -3.556 1.00 0.00 H new ATOM 0 HA GLU A 16 109.050 13.708 -0.799 1.00 0.00 H new ATOM 0 HB2 GLU A 16 107.549 15.565 -2.089 1.00 0.00 H new ATOM 0 HB3 GLU A 16 109.292 15.507 -2.264 1.00 0.00 H new ATOM 0 HG2 GLU A 16 109.086 14.140 -4.320 1.00 0.00 H new ATOM 0 HG3 GLU A 16 107.349 14.037 -4.116 1.00 0.00 H new ATOM 250 N GLU A 17 106.107 13.029 -2.143 1.00 0.00 N ATOM 251 CA GLU A 17 104.697 12.728 -1.773 1.00 0.00 C ATOM 252 C GLU A 17 104.626 11.623 -0.716 1.00 0.00 C ATOM 253 O GLU A 17 103.965 11.767 0.290 1.00 0.00 O ATOM 254 CB GLU A 17 103.933 12.279 -3.020 1.00 0.00 C ATOM 255 CG GLU A 17 104.070 13.339 -4.114 1.00 0.00 C ATOM 256 CD GLU A 17 103.647 14.702 -3.562 1.00 0.00 C ATOM 257 OE1 GLU A 17 102.662 14.749 -2.844 1.00 0.00 O ATOM 258 OE2 GLU A 17 104.316 15.676 -3.866 1.00 0.00 O ATOM 0 H GLU A 17 106.303 13.017 -3.144 1.00 0.00 H new ATOM 0 HA GLU A 17 104.251 13.632 -1.358 1.00 0.00 H new ATOM 0 HB2 GLU A 17 104.323 11.324 -3.374 1.00 0.00 H new ATOM 0 HB3 GLU A 17 102.881 12.124 -2.779 1.00 0.00 H new ATOM 0 HG2 GLU A 17 105.101 13.382 -4.466 1.00 0.00 H new ATOM 0 HG3 GLU A 17 103.451 13.074 -4.971 1.00 0.00 H new ATOM 265 N LEU A 18 105.265 10.510 -0.940 1.00 0.00 N ATOM 266 CA LEU A 18 105.177 9.399 0.052 1.00 0.00 C ATOM 267 C LEU A 18 106.058 9.663 1.281 1.00 0.00 C ATOM 268 O LEU A 18 105.647 9.411 2.398 1.00 0.00 O ATOM 269 CB LEU A 18 105.598 8.084 -0.611 1.00 0.00 C ATOM 270 CG LEU A 18 104.442 7.081 -0.535 1.00 0.00 C ATOM 271 CD1 LEU A 18 104.108 6.794 0.932 1.00 0.00 C ATOM 272 CD2 LEU A 18 103.208 7.663 -1.234 1.00 0.00 C ATOM 0 H LEU A 18 105.841 10.320 -1.760 1.00 0.00 H new ATOM 0 HA LEU A 18 104.143 9.333 0.390 1.00 0.00 H new ATOM 0 HB2 LEU A 18 105.873 8.260 -1.651 1.00 0.00 H new ATOM 0 HB3 LEU A 18 106.479 7.679 -0.113 1.00 0.00 H new ATOM 0 HG LEU A 18 104.736 6.155 -1.029 1.00 0.00 H new ATOM 0 HD11 LEU A 18 103.286 6.081 0.985 1.00 0.00 H new ATOM 0 HD12 LEU A 18 104.983 6.376 1.429 1.00 0.00 H new ATOM 0 HD13 LEU A 18 103.817 7.721 1.427 1.00 0.00 H new ATOM 0 HD21 LEU A 18 102.387 6.948 -1.179 1.00 0.00 H new ATOM 0 HD22 LEU A 18 102.915 8.591 -0.742 1.00 0.00 H new ATOM 0 HD23 LEU A 18 103.443 7.865 -2.279 1.00 0.00 H new ATOM 284 N THR A 19 107.258 10.151 1.115 1.00 0.00 N ATOM 285 CA THR A 19 108.102 10.385 2.319 1.00 0.00 C ATOM 286 C THR A 19 107.453 11.466 3.174 1.00 0.00 C ATOM 287 O THR A 19 107.184 11.264 4.340 1.00 0.00 O ATOM 288 CB THR A 19 109.509 10.819 1.901 1.00 0.00 C ATOM 289 OG1 THR A 19 109.979 9.946 0.885 1.00 0.00 O ATOM 290 CG2 THR A 19 110.457 10.758 3.107 1.00 0.00 C ATOM 0 H THR A 19 107.682 10.393 0.219 1.00 0.00 H new ATOM 0 HA THR A 19 108.183 9.462 2.894 1.00 0.00 H new ATOM 0 HB THR A 19 109.477 11.842 1.527 1.00 0.00 H new ATOM 0 HG1 THR A 19 109.641 10.245 0.015 1.00 0.00 H new ATOM 0 HG21 THR A 19 111.456 11.068 2.801 1.00 0.00 H new ATOM 0 HG22 THR A 19 110.094 11.425 3.889 1.00 0.00 H new ATOM 0 HG23 THR A 19 110.495 9.738 3.489 1.00 0.00 H new ATOM 298 N ARG A 20 107.174 12.601 2.600 1.00 0.00 N ATOM 299 CA ARG A 20 106.517 13.682 3.379 1.00 0.00 C ATOM 300 C ARG A 20 105.249 13.123 4.022 1.00 0.00 C ATOM 301 O ARG A 20 104.891 13.472 5.130 1.00 0.00 O ATOM 302 CB ARG A 20 106.147 14.826 2.440 1.00 0.00 C ATOM 303 CG ARG A 20 107.421 15.514 1.966 1.00 0.00 C ATOM 304 CD ARG A 20 107.108 16.398 0.757 1.00 0.00 C ATOM 305 NE ARG A 20 106.173 17.483 1.164 1.00 0.00 N ATOM 306 CZ ARG A 20 105.610 18.234 0.257 1.00 0.00 C ATOM 307 NH1 ARG A 20 105.867 18.034 -1.007 1.00 0.00 N ATOM 308 NH2 ARG A 20 104.790 19.185 0.614 1.00 0.00 N ATOM 0 H ARG A 20 107.373 12.826 1.625 1.00 0.00 H new ATOM 0 HA ARG A 20 107.193 14.051 4.150 1.00 0.00 H new ATOM 0 HB2 ARG A 20 105.585 14.445 1.587 1.00 0.00 H new ATOM 0 HB3 ARG A 20 105.503 15.540 2.953 1.00 0.00 H new ATOM 0 HG2 ARG A 20 107.842 16.117 2.771 1.00 0.00 H new ATOM 0 HG3 ARG A 20 108.171 14.769 1.700 1.00 0.00 H new ATOM 0 HD2 ARG A 20 108.028 16.826 0.358 1.00 0.00 H new ATOM 0 HD3 ARG A 20 106.664 15.800 -0.039 1.00 0.00 H new ATOM 0 HE ARG A 20 105.972 17.639 2.152 1.00 0.00 H new ATOM 0 HH11 ARG A 20 106.508 17.291 -1.286 1.00 0.00 H new ATOM 0 HH12 ARG A 20 105.427 18.621 -1.716 1.00 0.00 H new ATOM 0 HH21 ARG A 20 104.589 19.341 1.602 1.00 0.00 H new ATOM 0 HH22 ARG A 20 104.350 19.772 -0.095 1.00 0.00 H new ATOM 322 N GLN A 21 104.571 12.249 3.330 1.00 0.00 N ATOM 323 CA GLN A 21 103.329 11.649 3.881 1.00 0.00 C ATOM 324 C GLN A 21 103.668 10.837 5.128 1.00 0.00 C ATOM 325 O GLN A 21 102.823 10.564 5.949 1.00 0.00 O ATOM 326 CB GLN A 21 102.716 10.723 2.830 1.00 0.00 C ATOM 327 CG GLN A 21 101.960 11.552 1.794 1.00 0.00 C ATOM 328 CD GLN A 21 100.501 11.710 2.228 1.00 0.00 C ATOM 329 OE1 GLN A 21 99.599 11.288 1.532 1.00 0.00 O ATOM 330 NE2 GLN A 21 100.228 12.305 3.358 1.00 0.00 N ATOM 0 H GLN A 21 104.829 11.924 2.398 1.00 0.00 H new ATOM 0 HA GLN A 21 102.623 12.438 4.140 1.00 0.00 H new ATOM 0 HB2 GLN A 21 103.498 10.140 2.344 1.00 0.00 H new ATOM 0 HB3 GLN A 21 102.040 10.013 3.306 1.00 0.00 H new ATOM 0 HG2 GLN A 21 102.426 12.531 1.687 1.00 0.00 H new ATOM 0 HG3 GLN A 21 102.009 11.067 0.819 1.00 0.00 H new ATOM 0 HE21 GLN A 21 100.984 12.660 3.943 1.00 0.00 H new ATOM 0 HE22 GLN A 21 99.258 12.415 3.655 1.00 0.00 H new ATOM 339 N VAL A 22 104.901 10.444 5.270 1.00 0.00 N ATOM 340 CA VAL A 22 105.298 9.630 6.453 1.00 0.00 C ATOM 341 C VAL A 22 104.697 10.224 7.729 1.00 0.00 C ATOM 342 O VAL A 22 104.392 9.515 8.667 1.00 0.00 O ATOM 343 CB VAL A 22 106.825 9.632 6.567 1.00 0.00 C ATOM 344 CG1 VAL A 22 107.251 8.920 7.850 1.00 0.00 C ATOM 345 CG2 VAL A 22 107.429 8.913 5.359 1.00 0.00 C ATOM 0 H VAL A 22 105.655 10.652 4.615 1.00 0.00 H new ATOM 0 HA VAL A 22 104.930 8.612 6.329 1.00 0.00 H new ATOM 0 HB VAL A 22 107.181 10.662 6.594 1.00 0.00 H new ATOM 0 HG11 VAL A 22 108.338 8.925 7.925 1.00 0.00 H new ATOM 0 HG12 VAL A 22 106.826 9.436 8.711 1.00 0.00 H new ATOM 0 HG13 VAL A 22 106.893 7.891 7.831 1.00 0.00 H new ATOM 0 HG21 VAL A 22 108.516 8.915 5.441 1.00 0.00 H new ATOM 0 HG22 VAL A 22 107.069 7.885 5.330 1.00 0.00 H new ATOM 0 HG23 VAL A 22 107.133 9.427 4.444 1.00 0.00 H new ATOM 355 N GLY A 23 104.525 11.513 7.778 1.00 0.00 N ATOM 356 CA GLY A 23 103.947 12.137 9.002 1.00 0.00 C ATOM 357 C GLY A 23 102.577 11.522 9.314 1.00 0.00 C ATOM 358 O GLY A 23 101.919 11.908 10.260 1.00 0.00 O ATOM 0 H GLY A 23 104.758 12.162 7.027 1.00 0.00 H new ATOM 0 HA2 GLY A 23 104.620 11.990 9.846 1.00 0.00 H new ATOM 0 HA3 GLY A 23 103.846 13.213 8.858 1.00 0.00 H new ATOM 362 N ARG A 24 102.135 10.573 8.531 1.00 0.00 N ATOM 363 CA ARG A 24 100.803 9.951 8.801 1.00 0.00 C ATOM 364 C ARG A 24 100.792 8.497 8.317 1.00 0.00 C ATOM 365 O ARG A 24 99.759 7.860 8.261 1.00 0.00 O ATOM 366 CB ARG A 24 99.716 10.739 8.065 1.00 0.00 C ATOM 367 CG ARG A 24 98.436 10.751 8.904 1.00 0.00 C ATOM 368 CD ARG A 24 98.518 11.870 9.945 1.00 0.00 C ATOM 369 NE ARG A 24 97.212 11.987 10.651 1.00 0.00 N ATOM 370 CZ ARG A 24 96.811 11.032 11.445 1.00 0.00 C ATOM 371 NH1 ARG A 24 97.555 9.974 11.620 1.00 0.00 N ATOM 372 NH2 ARG A 24 95.666 11.134 12.063 1.00 0.00 N ATOM 0 H ARG A 24 102.634 10.203 7.722 1.00 0.00 H new ATOM 0 HA ARG A 24 100.612 9.971 9.874 1.00 0.00 H new ATOM 0 HB2 ARG A 24 100.053 11.759 7.882 1.00 0.00 H new ATOM 0 HB3 ARG A 24 99.521 10.288 7.092 1.00 0.00 H new ATOM 0 HG2 ARG A 24 97.569 10.901 8.261 1.00 0.00 H new ATOM 0 HG3 ARG A 24 98.304 9.789 9.399 1.00 0.00 H new ATOM 0 HD2 ARG A 24 99.313 11.658 10.660 1.00 0.00 H new ATOM 0 HD3 ARG A 24 98.768 12.814 9.461 1.00 0.00 H new ATOM 0 HE ARG A 24 96.631 12.814 10.514 1.00 0.00 H new ATOM 0 HH11 ARG A 24 98.449 9.894 11.136 1.00 0.00 H new ATOM 0 HH12 ARG A 24 97.242 9.227 12.240 1.00 0.00 H new ATOM 0 HH21 ARG A 24 95.084 11.960 11.926 1.00 0.00 H new ATOM 0 HH22 ARG A 24 95.353 10.387 12.683 1.00 0.00 H new ATOM 386 N TYR A 25 101.932 7.970 7.960 1.00 0.00 N ATOM 387 CA TYR A 25 101.984 6.563 7.474 1.00 0.00 C ATOM 388 C TYR A 25 103.045 5.801 8.262 1.00 0.00 C ATOM 389 O TYR A 25 102.870 4.651 8.614 1.00 0.00 O ATOM 390 CB TYR A 25 102.360 6.539 5.989 1.00 0.00 C ATOM 391 CG TYR A 25 101.375 7.358 5.189 1.00 0.00 C ATOM 392 CD1 TYR A 25 101.177 8.709 5.491 1.00 0.00 C ATOM 393 CD2 TYR A 25 100.665 6.767 4.140 1.00 0.00 C ATOM 394 CE1 TYR A 25 100.270 9.470 4.750 1.00 0.00 C ATOM 395 CE2 TYR A 25 99.757 7.527 3.396 1.00 0.00 C ATOM 396 CZ TYR A 25 99.558 8.880 3.700 1.00 0.00 C ATOM 397 OH TYR A 25 98.662 9.629 2.966 1.00 0.00 O ATOM 0 H TYR A 25 102.830 8.454 7.984 1.00 0.00 H new ATOM 0 HA TYR A 25 101.007 6.100 7.610 1.00 0.00 H new ATOM 0 HB2 TYR A 25 103.367 6.934 5.855 1.00 0.00 H new ATOM 0 HB3 TYR A 25 102.370 5.512 5.625 1.00 0.00 H new ATOM 0 HD1 TYR A 25 101.727 9.166 6.300 1.00 0.00 H new ATOM 0 HD2 TYR A 25 100.818 5.724 3.904 1.00 0.00 H new ATOM 0 HE1 TYR A 25 100.118 10.513 4.987 1.00 0.00 H new ATOM 0 HE2 TYR A 25 99.208 7.070 2.586 1.00 0.00 H new ATOM 0 HH TYR A 25 99.090 9.932 2.138 1.00 0.00 H new ATOM 407 N LYS A 26 104.153 6.432 8.534 1.00 0.00 N ATOM 408 CA LYS A 26 105.232 5.744 9.288 1.00 0.00 C ATOM 409 C LYS A 26 105.695 4.525 8.489 1.00 0.00 C ATOM 410 O LYS A 26 106.576 3.797 8.901 1.00 0.00 O ATOM 411 CB LYS A 26 104.698 5.292 10.649 1.00 0.00 C ATOM 412 CG LYS A 26 103.689 6.319 11.169 1.00 0.00 C ATOM 413 CD LYS A 26 103.600 6.222 12.693 1.00 0.00 C ATOM 414 CE LYS A 26 102.512 7.169 13.203 1.00 0.00 C ATOM 415 NZ LYS A 26 103.090 8.527 13.407 1.00 0.00 N ATOM 0 H LYS A 26 104.356 7.395 8.266 1.00 0.00 H new ATOM 0 HA LYS A 26 106.069 6.426 9.440 1.00 0.00 H new ATOM 0 HB2 LYS A 26 104.224 4.314 10.559 1.00 0.00 H new ATOM 0 HB3 LYS A 26 105.520 5.184 11.356 1.00 0.00 H new ATOM 0 HG2 LYS A 26 103.993 7.324 10.875 1.00 0.00 H new ATOM 0 HG3 LYS A 26 102.710 6.139 10.725 1.00 0.00 H new ATOM 0 HD2 LYS A 26 103.374 5.198 12.990 1.00 0.00 H new ATOM 0 HD3 LYS A 26 104.560 6.479 13.141 1.00 0.00 H new ATOM 0 HE2 LYS A 26 101.691 7.215 12.488 1.00 0.00 H new ATOM 0 HE3 LYS A 26 102.098 6.794 14.139 1.00 0.00 H new ATOM 0 HZ1 LYS A 26 102.350 9.171 13.754 1.00 0.00 H new ATOM 0 HZ2 LYS A 26 103.859 8.476 14.105 1.00 0.00 H new ATOM 0 HZ3 LYS A 26 103.464 8.884 12.505 1.00 0.00 H new ATOM 429 N ASN A 27 105.103 4.296 7.346 1.00 0.00 N ATOM 430 CA ASN A 27 105.505 3.126 6.520 1.00 0.00 C ATOM 431 C ASN A 27 106.584 3.548 5.523 1.00 0.00 C ATOM 432 O ASN A 27 106.615 4.670 5.059 1.00 0.00 O ATOM 433 CB ASN A 27 104.287 2.597 5.759 1.00 0.00 C ATOM 434 CG ASN A 27 103.560 1.559 6.615 1.00 0.00 C ATOM 435 OD1 ASN A 27 104.185 0.766 7.291 1.00 0.00 O ATOM 436 ND2 ASN A 27 102.255 1.530 6.616 1.00 0.00 N ATOM 0 H ASN A 27 104.358 4.871 6.951 1.00 0.00 H new ATOM 0 HA ASN A 27 105.898 2.343 7.169 1.00 0.00 H new ATOM 0 HB2 ASN A 27 103.613 3.418 5.514 1.00 0.00 H new ATOM 0 HB3 ASN A 27 104.601 2.150 4.816 1.00 0.00 H new ATOM 0 HD21 ASN A 27 101.761 0.842 7.184 1.00 0.00 H new ATOM 0 HD22 ASN A 27 101.730 2.195 6.049 1.00 0.00 H new ATOM 443 N LYS A 28 107.467 2.650 5.191 1.00 0.00 N ATOM 444 CA LYS A 28 108.551 2.977 4.225 1.00 0.00 C ATOM 445 C LYS A 28 108.644 1.845 3.201 1.00 0.00 C ATOM 446 O LYS A 28 108.812 2.060 2.012 1.00 0.00 O ATOM 447 CB LYS A 28 109.872 3.084 4.978 1.00 0.00 C ATOM 448 CG LYS A 28 109.927 4.407 5.746 1.00 0.00 C ATOM 449 CD LYS A 28 109.243 4.243 7.106 1.00 0.00 C ATOM 450 CE LYS A 28 108.470 5.519 7.448 1.00 0.00 C ATOM 451 NZ LYS A 28 108.341 5.639 8.928 1.00 0.00 N ATOM 0 H LYS A 28 107.484 1.696 5.550 1.00 0.00 H new ATOM 0 HA LYS A 28 108.340 3.921 3.723 1.00 0.00 H new ATOM 0 HB2 LYS A 28 109.976 2.247 5.669 1.00 0.00 H new ATOM 0 HB3 LYS A 28 110.706 3.025 4.278 1.00 0.00 H new ATOM 0 HG2 LYS A 28 110.963 4.716 5.884 1.00 0.00 H new ATOM 0 HG3 LYS A 28 109.434 5.192 5.173 1.00 0.00 H new ATOM 0 HD2 LYS A 28 108.565 3.390 7.083 1.00 0.00 H new ATOM 0 HD3 LYS A 28 109.987 4.038 7.876 1.00 0.00 H new ATOM 0 HE2 LYS A 28 108.988 6.390 7.045 1.00 0.00 H new ATOM 0 HE3 LYS A 28 107.483 5.494 6.987 1.00 0.00 H new ATOM 0 HZ1 LYS A 28 107.831 6.514 9.162 1.00 0.00 H new ATOM 0 HZ2 LYS A 28 107.815 4.822 9.298 1.00 0.00 H new ATOM 0 HZ3 LYS A 28 109.288 5.665 9.358 1.00 0.00 H new ATOM 465 N LYS A 29 108.527 0.635 3.671 1.00 0.00 N ATOM 466 CA LYS A 29 108.595 -0.546 2.770 1.00 0.00 C ATOM 467 C LYS A 29 107.335 -0.598 1.908 1.00 0.00 C ATOM 468 O LYS A 29 107.182 -1.440 1.048 1.00 0.00 O ATOM 469 CB LYS A 29 108.673 -1.811 3.627 1.00 0.00 C ATOM 470 CG LYS A 29 107.876 -1.616 4.921 1.00 0.00 C ATOM 471 CD LYS A 29 106.442 -1.197 4.591 1.00 0.00 C ATOM 472 CE LYS A 29 105.531 -1.521 5.776 1.00 0.00 C ATOM 473 NZ LYS A 29 105.137 -2.957 5.722 1.00 0.00 N ATOM 0 H LYS A 29 108.385 0.412 4.656 1.00 0.00 H new ATOM 0 HA LYS A 29 109.472 -0.475 2.126 1.00 0.00 H new ATOM 0 HB2 LYS A 29 108.278 -2.662 3.071 1.00 0.00 H new ATOM 0 HB3 LYS A 29 109.713 -2.038 3.861 1.00 0.00 H new ATOM 0 HG2 LYS A 29 107.870 -2.541 5.498 1.00 0.00 H new ATOM 0 HG3 LYS A 29 108.353 -0.857 5.541 1.00 0.00 H new ATOM 0 HD2 LYS A 29 106.405 -0.130 4.371 1.00 0.00 H new ATOM 0 HD3 LYS A 29 106.095 -1.719 3.699 1.00 0.00 H new ATOM 0 HE2 LYS A 29 106.046 -1.309 6.713 1.00 0.00 H new ATOM 0 HE3 LYS A 29 104.644 -0.888 5.750 1.00 0.00 H new ATOM 0 HZ1 LYS A 29 104.866 -3.279 6.673 1.00 0.00 H new ATOM 0 HZ2 LYS A 29 104.331 -3.072 5.075 1.00 0.00 H new ATOM 0 HZ3 LYS A 29 105.939 -3.524 5.380 1.00 0.00 H new ATOM 487 N PHE A 30 106.421 0.285 2.158 1.00 0.00 N ATOM 488 CA PHE A 30 105.142 0.287 1.392 1.00 0.00 C ATOM 489 C PHE A 30 105.363 0.661 -0.085 1.00 0.00 C ATOM 490 O PHE A 30 105.355 -0.182 -0.961 1.00 0.00 O ATOM 491 CB PHE A 30 104.270 1.369 2.029 1.00 0.00 C ATOM 492 CG PHE A 30 105.083 2.655 2.190 1.00 0.00 C ATOM 493 CD1 PHE A 30 106.412 2.747 1.712 1.00 0.00 C ATOM 494 CD2 PHE A 30 104.504 3.765 2.815 1.00 0.00 C ATOM 495 CE1 PHE A 30 107.131 3.935 1.860 1.00 0.00 C ATOM 496 CE2 PHE A 30 105.235 4.953 2.962 1.00 0.00 C ATOM 497 CZ PHE A 30 106.547 5.035 2.483 1.00 0.00 C ATOM 0 H PHE A 30 106.500 1.015 2.866 1.00 0.00 H new ATOM 0 HA PHE A 30 104.692 -0.705 1.422 1.00 0.00 H new ATOM 0 HB2 PHE A 30 103.394 1.556 1.408 1.00 0.00 H new ATOM 0 HB3 PHE A 30 103.907 1.033 3.000 1.00 0.00 H new ATOM 0 HD1 PHE A 30 106.871 1.896 1.231 1.00 0.00 H new ATOM 0 HD2 PHE A 30 103.491 3.707 3.185 1.00 0.00 H new ATOM 0 HE1 PHE A 30 108.144 4.001 1.490 1.00 0.00 H new ATOM 0 HE2 PHE A 30 104.784 5.807 3.446 1.00 0.00 H new ATOM 0 HZ PHE A 30 107.107 5.952 2.596 1.00 0.00 H new ATOM 507 N MET A 31 105.595 1.918 -0.350 1.00 0.00 N ATOM 508 CA MET A 31 105.857 2.379 -1.737 1.00 0.00 C ATOM 509 C MET A 31 107.315 2.116 -2.090 1.00 0.00 C ATOM 510 O MET A 31 107.637 1.618 -3.151 1.00 0.00 O ATOM 511 CB MET A 31 105.576 3.879 -1.829 1.00 0.00 C ATOM 512 CG MET A 31 106.233 4.448 -3.087 1.00 0.00 C ATOM 513 SD MET A 31 105.857 3.381 -4.500 1.00 0.00 S ATOM 514 CE MET A 31 106.595 4.429 -5.778 1.00 0.00 C ATOM 0 H MET A 31 105.614 2.657 0.353 1.00 0.00 H new ATOM 0 HA MET A 31 105.212 1.841 -2.431 1.00 0.00 H new ATOM 0 HB2 MET A 31 104.501 4.057 -1.856 1.00 0.00 H new ATOM 0 HB3 MET A 31 105.961 4.386 -0.944 1.00 0.00 H new ATOM 0 HG2 MET A 31 105.870 5.459 -3.274 1.00 0.00 H new ATOM 0 HG3 MET A 31 107.312 4.517 -2.947 1.00 0.00 H new ATOM 0 HE1 MET A 31 106.158 4.184 -6.746 1.00 0.00 H new ATOM 0 HE2 MET A 31 106.401 5.476 -5.546 1.00 0.00 H new ATOM 0 HE3 MET A 31 107.671 4.258 -5.812 1.00 0.00 H new ATOM 524 N GLN A 32 108.202 2.481 -1.205 1.00 0.00 N ATOM 525 CA GLN A 32 109.645 2.295 -1.471 1.00 0.00 C ATOM 526 C GLN A 32 110.005 0.809 -1.362 1.00 0.00 C ATOM 527 O GLN A 32 110.913 0.336 -2.014 1.00 0.00 O ATOM 528 CB GLN A 32 110.444 3.134 -0.472 1.00 0.00 C ATOM 529 CG GLN A 32 110.007 4.598 -0.582 1.00 0.00 C ATOM 530 CD GLN A 32 110.635 5.404 0.557 1.00 0.00 C ATOM 531 OE1 GLN A 32 111.629 5.000 1.127 1.00 0.00 O ATOM 532 NE2 GLN A 32 110.093 6.537 0.914 1.00 0.00 N ATOM 0 H GLN A 32 107.981 2.903 -0.303 1.00 0.00 H new ATOM 0 HA GLN A 32 109.889 2.625 -2.481 1.00 0.00 H new ATOM 0 HB2 GLN A 32 110.280 2.768 0.542 1.00 0.00 H new ATOM 0 HB3 GLN A 32 111.511 3.044 -0.675 1.00 0.00 H new ATOM 0 HG2 GLN A 32 110.313 5.009 -1.544 1.00 0.00 H new ATOM 0 HG3 GLN A 32 108.920 4.669 -0.536 1.00 0.00 H new ATOM 0 HE21 GLN A 32 109.259 6.876 0.436 1.00 0.00 H new ATOM 0 HE22 GLN A 32 110.504 7.083 1.671 1.00 0.00 H new ATOM 541 N GLY A 33 109.302 0.061 -0.548 1.00 0.00 N ATOM 542 CA GLY A 33 109.622 -1.389 -0.429 1.00 0.00 C ATOM 543 C GLY A 33 109.211 -2.086 -1.723 1.00 0.00 C ATOM 544 O GLY A 33 109.991 -2.789 -2.334 1.00 0.00 O ATOM 0 H GLY A 33 108.530 0.389 0.032 1.00 0.00 H new ATOM 0 HA2 GLY A 33 110.688 -1.528 -0.247 1.00 0.00 H new ATOM 0 HA3 GLY A 33 109.094 -1.825 0.419 1.00 0.00 H new ATOM 548 N THR A 34 107.998 -1.879 -2.163 1.00 0.00 N ATOM 549 CA THR A 34 107.562 -2.516 -3.436 1.00 0.00 C ATOM 550 C THR A 34 108.492 -2.032 -4.547 1.00 0.00 C ATOM 551 O THR A 34 108.631 -2.653 -5.582 1.00 0.00 O ATOM 552 CB THR A 34 106.118 -2.113 -3.753 1.00 0.00 C ATOM 553 OG1 THR A 34 105.706 -2.749 -4.955 1.00 0.00 O ATOM 554 CG2 THR A 34 106.031 -0.596 -3.921 1.00 0.00 C ATOM 0 H THR A 34 107.297 -1.301 -1.699 1.00 0.00 H new ATOM 0 HA THR A 34 107.606 -3.602 -3.351 1.00 0.00 H new ATOM 0 HB THR A 34 105.467 -2.421 -2.935 1.00 0.00 H new ATOM 0 HG1 THR A 34 104.782 -2.494 -5.160 1.00 0.00 H new ATOM 0 HG21 THR A 34 105.003 -0.313 -4.146 1.00 0.00 H new ATOM 0 HG22 THR A 34 106.347 -0.109 -2.999 1.00 0.00 H new ATOM 0 HG23 THR A 34 106.681 -0.283 -4.738 1.00 0.00 H new ATOM 562 N VAL A 35 109.135 -0.921 -4.323 1.00 0.00 N ATOM 563 CA VAL A 35 110.072 -0.367 -5.337 1.00 0.00 C ATOM 564 C VAL A 35 111.367 -1.192 -5.335 1.00 0.00 C ATOM 565 O VAL A 35 111.745 -1.773 -6.332 1.00 0.00 O ATOM 566 CB VAL A 35 110.372 1.091 -4.972 1.00 0.00 C ATOM 567 CG1 VAL A 35 111.745 1.498 -5.494 1.00 0.00 C ATOM 568 CG2 VAL A 35 109.311 2.002 -5.589 1.00 0.00 C ATOM 0 H VAL A 35 109.050 -0.367 -3.471 1.00 0.00 H new ATOM 0 HA VAL A 35 109.630 -0.412 -6.332 1.00 0.00 H new ATOM 0 HB VAL A 35 110.360 1.188 -3.886 1.00 0.00 H new ATOM 0 HG11 VAL A 35 111.943 2.536 -5.227 1.00 0.00 H new ATOM 0 HG12 VAL A 35 112.507 0.857 -5.051 1.00 0.00 H new ATOM 0 HG13 VAL A 35 111.768 1.392 -6.579 1.00 0.00 H new ATOM 0 HG21 VAL A 35 109.525 3.039 -5.329 1.00 0.00 H new ATOM 0 HG22 VAL A 35 109.322 1.890 -6.673 1.00 0.00 H new ATOM 0 HG23 VAL A 35 108.328 1.728 -5.206 1.00 0.00 H new ATOM 578 N ALA A 36 112.048 -1.248 -4.221 1.00 0.00 N ATOM 579 CA ALA A 36 113.314 -2.033 -4.153 1.00 0.00 C ATOM 580 C ALA A 36 113.111 -3.402 -4.807 1.00 0.00 C ATOM 581 O ALA A 36 113.881 -3.814 -5.652 1.00 0.00 O ATOM 582 CB ALA A 36 113.716 -2.223 -2.689 1.00 0.00 C ATOM 0 H ALA A 36 111.781 -0.783 -3.354 1.00 0.00 H new ATOM 0 HA ALA A 36 114.100 -1.495 -4.682 1.00 0.00 H new ATOM 0 HB1 ALA A 36 114.641 -2.797 -2.637 1.00 0.00 H new ATOM 0 HB2 ALA A 36 113.867 -1.249 -2.224 1.00 0.00 H new ATOM 0 HB3 ALA A 36 112.927 -2.759 -2.162 1.00 0.00 H new ATOM 588 N VAL A 37 112.085 -4.114 -4.428 1.00 0.00 N ATOM 589 CA VAL A 37 111.851 -5.453 -5.040 1.00 0.00 C ATOM 590 C VAL A 37 111.802 -5.301 -6.558 1.00 0.00 C ATOM 591 O VAL A 37 112.363 -6.097 -7.288 1.00 0.00 O ATOM 592 CB VAL A 37 110.529 -6.035 -4.538 1.00 0.00 C ATOM 593 CG1 VAL A 37 109.424 -4.994 -4.686 1.00 0.00 C ATOM 594 CG2 VAL A 37 110.173 -7.275 -5.363 1.00 0.00 C ATOM 0 H VAL A 37 111.403 -3.829 -3.726 1.00 0.00 H new ATOM 0 HA VAL A 37 112.660 -6.128 -4.760 1.00 0.00 H new ATOM 0 HB VAL A 37 110.630 -6.311 -3.488 1.00 0.00 H new ATOM 0 HG11 VAL A 37 108.482 -5.410 -4.328 1.00 0.00 H new ATOM 0 HG12 VAL A 37 109.676 -4.110 -4.101 1.00 0.00 H new ATOM 0 HG13 VAL A 37 109.323 -4.717 -5.735 1.00 0.00 H new ATOM 0 HG21 VAL A 37 109.231 -7.691 -5.006 1.00 0.00 H new ATOM 0 HG22 VAL A 37 110.073 -6.997 -6.412 1.00 0.00 H new ATOM 0 HG23 VAL A 37 110.961 -8.020 -5.258 1.00 0.00 H new ATOM 604 N CYS A 38 111.159 -4.274 -7.048 1.00 0.00 N ATOM 605 CA CYS A 38 111.116 -4.084 -8.521 1.00 0.00 C ATOM 606 C CYS A 38 112.550 -4.142 -9.036 1.00 0.00 C ATOM 607 O CYS A 38 112.810 -4.518 -10.158 1.00 0.00 O ATOM 608 CB CYS A 38 110.500 -2.723 -8.858 1.00 0.00 C ATOM 609 SG CYS A 38 108.834 -2.623 -8.157 1.00 0.00 S ATOM 0 H CYS A 38 110.669 -3.569 -6.498 1.00 0.00 H new ATOM 0 HA CYS A 38 110.507 -4.859 -8.986 1.00 0.00 H new ATOM 0 HB2 CYS A 38 111.122 -1.922 -8.459 1.00 0.00 H new ATOM 0 HB3 CYS A 38 110.460 -2.588 -9.939 1.00 0.00 H new ATOM 0 HG CYS A 38 108.888 -2.843 -6.877 1.00 0.00 H new ATOM 615 N ALA A 39 113.488 -3.771 -8.211 1.00 0.00 N ATOM 616 CA ALA A 39 114.908 -3.817 -8.636 1.00 0.00 C ATOM 617 C ALA A 39 115.429 -5.258 -8.557 1.00 0.00 C ATOM 618 O ALA A 39 116.000 -5.775 -9.494 1.00 0.00 O ATOM 619 CB ALA A 39 115.740 -2.922 -7.719 1.00 0.00 C ATOM 0 H ALA A 39 113.329 -3.438 -7.260 1.00 0.00 H new ATOM 0 HA ALA A 39 114.988 -3.464 -9.664 1.00 0.00 H new ATOM 0 HB1 ALA A 39 116.784 -2.954 -8.029 1.00 0.00 H new ATOM 0 HB2 ALA A 39 115.374 -1.897 -7.781 1.00 0.00 H new ATOM 0 HB3 ALA A 39 115.656 -3.276 -6.691 1.00 0.00 H new ATOM 625 N ARG A 40 115.256 -5.894 -7.427 1.00 0.00 N ATOM 626 CA ARG A 40 115.764 -7.288 -7.250 1.00 0.00 C ATOM 627 C ARG A 40 115.525 -8.123 -8.511 1.00 0.00 C ATOM 628 O ARG A 40 116.334 -8.953 -8.869 1.00 0.00 O ATOM 629 CB ARG A 40 115.043 -7.944 -6.073 1.00 0.00 C ATOM 630 CG ARG A 40 115.432 -9.424 -5.988 1.00 0.00 C ATOM 631 CD ARG A 40 114.344 -10.287 -6.633 1.00 0.00 C ATOM 632 NE ARG A 40 114.549 -11.712 -6.247 1.00 0.00 N ATOM 633 CZ ARG A 40 114.087 -12.667 -7.008 1.00 0.00 C ATOM 634 NH1 ARG A 40 113.447 -12.374 -8.107 1.00 0.00 N ATOM 635 NH2 ARG A 40 114.266 -13.914 -6.669 1.00 0.00 N ATOM 0 H ARG A 40 114.781 -5.504 -6.613 1.00 0.00 H new ATOM 0 HA ARG A 40 116.836 -7.242 -7.060 1.00 0.00 H new ATOM 0 HB2 ARG A 40 115.304 -7.436 -5.145 1.00 0.00 H new ATOM 0 HB3 ARG A 40 113.964 -7.848 -6.196 1.00 0.00 H new ATOM 0 HG2 ARG A 40 116.385 -9.588 -6.492 1.00 0.00 H new ATOM 0 HG3 ARG A 40 115.568 -9.714 -4.946 1.00 0.00 H new ATOM 0 HD2 ARG A 40 113.359 -9.950 -6.311 1.00 0.00 H new ATOM 0 HD3 ARG A 40 114.378 -10.184 -7.718 1.00 0.00 H new ATOM 0 HE ARG A 40 115.050 -11.941 -5.389 1.00 0.00 H new ATOM 0 HH11 ARG A 40 113.308 -11.399 -8.372 1.00 0.00 H new ATOM 0 HH12 ARG A 40 113.086 -13.120 -8.701 1.00 0.00 H new ATOM 0 HH21 ARG A 40 114.767 -14.142 -5.810 1.00 0.00 H new ATOM 0 HH22 ARG A 40 113.905 -14.661 -7.263 1.00 0.00 H new ATOM 649 N ILE A 41 114.423 -7.934 -9.178 1.00 0.00 N ATOM 650 CA ILE A 41 114.159 -8.748 -10.402 1.00 0.00 C ATOM 651 C ILE A 41 114.695 -8.037 -11.657 1.00 0.00 C ATOM 652 O ILE A 41 115.001 -8.671 -12.647 1.00 0.00 O ATOM 653 CB ILE A 41 112.649 -9.002 -10.537 1.00 0.00 C ATOM 654 CG1 ILE A 41 112.021 -8.014 -11.522 1.00 0.00 C ATOM 655 CG2 ILE A 41 111.979 -8.842 -9.172 1.00 0.00 C ATOM 656 CD1 ILE A 41 112.269 -6.592 -11.034 1.00 0.00 C ATOM 0 H ILE A 41 113.698 -7.259 -8.935 1.00 0.00 H new ATOM 0 HA ILE A 41 114.677 -9.702 -10.307 1.00 0.00 H new ATOM 0 HB ILE A 41 112.501 -10.016 -10.910 1.00 0.00 H new ATOM 0 HG12 ILE A 41 112.450 -8.150 -12.515 1.00 0.00 H new ATOM 0 HG13 ILE A 41 110.950 -8.200 -11.609 1.00 0.00 H new ATOM 0 HG21 ILE A 41 110.908 -9.022 -9.269 1.00 0.00 H new ATOM 0 HG22 ILE A 41 112.406 -9.559 -8.471 1.00 0.00 H new ATOM 0 HG23 ILE A 41 112.145 -7.830 -8.802 1.00 0.00 H new ATOM 0 HD11 ILE A 41 111.823 -5.884 -11.733 1.00 0.00 H new ATOM 0 HD12 ILE A 41 111.820 -6.462 -10.050 1.00 0.00 H new ATOM 0 HD13 ILE A 41 113.342 -6.411 -10.970 1.00 0.00 H new ATOM 668 N ALA A 42 114.796 -6.733 -11.640 1.00 0.00 N ATOM 669 CA ALA A 42 115.292 -6.011 -12.850 1.00 0.00 C ATOM 670 C ALA A 42 116.820 -5.871 -12.804 1.00 0.00 C ATOM 671 O ALA A 42 117.428 -5.338 -13.711 1.00 0.00 O ATOM 672 CB ALA A 42 114.638 -4.627 -12.918 1.00 0.00 C ATOM 0 H ALA A 42 114.558 -6.139 -10.845 1.00 0.00 H new ATOM 0 HA ALA A 42 115.028 -6.583 -13.740 1.00 0.00 H new ATOM 0 HB1 ALA A 42 114.998 -4.097 -13.800 1.00 0.00 H new ATOM 0 HB2 ALA A 42 113.555 -4.739 -12.978 1.00 0.00 H new ATOM 0 HB3 ALA A 42 114.895 -4.059 -12.024 1.00 0.00 H new ATOM 678 N VAL A 43 117.440 -6.331 -11.751 1.00 0.00 N ATOM 679 CA VAL A 43 118.926 -6.216 -11.631 1.00 0.00 C ATOM 680 C VAL A 43 119.591 -6.257 -13.013 1.00 0.00 C ATOM 681 O VAL A 43 120.480 -5.483 -13.300 1.00 0.00 O ATOM 682 CB VAL A 43 119.455 -7.361 -10.762 1.00 0.00 C ATOM 683 CG1 VAL A 43 118.324 -7.927 -9.909 1.00 0.00 C ATOM 684 CG2 VAL A 43 120.020 -8.468 -11.648 1.00 0.00 C ATOM 0 H VAL A 43 116.979 -6.785 -10.962 1.00 0.00 H new ATOM 0 HA VAL A 43 119.167 -5.260 -11.166 1.00 0.00 H new ATOM 0 HB VAL A 43 120.243 -6.977 -10.114 1.00 0.00 H new ATOM 0 HG11 VAL A 43 118.705 -8.741 -9.293 1.00 0.00 H new ATOM 0 HG12 VAL A 43 117.925 -7.142 -9.267 1.00 0.00 H new ATOM 0 HG13 VAL A 43 117.532 -8.303 -10.557 1.00 0.00 H new ATOM 0 HG21 VAL A 43 120.394 -9.279 -11.023 1.00 0.00 H new ATOM 0 HG22 VAL A 43 119.235 -8.847 -12.302 1.00 0.00 H new ATOM 0 HG23 VAL A 43 120.835 -8.070 -12.252 1.00 0.00 H new ATOM 694 N ALA A 44 119.182 -7.150 -13.866 1.00 0.00 N ATOM 695 CA ALA A 44 119.815 -7.229 -15.212 1.00 0.00 C ATOM 696 C ALA A 44 121.152 -7.967 -15.091 1.00 0.00 C ATOM 697 O ALA A 44 121.469 -8.829 -15.886 1.00 0.00 O ATOM 698 CB ALA A 44 120.055 -5.817 -15.752 1.00 0.00 C ATOM 0 H ALA A 44 118.439 -7.827 -13.692 1.00 0.00 H new ATOM 0 HA ALA A 44 119.158 -7.766 -15.896 1.00 0.00 H new ATOM 0 HB1 ALA A 44 120.518 -5.878 -16.737 1.00 0.00 H new ATOM 0 HB2 ALA A 44 119.104 -5.291 -15.830 1.00 0.00 H new ATOM 0 HB3 ALA A 44 120.714 -5.275 -15.074 1.00 0.00 H new ATOM 704 N SER A 45 121.934 -7.640 -14.095 1.00 0.00 N ATOM 705 CA SER A 45 123.245 -8.329 -13.918 1.00 0.00 C ATOM 706 C SER A 45 123.044 -9.834 -14.095 1.00 0.00 C ATOM 707 O SER A 45 123.955 -10.557 -14.446 1.00 0.00 O ATOM 708 CB SER A 45 123.785 -8.050 -12.517 1.00 0.00 C ATOM 709 OG SER A 45 125.206 -8.044 -12.553 1.00 0.00 O ATOM 0 H SER A 45 121.721 -6.926 -13.398 1.00 0.00 H new ATOM 0 HA SER A 45 123.956 -7.961 -14.657 1.00 0.00 H new ATOM 0 HB2 SER A 45 123.415 -7.090 -12.157 1.00 0.00 H new ATOM 0 HB3 SER A 45 123.431 -8.810 -11.820 1.00 0.00 H new ATOM 0 HG SER A 45 125.522 -7.167 -12.856 1.00 0.00 H new ATOM 715 N ASP A 46 121.848 -10.300 -13.858 1.00 0.00 N ATOM 716 CA ASP A 46 121.552 -11.757 -14.015 1.00 0.00 C ATOM 717 C ASP A 46 121.843 -12.511 -12.710 1.00 0.00 C ATOM 718 O ASP A 46 121.509 -13.671 -12.573 1.00 0.00 O ATOM 719 CB ASP A 46 122.410 -12.341 -15.140 1.00 0.00 C ATOM 720 CG ASP A 46 121.677 -13.521 -15.781 1.00 0.00 C ATOM 721 OD1 ASP A 46 120.934 -13.291 -16.721 1.00 0.00 O ATOM 722 OD2 ASP A 46 121.870 -14.634 -15.320 1.00 0.00 O ATOM 0 H ASP A 46 121.056 -9.731 -13.560 1.00 0.00 H new ATOM 0 HA ASP A 46 120.496 -11.870 -14.260 1.00 0.00 H new ATOM 0 HB2 ASP A 46 122.616 -11.576 -15.889 1.00 0.00 H new ATOM 0 HB3 ASP A 46 123.372 -12.668 -14.746 1.00 0.00 H new ATOM 727 N GLY A 47 122.457 -11.873 -11.750 1.00 0.00 N ATOM 728 CA GLY A 47 122.751 -12.578 -10.466 1.00 0.00 C ATOM 729 C GLY A 47 121.487 -12.606 -9.604 1.00 0.00 C ATOM 730 O GLY A 47 121.161 -13.604 -8.991 1.00 0.00 O ATOM 0 H GLY A 47 122.766 -10.902 -11.797 1.00 0.00 H new ATOM 0 HA2 GLY A 47 123.092 -13.594 -10.665 1.00 0.00 H new ATOM 0 HA3 GLY A 47 123.556 -12.070 -9.935 1.00 0.00 H new ATOM 734 N VAL A 48 120.770 -11.516 -9.559 1.00 0.00 N ATOM 735 CA VAL A 48 119.520 -11.467 -8.747 1.00 0.00 C ATOM 736 C VAL A 48 119.827 -11.775 -7.281 1.00 0.00 C ATOM 737 O VAL A 48 120.814 -12.404 -6.957 1.00 0.00 O ATOM 738 CB VAL A 48 118.520 -12.491 -9.287 1.00 0.00 C ATOM 739 CG1 VAL A 48 117.205 -12.379 -8.513 1.00 0.00 C ATOM 740 CG2 VAL A 48 118.262 -12.217 -10.770 1.00 0.00 C ATOM 0 H VAL A 48 120.997 -10.653 -10.052 1.00 0.00 H new ATOM 0 HA VAL A 48 119.093 -10.466 -8.815 1.00 0.00 H new ATOM 0 HB VAL A 48 118.928 -13.495 -9.167 1.00 0.00 H new ATOM 0 HG11 VAL A 48 116.493 -13.109 -8.898 1.00 0.00 H new ATOM 0 HG12 VAL A 48 117.387 -12.573 -7.456 1.00 0.00 H new ATOM 0 HG13 VAL A 48 116.797 -11.375 -8.633 1.00 0.00 H new ATOM 0 HG21 VAL A 48 117.550 -12.946 -11.156 1.00 0.00 H new ATOM 0 HG22 VAL A 48 117.854 -11.213 -10.889 1.00 0.00 H new ATOM 0 HG23 VAL A 48 119.198 -12.296 -11.323 1.00 0.00 H new ATOM 750 N SER A 49 118.979 -11.330 -6.393 1.00 0.00 N ATOM 751 CA SER A 49 119.204 -11.586 -4.943 1.00 0.00 C ATOM 752 C SER A 49 117.953 -12.229 -4.340 1.00 0.00 C ATOM 753 O SER A 49 117.472 -13.237 -4.819 1.00 0.00 O ATOM 754 CB SER A 49 119.490 -10.263 -4.233 1.00 0.00 C ATOM 755 OG SER A 49 118.261 -9.600 -3.963 1.00 0.00 O ATOM 0 H SER A 49 118.137 -10.798 -6.612 1.00 0.00 H new ATOM 0 HA SER A 49 120.054 -12.257 -4.818 1.00 0.00 H new ATOM 0 HB2 SER A 49 120.030 -10.445 -3.304 1.00 0.00 H new ATOM 0 HB3 SER A 49 120.127 -9.634 -4.854 1.00 0.00 H new ATOM 0 HG SER A 49 118.440 -8.752 -3.506 1.00 0.00 H new ATOM 761 N SER A 50 117.422 -11.652 -3.293 1.00 0.00 N ATOM 762 CA SER A 50 116.205 -12.226 -2.657 1.00 0.00 C ATOM 763 C SER A 50 116.152 -11.780 -1.196 1.00 0.00 C ATOM 764 O SER A 50 115.421 -10.880 -0.837 1.00 0.00 O ATOM 765 CB SER A 50 116.259 -13.753 -2.720 1.00 0.00 C ATOM 766 OG SER A 50 115.593 -14.293 -1.586 1.00 0.00 O ATOM 0 H SER A 50 117.782 -10.806 -2.852 1.00 0.00 H new ATOM 0 HA SER A 50 115.318 -11.878 -3.185 1.00 0.00 H new ATOM 0 HB2 SER A 50 115.787 -14.108 -3.636 1.00 0.00 H new ATOM 0 HB3 SER A 50 117.295 -14.091 -2.743 1.00 0.00 H new ATOM 0 HG SER A 50 115.997 -15.154 -1.348 1.00 0.00 H new ATOM 772 N GLU A 51 116.926 -12.405 -0.352 1.00 0.00 N ATOM 773 CA GLU A 51 116.927 -12.020 1.086 1.00 0.00 C ATOM 774 C GLU A 51 117.608 -10.659 1.257 1.00 0.00 C ATOM 775 O GLU A 51 117.318 -9.925 2.179 1.00 0.00 O ATOM 776 CB GLU A 51 117.686 -13.074 1.894 1.00 0.00 C ATOM 777 CG GLU A 51 117.033 -14.442 1.691 1.00 0.00 C ATOM 778 CD GLU A 51 117.477 -15.027 0.349 1.00 0.00 C ATOM 779 OE1 GLU A 51 118.471 -14.557 -0.180 1.00 0.00 O ATOM 780 OE2 GLU A 51 116.815 -15.934 -0.128 1.00 0.00 O ATOM 0 H GLU A 51 117.558 -13.167 -0.597 1.00 0.00 H new ATOM 0 HA GLU A 51 115.899 -11.956 1.443 1.00 0.00 H new ATOM 0 HB2 GLU A 51 118.729 -13.107 1.579 1.00 0.00 H new ATOM 0 HB3 GLU A 51 117.680 -12.810 2.952 1.00 0.00 H new ATOM 0 HG2 GLU A 51 117.312 -15.114 2.503 1.00 0.00 H new ATOM 0 HG3 GLU A 51 115.948 -14.346 1.716 1.00 0.00 H new ATOM 787 N GLU A 52 118.519 -10.317 0.387 1.00 0.00 N ATOM 788 CA GLU A 52 119.213 -9.004 0.524 1.00 0.00 C ATOM 789 C GLU A 52 118.251 -7.867 0.173 1.00 0.00 C ATOM 790 O GLU A 52 118.074 -6.942 0.940 1.00 0.00 O ATOM 791 CB GLU A 52 120.414 -8.967 -0.415 1.00 0.00 C ATOM 792 CG GLU A 52 121.678 -9.367 0.351 1.00 0.00 C ATOM 793 CD GLU A 52 121.982 -8.315 1.419 1.00 0.00 C ATOM 794 OE1 GLU A 52 121.568 -7.181 1.242 1.00 0.00 O ATOM 795 OE2 GLU A 52 122.625 -8.661 2.397 1.00 0.00 O ATOM 0 H GLU A 52 118.812 -10.885 -0.408 1.00 0.00 H new ATOM 0 HA GLU A 52 119.550 -8.880 1.553 1.00 0.00 H new ATOM 0 HB2 GLU A 52 120.254 -9.646 -1.253 1.00 0.00 H new ATOM 0 HB3 GLU A 52 120.531 -7.967 -0.833 1.00 0.00 H new ATOM 0 HG2 GLU A 52 121.541 -10.343 0.816 1.00 0.00 H new ATOM 0 HG3 GLU A 52 122.519 -9.457 -0.336 1.00 0.00 H new ATOM 802 N LYS A 53 117.607 -7.926 -0.965 1.00 0.00 N ATOM 803 CA LYS A 53 116.649 -6.836 -1.307 1.00 0.00 C ATOM 804 C LYS A 53 115.616 -6.778 -0.196 1.00 0.00 C ATOM 805 O LYS A 53 115.272 -5.726 0.306 1.00 0.00 O ATOM 806 CB LYS A 53 115.943 -7.126 -2.636 1.00 0.00 C ATOM 807 CG LYS A 53 114.736 -6.188 -2.787 1.00 0.00 C ATOM 808 CD LYS A 53 113.453 -6.865 -2.278 1.00 0.00 C ATOM 809 CE LYS A 53 113.198 -8.169 -3.038 1.00 0.00 C ATOM 810 NZ LYS A 53 111.730 -8.369 -3.199 1.00 0.00 N ATOM 0 H LYS A 53 117.701 -8.667 -1.659 1.00 0.00 H new ATOM 0 HA LYS A 53 117.183 -5.891 -1.408 1.00 0.00 H new ATOM 0 HB2 LYS A 53 116.634 -6.984 -3.467 1.00 0.00 H new ATOM 0 HB3 LYS A 53 115.616 -8.165 -2.668 1.00 0.00 H new ATOM 0 HG2 LYS A 53 114.913 -5.268 -2.230 1.00 0.00 H new ATOM 0 HG3 LYS A 53 114.615 -5.909 -3.834 1.00 0.00 H new ATOM 0 HD2 LYS A 53 113.542 -7.070 -1.211 1.00 0.00 H new ATOM 0 HD3 LYS A 53 112.605 -6.192 -2.404 1.00 0.00 H new ATOM 0 HE2 LYS A 53 113.681 -8.134 -4.015 1.00 0.00 H new ATOM 0 HE3 LYS A 53 113.634 -9.009 -2.497 1.00 0.00 H new ATOM 0 HZ1 LYS A 53 111.443 -9.242 -2.712 1.00 0.00 H new ATOM 0 HZ2 LYS A 53 111.222 -7.560 -2.788 1.00 0.00 H new ATOM 0 HZ3 LYS A 53 111.499 -8.445 -4.210 1.00 0.00 H new ATOM 824 N GLN A 54 115.129 -7.920 0.199 1.00 0.00 N ATOM 825 CA GLN A 54 114.124 -7.963 1.289 1.00 0.00 C ATOM 826 C GLN A 54 114.677 -7.177 2.480 1.00 0.00 C ATOM 827 O GLN A 54 113.948 -6.525 3.202 1.00 0.00 O ATOM 828 CB GLN A 54 113.863 -9.429 1.664 1.00 0.00 C ATOM 829 CG GLN A 54 114.422 -9.738 3.055 1.00 0.00 C ATOM 830 CD GLN A 54 113.548 -9.072 4.120 1.00 0.00 C ATOM 831 OE1 GLN A 54 112.352 -9.284 4.160 1.00 0.00 O ATOM 832 NE2 GLN A 54 114.098 -8.270 4.990 1.00 0.00 N ATOM 0 H GLN A 54 115.386 -8.827 -0.189 1.00 0.00 H new ATOM 0 HA GLN A 54 113.180 -7.515 0.977 1.00 0.00 H new ATOM 0 HB2 GLN A 54 112.792 -9.630 1.644 1.00 0.00 H new ATOM 0 HB3 GLN A 54 114.324 -10.086 0.927 1.00 0.00 H new ATOM 0 HG2 GLN A 54 114.450 -10.816 3.215 1.00 0.00 H new ATOM 0 HG3 GLN A 54 115.447 -9.377 3.134 1.00 0.00 H new ATOM 0 HE21 GLN A 54 115.102 -8.092 4.956 1.00 0.00 H new ATOM 0 HE22 GLN A 54 113.524 -7.821 5.704 1.00 0.00 H new ATOM 841 N LYS A 55 115.970 -7.212 2.671 1.00 0.00 N ATOM 842 CA LYS A 55 116.575 -6.442 3.792 1.00 0.00 C ATOM 843 C LYS A 55 116.398 -4.957 3.482 1.00 0.00 C ATOM 844 O LYS A 55 116.019 -4.172 4.329 1.00 0.00 O ATOM 845 CB LYS A 55 118.066 -6.779 3.907 1.00 0.00 C ATOM 846 CG LYS A 55 118.345 -7.425 5.266 1.00 0.00 C ATOM 847 CD LYS A 55 117.777 -8.846 5.283 1.00 0.00 C ATOM 848 CE LYS A 55 118.094 -9.508 6.625 1.00 0.00 C ATOM 849 NZ LYS A 55 116.972 -9.267 7.575 1.00 0.00 N ATOM 0 H LYS A 55 116.630 -7.740 2.100 1.00 0.00 H new ATOM 0 HA LYS A 55 116.092 -6.694 4.736 1.00 0.00 H new ATOM 0 HB2 LYS A 55 118.359 -7.456 3.105 1.00 0.00 H new ATOM 0 HB3 LYS A 55 118.663 -5.874 3.794 1.00 0.00 H new ATOM 0 HG2 LYS A 55 119.418 -7.449 5.456 1.00 0.00 H new ATOM 0 HG3 LYS A 55 117.894 -6.832 6.062 1.00 0.00 H new ATOM 0 HD2 LYS A 55 116.699 -8.820 5.124 1.00 0.00 H new ATOM 0 HD3 LYS A 55 118.205 -9.430 4.468 1.00 0.00 H new ATOM 0 HE2 LYS A 55 118.245 -10.579 6.488 1.00 0.00 H new ATOM 0 HE3 LYS A 55 119.022 -9.105 7.031 1.00 0.00 H new ATOM 0 HZ1 LYS A 55 117.187 -9.717 8.488 1.00 0.00 H new ATOM 0 HZ2 LYS A 55 116.849 -8.244 7.714 1.00 0.00 H new ATOM 0 HZ3 LYS A 55 116.096 -9.672 7.187 1.00 0.00 H new ATOM 863 N MET A 56 116.652 -4.574 2.260 1.00 0.00 N ATOM 864 CA MET A 56 116.481 -3.148 1.873 1.00 0.00 C ATOM 865 C MET A 56 115.073 -2.698 2.274 1.00 0.00 C ATOM 866 O MET A 56 114.859 -1.570 2.667 1.00 0.00 O ATOM 867 CB MET A 56 116.647 -3.016 0.353 1.00 0.00 C ATOM 868 CG MET A 56 117.633 -1.892 0.026 1.00 0.00 C ATOM 869 SD MET A 56 116.821 -0.290 0.248 1.00 0.00 S ATOM 870 CE MET A 56 118.284 0.747 0.004 1.00 0.00 C ATOM 0 H MET A 56 116.971 -5.190 1.513 1.00 0.00 H new ATOM 0 HA MET A 56 117.225 -2.529 2.374 1.00 0.00 H new ATOM 0 HB2 MET A 56 117.005 -3.957 -0.064 1.00 0.00 H new ATOM 0 HB3 MET A 56 115.682 -2.809 -0.109 1.00 0.00 H new ATOM 0 HG2 MET A 56 118.507 -1.961 0.674 1.00 0.00 H new ATOM 0 HG3 MET A 56 117.988 -1.992 -1.000 1.00 0.00 H new ATOM 0 HE1 MET A 56 118.266 1.574 0.714 1.00 0.00 H new ATOM 0 HE2 MET A 56 119.183 0.151 0.163 1.00 0.00 H new ATOM 0 HE3 MET A 56 118.285 1.141 -1.012 1.00 0.00 H new ATOM 880 N ILE A 57 114.109 -3.576 2.188 1.00 0.00 N ATOM 881 CA ILE A 57 112.723 -3.191 2.578 1.00 0.00 C ATOM 882 C ILE A 57 112.695 -2.917 4.084 1.00 0.00 C ATOM 883 O ILE A 57 112.059 -1.989 4.543 1.00 0.00 O ATOM 884 CB ILE A 57 111.750 -4.324 2.231 1.00 0.00 C ATOM 885 CG1 ILE A 57 112.112 -4.906 0.861 1.00 0.00 C ATOM 886 CG2 ILE A 57 110.316 -3.779 2.189 1.00 0.00 C ATOM 887 CD1 ILE A 57 111.183 -6.079 0.542 1.00 0.00 C ATOM 0 H ILE A 57 114.221 -4.537 1.866 1.00 0.00 H new ATOM 0 HA ILE A 57 112.420 -2.296 2.036 1.00 0.00 H new ATOM 0 HB ILE A 57 111.819 -5.103 2.990 1.00 0.00 H new ATOM 0 HG12 ILE A 57 112.022 -4.138 0.093 1.00 0.00 H new ATOM 0 HG13 ILE A 57 113.150 -5.239 0.859 1.00 0.00 H new ATOM 0 HG21 ILE A 57 109.627 -4.587 1.942 1.00 0.00 H new ATOM 0 HG22 ILE A 57 110.056 -3.365 3.163 1.00 0.00 H new ATOM 0 HG23 ILE A 57 110.246 -2.998 1.432 1.00 0.00 H new ATOM 0 HD11 ILE A 57 111.441 -6.493 -0.433 1.00 0.00 H new ATOM 0 HD12 ILE A 57 111.295 -6.850 1.305 1.00 0.00 H new ATOM 0 HD13 ILE A 57 110.150 -5.731 0.527 1.00 0.00 H new ATOM 899 N GLY A 58 113.397 -3.705 4.856 1.00 0.00 N ATOM 900 CA GLY A 58 113.427 -3.467 6.328 1.00 0.00 C ATOM 901 C GLY A 58 114.127 -2.132 6.585 1.00 0.00 C ATOM 902 O GLY A 58 113.652 -1.289 7.332 1.00 0.00 O ATOM 0 H GLY A 58 113.948 -4.500 4.532 1.00 0.00 H new ATOM 0 HA2 GLY A 58 112.414 -3.448 6.730 1.00 0.00 H new ATOM 0 HA3 GLY A 58 113.955 -4.276 6.833 1.00 0.00 H new ATOM 906 N PHE A 59 115.244 -1.919 5.945 1.00 0.00 N ATOM 907 CA PHE A 59 115.959 -0.633 6.126 1.00 0.00 C ATOM 908 C PHE A 59 114.968 0.481 5.814 1.00 0.00 C ATOM 909 O PHE A 59 114.948 1.515 6.453 1.00 0.00 O ATOM 910 CB PHE A 59 117.145 -0.571 5.158 1.00 0.00 C ATOM 911 CG PHE A 59 117.186 0.779 4.487 1.00 0.00 C ATOM 912 CD1 PHE A 59 117.737 1.874 5.157 1.00 0.00 C ATOM 913 CD2 PHE A 59 116.668 0.935 3.198 1.00 0.00 C ATOM 914 CE1 PHE A 59 117.770 3.127 4.538 1.00 0.00 C ATOM 915 CE2 PHE A 59 116.698 2.187 2.578 1.00 0.00 C ATOM 916 CZ PHE A 59 117.248 3.283 3.247 1.00 0.00 C ATOM 0 H PHE A 59 115.688 -2.580 5.308 1.00 0.00 H new ATOM 0 HA PHE A 59 116.339 -0.532 7.142 1.00 0.00 H new ATOM 0 HB2 PHE A 59 118.076 -0.748 5.697 1.00 0.00 H new ATOM 0 HB3 PHE A 59 117.056 -1.357 4.408 1.00 0.00 H new ATOM 0 HD1 PHE A 59 118.137 1.753 6.153 1.00 0.00 H new ATOM 0 HD2 PHE A 59 116.244 0.087 2.681 1.00 0.00 H new ATOM 0 HE1 PHE A 59 118.197 3.974 5.054 1.00 0.00 H new ATOM 0 HE2 PHE A 59 116.296 2.307 1.583 1.00 0.00 H new ATOM 0 HZ PHE A 59 117.271 4.251 2.769 1.00 0.00 H new ATOM 926 N LEU A 60 114.123 0.255 4.849 1.00 0.00 N ATOM 927 CA LEU A 60 113.100 1.270 4.500 1.00 0.00 C ATOM 928 C LEU A 60 112.277 1.553 5.752 1.00 0.00 C ATOM 929 O LEU A 60 112.009 2.687 6.091 1.00 0.00 O ATOM 930 CB LEU A 60 112.193 0.706 3.400 1.00 0.00 C ATOM 931 CG LEU A 60 112.230 1.587 2.140 1.00 0.00 C ATOM 932 CD1 LEU A 60 113.663 2.049 1.837 1.00 0.00 C ATOM 933 CD2 LEU A 60 111.720 0.761 0.961 1.00 0.00 C ATOM 0 H LEU A 60 114.099 -0.595 4.285 1.00 0.00 H new ATOM 0 HA LEU A 60 113.567 2.187 4.141 1.00 0.00 H new ATOM 0 HB2 LEU A 60 112.509 -0.306 3.148 1.00 0.00 H new ATOM 0 HB3 LEU A 60 111.170 0.638 3.769 1.00 0.00 H new ATOM 0 HG LEU A 60 111.608 2.467 2.302 1.00 0.00 H new ATOM 0 HD11 LEU A 60 113.663 2.670 0.942 1.00 0.00 H new ATOM 0 HD12 LEU A 60 114.045 2.626 2.679 1.00 0.00 H new ATOM 0 HD13 LEU A 60 114.299 1.179 1.675 1.00 0.00 H new ATOM 0 HD21 LEU A 60 111.738 1.369 0.056 1.00 0.00 H new ATOM 0 HD22 LEU A 60 112.359 -0.112 0.825 1.00 0.00 H new ATOM 0 HD23 LEU A 60 110.699 0.436 1.159 1.00 0.00 H new ATOM 945 N ARG A 61 111.890 0.528 6.459 1.00 0.00 N ATOM 946 CA ARG A 61 111.099 0.750 7.695 1.00 0.00 C ATOM 947 C ARG A 61 111.795 1.831 8.513 1.00 0.00 C ATOM 948 O ARG A 61 111.161 2.640 9.160 1.00 0.00 O ATOM 949 CB ARG A 61 111.031 -0.548 8.502 1.00 0.00 C ATOM 950 CG ARG A 61 110.459 -1.662 7.623 1.00 0.00 C ATOM 951 CD ARG A 61 110.568 -3.000 8.357 1.00 0.00 C ATOM 952 NE ARG A 61 110.308 -4.113 7.401 1.00 0.00 N ATOM 953 CZ ARG A 61 110.038 -5.308 7.850 1.00 0.00 C ATOM 954 NH1 ARG A 61 109.996 -5.528 9.135 1.00 0.00 N ATOM 955 NH2 ARG A 61 109.810 -6.283 7.013 1.00 0.00 N ATOM 0 H ARG A 61 112.087 -0.447 6.234 1.00 0.00 H new ATOM 0 HA ARG A 61 110.084 1.060 7.446 1.00 0.00 H new ATOM 0 HB2 ARG A 61 112.025 -0.822 8.855 1.00 0.00 H new ATOM 0 HB3 ARG A 61 110.406 -0.409 9.384 1.00 0.00 H new ATOM 0 HG2 ARG A 61 109.417 -1.451 7.383 1.00 0.00 H new ATOM 0 HG3 ARG A 61 111.001 -1.708 6.678 1.00 0.00 H new ATOM 0 HD2 ARG A 61 111.560 -3.107 8.795 1.00 0.00 H new ATOM 0 HD3 ARG A 61 109.852 -3.036 9.178 1.00 0.00 H new ATOM 0 HE ARG A 61 110.341 -3.941 6.396 1.00 0.00 H new ATOM 0 HH11 ARG A 61 110.174 -4.766 9.789 1.00 0.00 H new ATOM 0 HH12 ARG A 61 109.785 -6.462 9.486 1.00 0.00 H new ATOM 0 HH21 ARG A 61 109.843 -6.111 6.008 1.00 0.00 H new ATOM 0 HH22 ARG A 61 109.599 -7.217 7.364 1.00 0.00 H new ATOM 969 N SER A 62 113.100 1.864 8.475 1.00 0.00 N ATOM 970 CA SER A 62 113.834 2.910 9.236 1.00 0.00 C ATOM 971 C SER A 62 114.533 3.867 8.260 1.00 0.00 C ATOM 972 O SER A 62 115.258 4.748 8.669 1.00 0.00 O ATOM 973 CB SER A 62 114.873 2.245 10.139 1.00 0.00 C ATOM 974 OG SER A 62 115.706 3.244 10.713 1.00 0.00 O ATOM 0 H SER A 62 113.686 1.214 7.951 1.00 0.00 H new ATOM 0 HA SER A 62 113.130 3.475 9.847 1.00 0.00 H new ATOM 0 HB2 SER A 62 114.377 1.674 10.924 1.00 0.00 H new ATOM 0 HB3 SER A 62 115.474 1.541 9.564 1.00 0.00 H new ATOM 0 HG SER A 62 115.560 4.096 10.252 1.00 0.00 H new ATOM 980 N SER A 63 114.336 3.692 6.974 1.00 0.00 N ATOM 981 CA SER A 63 115.012 4.584 5.976 1.00 0.00 C ATOM 982 C SER A 63 115.078 6.019 6.490 1.00 0.00 C ATOM 983 O SER A 63 114.540 6.347 7.523 1.00 0.00 O ATOM 984 CB SER A 63 114.252 4.570 4.649 1.00 0.00 C ATOM 985 OG SER A 63 112.910 4.166 4.874 1.00 0.00 O ATOM 0 H SER A 63 113.737 2.971 6.572 1.00 0.00 H new ATOM 0 HA SER A 63 116.024 4.208 5.825 1.00 0.00 H new ATOM 0 HB2 SER A 63 114.273 5.561 4.196 1.00 0.00 H new ATOM 0 HB3 SER A 63 114.735 3.889 3.949 1.00 0.00 H new ATOM 0 HG SER A 63 112.369 4.372 4.083 1.00 0.00 H new ATOM 991 N GLU A 64 115.738 6.878 5.760 1.00 0.00 N ATOM 992 CA GLU A 64 115.851 8.297 6.189 1.00 0.00 C ATOM 993 C GLU A 64 114.464 8.942 6.192 1.00 0.00 C ATOM 994 O GLU A 64 114.277 10.023 6.714 1.00 0.00 O ATOM 995 CB GLU A 64 116.775 9.049 5.229 1.00 0.00 C ATOM 996 CG GLU A 64 116.923 10.505 5.687 1.00 0.00 C ATOM 997 CD GLU A 64 118.408 10.864 5.789 1.00 0.00 C ATOM 998 OE1 GLU A 64 119.114 10.180 6.511 1.00 0.00 O ATOM 999 OE2 GLU A 64 118.812 11.816 5.143 1.00 0.00 O ATOM 0 H GLU A 64 116.205 6.654 4.881 1.00 0.00 H new ATOM 0 HA GLU A 64 116.268 8.342 7.195 1.00 0.00 H new ATOM 0 HB2 GLU A 64 117.752 8.567 5.197 1.00 0.00 H new ATOM 0 HB3 GLU A 64 116.370 9.015 4.218 1.00 0.00 H new ATOM 0 HG2 GLU A 64 116.425 11.171 4.982 1.00 0.00 H new ATOM 0 HG3 GLU A 64 116.438 10.644 6.653 1.00 0.00 H new ATOM 1006 N GLU A 65 113.483 8.285 5.629 1.00 0.00 N ATOM 1007 CA GLU A 65 112.111 8.868 5.628 1.00 0.00 C ATOM 1008 C GLU A 65 111.825 9.406 7.030 1.00 0.00 C ATOM 1009 O GLU A 65 110.893 10.153 7.251 1.00 0.00 O ATOM 1010 CB GLU A 65 111.088 7.783 5.273 1.00 0.00 C ATOM 1011 CG GLU A 65 110.973 7.651 3.749 1.00 0.00 C ATOM 1012 CD GLU A 65 111.073 6.178 3.349 1.00 0.00 C ATOM 1013 OE1 GLU A 65 112.178 5.661 3.335 1.00 0.00 O ATOM 1014 OE2 GLU A 65 110.042 5.592 3.060 1.00 0.00 O ATOM 0 H GLU A 65 113.573 7.377 5.173 1.00 0.00 H new ATOM 0 HA GLU A 65 112.040 9.669 4.892 1.00 0.00 H new ATOM 0 HB2 GLU A 65 111.390 6.830 5.707 1.00 0.00 H new ATOM 0 HB3 GLU A 65 110.117 8.034 5.699 1.00 0.00 H new ATOM 0 HG2 GLU A 65 110.024 8.066 3.409 1.00 0.00 H new ATOM 0 HG3 GLU A 65 111.764 8.224 3.264 1.00 0.00 H new ATOM 1021 N LEU A 66 112.644 9.031 7.972 1.00 0.00 N ATOM 1022 CA LEU A 66 112.465 9.510 9.374 1.00 0.00 C ATOM 1023 C LEU A 66 112.278 11.024 9.345 1.00 0.00 C ATOM 1024 O LEU A 66 111.744 11.619 10.260 1.00 0.00 O ATOM 1025 CB LEU A 66 113.716 9.171 10.199 1.00 0.00 C ATOM 1026 CG LEU A 66 114.324 7.857 9.710 1.00 0.00 C ATOM 1027 CD1 LEU A 66 115.421 7.406 10.678 1.00 0.00 C ATOM 1028 CD2 LEU A 66 113.234 6.786 9.640 1.00 0.00 C ATOM 0 H LEU A 66 113.438 8.407 7.831 1.00 0.00 H new ATOM 0 HA LEU A 66 111.597 9.028 9.825 1.00 0.00 H new ATOM 0 HB2 LEU A 66 114.448 9.974 10.112 1.00 0.00 H new ATOM 0 HB3 LEU A 66 113.455 9.090 11.254 1.00 0.00 H new ATOM 0 HG LEU A 66 114.754 8.004 8.719 1.00 0.00 H new ATOM 0 HD11 LEU A 66 115.853 6.469 10.327 1.00 0.00 H new ATOM 0 HD12 LEU A 66 116.199 8.168 10.727 1.00 0.00 H new ATOM 0 HD13 LEU A 66 114.993 7.260 11.670 1.00 0.00 H new ATOM 0 HD21 LEU A 66 113.667 5.848 9.291 1.00 0.00 H new ATOM 0 HD22 LEU A 66 112.803 6.640 10.630 1.00 0.00 H new ATOM 0 HD23 LEU A 66 112.454 7.105 8.948 1.00 0.00 H new ATOM 1040 N LYS A 67 112.722 11.644 8.291 1.00 0.00 N ATOM 1041 CA LYS A 67 112.591 13.121 8.168 1.00 0.00 C ATOM 1042 C LYS A 67 111.202 13.473 7.632 1.00 0.00 C ATOM 1043 O LYS A 67 110.517 14.306 8.187 1.00 0.00 O ATOM 1044 CB LYS A 67 113.651 13.635 7.197 1.00 0.00 C ATOM 1045 CG LYS A 67 113.837 12.616 6.067 1.00 0.00 C ATOM 1046 CD LYS A 67 113.732 13.315 4.716 1.00 0.00 C ATOM 1047 CE LYS A 67 113.542 12.265 3.621 1.00 0.00 C ATOM 1048 NZ LYS A 67 114.811 11.508 3.426 1.00 0.00 N ATOM 0 H LYS A 67 113.175 11.186 7.500 1.00 0.00 H new ATOM 0 HA LYS A 67 112.727 13.582 9.146 1.00 0.00 H new ATOM 0 HB2 LYS A 67 113.349 14.599 6.787 1.00 0.00 H new ATOM 0 HB3 LYS A 67 114.594 13.792 7.720 1.00 0.00 H new ATOM 0 HG2 LYS A 67 114.808 12.130 6.160 1.00 0.00 H new ATOM 0 HG3 LYS A 67 113.081 11.835 6.142 1.00 0.00 H new ATOM 0 HD2 LYS A 67 112.894 14.012 4.718 1.00 0.00 H new ATOM 0 HD3 LYS A 67 114.632 13.899 4.524 1.00 0.00 H new ATOM 0 HE2 LYS A 67 112.738 11.582 3.894 1.00 0.00 H new ATOM 0 HE3 LYS A 67 113.248 12.747 2.689 1.00 0.00 H new ATOM 0 HZ1 LYS A 67 114.817 11.078 2.479 1.00 0.00 H new ATOM 0 HZ2 LYS A 67 115.619 12.156 3.517 1.00 0.00 H new ATOM 0 HZ3 LYS A 67 114.884 10.761 4.146 1.00 0.00 H new ATOM 1062 N VAL A 68 110.788 12.852 6.552 1.00 0.00 N ATOM 1063 CA VAL A 68 109.446 13.156 5.974 1.00 0.00 C ATOM 1064 C VAL A 68 109.576 14.348 5.026 1.00 0.00 C ATOM 1065 O VAL A 68 108.785 15.265 5.077 1.00 0.00 O ATOM 1066 CB VAL A 68 108.466 13.507 7.108 1.00 0.00 C ATOM 1067 CG1 VAL A 68 107.022 13.445 6.602 1.00 0.00 C ATOM 1068 CG2 VAL A 68 108.640 12.516 8.267 1.00 0.00 C ATOM 0 H VAL A 68 111.325 12.147 6.047 1.00 0.00 H new ATOM 0 HA VAL A 68 109.071 12.289 5.431 1.00 0.00 H new ATOM 0 HB VAL A 68 108.680 14.519 7.453 1.00 0.00 H new ATOM 0 HG11 VAL A 68 106.341 13.696 7.415 1.00 0.00 H new ATOM 0 HG12 VAL A 68 106.891 14.156 5.787 1.00 0.00 H new ATOM 0 HG13 VAL A 68 106.805 12.439 6.244 1.00 0.00 H new ATOM 0 HG21 VAL A 68 107.945 12.767 9.068 1.00 0.00 H new ATOM 0 HG22 VAL A 68 108.437 11.505 7.915 1.00 0.00 H new ATOM 0 HG23 VAL A 68 109.662 12.571 8.643 1.00 0.00 H new ATOM 1078 N PHE A 69 110.566 14.351 4.158 1.00 0.00 N ATOM 1079 CA PHE A 69 110.718 15.518 3.230 1.00 0.00 C ATOM 1080 C PHE A 69 111.815 15.294 2.176 1.00 0.00 C ATOM 1081 O PHE A 69 111.549 15.313 0.990 1.00 0.00 O ATOM 1082 CB PHE A 69 111.088 16.767 4.039 1.00 0.00 C ATOM 1083 CG PHE A 69 109.891 17.259 4.815 1.00 0.00 C ATOM 1084 CD1 PHE A 69 108.833 17.889 4.149 1.00 0.00 C ATOM 1085 CD2 PHE A 69 109.840 17.083 6.203 1.00 0.00 C ATOM 1086 CE1 PHE A 69 107.724 18.345 4.873 1.00 0.00 C ATOM 1087 CE2 PHE A 69 108.731 17.537 6.926 1.00 0.00 C ATOM 1088 CZ PHE A 69 107.673 18.169 6.261 1.00 0.00 C ATOM 0 H PHE A 69 111.261 13.611 4.054 1.00 0.00 H new ATOM 0 HA PHE A 69 109.765 15.641 2.715 1.00 0.00 H new ATOM 0 HB2 PHE A 69 111.905 16.537 4.723 1.00 0.00 H new ATOM 0 HB3 PHE A 69 111.444 17.550 3.370 1.00 0.00 H new ATOM 0 HD1 PHE A 69 108.872 18.023 3.078 1.00 0.00 H new ATOM 0 HD2 PHE A 69 110.657 16.597 6.716 1.00 0.00 H new ATOM 0 HE1 PHE A 69 106.908 18.833 4.360 1.00 0.00 H new ATOM 0 HE2 PHE A 69 108.691 17.400 7.997 1.00 0.00 H new ATOM 0 HZ PHE A 69 106.818 18.521 6.819 1.00 0.00 H new ATOM 1098 N ASP A 70 113.050 15.139 2.582 1.00 0.00 N ATOM 1099 CA ASP A 70 114.147 14.984 1.576 1.00 0.00 C ATOM 1100 C ASP A 70 113.758 13.961 0.508 1.00 0.00 C ATOM 1101 O ASP A 70 114.088 12.789 0.583 1.00 0.00 O ATOM 1102 CB ASP A 70 115.442 14.548 2.262 1.00 0.00 C ATOM 1103 CG ASP A 70 116.612 14.717 1.292 1.00 0.00 C ATOM 1104 OD1 ASP A 70 116.407 14.518 0.106 1.00 0.00 O ATOM 1105 OD2 ASP A 70 117.695 15.043 1.751 1.00 0.00 O ATOM 0 H ASP A 70 113.346 15.113 3.558 1.00 0.00 H new ATOM 0 HA ASP A 70 114.306 15.950 1.096 1.00 0.00 H new ATOM 0 HB2 ASP A 70 115.610 15.144 3.159 1.00 0.00 H new ATOM 0 HB3 ASP A 70 115.366 13.508 2.580 1.00 0.00 H new ATOM 1110 N THR A 71 113.070 14.417 -0.502 1.00 0.00 N ATOM 1111 CA THR A 71 112.657 13.513 -1.607 1.00 0.00 C ATOM 1112 C THR A 71 113.905 12.996 -2.320 1.00 0.00 C ATOM 1113 O THR A 71 113.949 11.877 -2.789 1.00 0.00 O ATOM 1114 CB THR A 71 111.798 14.301 -2.599 1.00 0.00 C ATOM 1115 OG1 THR A 71 112.362 14.195 -3.898 1.00 0.00 O ATOM 1116 CG2 THR A 71 111.756 15.773 -2.185 1.00 0.00 C ATOM 0 H THR A 71 112.774 15.387 -0.608 1.00 0.00 H new ATOM 0 HA THR A 71 112.086 12.674 -1.210 1.00 0.00 H new ATOM 0 HB THR A 71 110.786 13.896 -2.603 1.00 0.00 H new ATOM 0 HG1 THR A 71 112.157 15.005 -4.411 1.00 0.00 H new ATOM 0 HG21 THR A 71 111.144 16.333 -2.892 1.00 0.00 H new ATOM 0 HG22 THR A 71 111.326 15.858 -1.187 1.00 0.00 H new ATOM 0 HG23 THR A 71 112.768 16.179 -2.180 1.00 0.00 H new ATOM 1124 N ALA A 72 114.922 13.810 -2.404 1.00 0.00 N ATOM 1125 CA ALA A 72 116.170 13.374 -3.085 1.00 0.00 C ATOM 1126 C ALA A 72 116.765 12.183 -2.336 1.00 0.00 C ATOM 1127 O ALA A 72 117.383 11.319 -2.921 1.00 0.00 O ATOM 1128 CB ALA A 72 117.176 14.527 -3.095 1.00 0.00 C ATOM 0 H ALA A 72 114.941 14.759 -2.029 1.00 0.00 H new ATOM 0 HA ALA A 72 115.944 13.083 -4.111 1.00 0.00 H new ATOM 0 HB1 ALA A 72 118.091 14.207 -3.594 1.00 0.00 H new ATOM 0 HB2 ALA A 72 116.750 15.377 -3.628 1.00 0.00 H new ATOM 0 HB3 ALA A 72 117.405 14.819 -2.070 1.00 0.00 H new ATOM 1134 N GLU A 73 116.581 12.133 -1.045 1.00 0.00 N ATOM 1135 CA GLU A 73 117.134 10.997 -0.254 1.00 0.00 C ATOM 1136 C GLU A 73 116.350 9.722 -0.572 1.00 0.00 C ATOM 1137 O GLU A 73 116.899 8.638 -0.627 1.00 0.00 O ATOM 1138 CB GLU A 73 117.008 11.310 1.237 1.00 0.00 C ATOM 1139 CG GLU A 73 118.117 12.279 1.653 1.00 0.00 C ATOM 1140 CD GLU A 73 119.373 11.489 2.022 1.00 0.00 C ATOM 1141 OE1 GLU A 73 119.325 10.762 3.001 1.00 0.00 O ATOM 1142 OE2 GLU A 73 120.363 11.625 1.321 1.00 0.00 O ATOM 0 H GLU A 73 116.071 12.831 -0.503 1.00 0.00 H new ATOM 0 HA GLU A 73 118.183 10.852 -0.511 1.00 0.00 H new ATOM 0 HB2 GLU A 73 116.032 11.747 1.446 1.00 0.00 H new ATOM 0 HB3 GLU A 73 117.077 10.391 1.819 1.00 0.00 H new ATOM 0 HG2 GLU A 73 118.335 12.970 0.839 1.00 0.00 H new ATOM 0 HG3 GLU A 73 117.790 12.880 2.502 1.00 0.00 H new ATOM 1149 N VAL A 74 115.068 9.841 -0.786 1.00 0.00 N ATOM 1150 CA VAL A 74 114.254 8.633 -1.102 1.00 0.00 C ATOM 1151 C VAL A 74 114.693 8.080 -2.463 1.00 0.00 C ATOM 1152 O VAL A 74 115.215 6.977 -2.573 1.00 0.00 O ATOM 1153 CB VAL A 74 112.776 9.022 -1.149 1.00 0.00 C ATOM 1154 CG1 VAL A 74 111.910 7.770 -0.997 1.00 0.00 C ATOM 1155 CG2 VAL A 74 112.457 9.997 -0.008 1.00 0.00 C ATOM 0 H VAL A 74 114.550 10.719 -0.756 1.00 0.00 H new ATOM 0 HA VAL A 74 114.399 7.870 -0.337 1.00 0.00 H new ATOM 0 HB VAL A 74 112.565 9.501 -2.105 1.00 0.00 H new ATOM 0 HG11 VAL A 74 110.857 8.050 -1.031 1.00 0.00 H new ATOM 0 HG12 VAL A 74 112.127 7.076 -1.809 1.00 0.00 H new ATOM 0 HG13 VAL A 74 112.128 7.291 -0.043 1.00 0.00 H new ATOM 0 HG21 VAL A 74 111.403 10.270 -0.047 1.00 0.00 H new ATOM 0 HG22 VAL A 74 112.673 9.521 0.948 1.00 0.00 H new ATOM 0 HG23 VAL A 74 113.068 10.893 -0.114 1.00 0.00 H new ATOM 1165 N ILE A 75 114.511 8.843 -3.506 1.00 0.00 N ATOM 1166 CA ILE A 75 114.948 8.364 -4.840 1.00 0.00 C ATOM 1167 C ILE A 75 116.404 7.938 -4.721 1.00 0.00 C ATOM 1168 O ILE A 75 116.897 7.160 -5.499 1.00 0.00 O ATOM 1169 CB ILE A 75 114.822 9.477 -5.884 1.00 0.00 C ATOM 1170 CG1 ILE A 75 115.399 10.782 -5.321 1.00 0.00 C ATOM 1171 CG2 ILE A 75 113.347 9.672 -6.251 1.00 0.00 C ATOM 1172 CD1 ILE A 75 116.554 11.256 -6.208 1.00 0.00 C ATOM 0 H ILE A 75 114.082 9.768 -3.490 1.00 0.00 H new ATOM 0 HA ILE A 75 114.321 7.532 -5.160 1.00 0.00 H new ATOM 0 HB ILE A 75 115.379 9.199 -6.779 1.00 0.00 H new ATOM 0 HG12 ILE A 75 114.623 11.546 -5.278 1.00 0.00 H new ATOM 0 HG13 ILE A 75 115.750 10.626 -4.301 1.00 0.00 H new ATOM 0 HG21 ILE A 75 113.259 10.464 -6.994 1.00 0.00 H new ATOM 0 HG22 ILE A 75 112.948 8.744 -6.661 1.00 0.00 H new ATOM 0 HG23 ILE A 75 112.783 9.946 -5.359 1.00 0.00 H new ATOM 0 HD11 ILE A 75 116.964 12.183 -5.807 1.00 0.00 H new ATOM 0 HD12 ILE A 75 117.333 10.494 -6.229 1.00 0.00 H new ATOM 0 HD13 ILE A 75 116.188 11.428 -7.220 1.00 0.00 H new ATOM 1184 N GLU A 76 117.098 8.451 -3.745 1.00 0.00 N ATOM 1185 CA GLU A 76 118.524 8.067 -3.574 1.00 0.00 C ATOM 1186 C GLU A 76 118.610 6.562 -3.342 1.00 0.00 C ATOM 1187 O GLU A 76 119.443 5.888 -3.916 1.00 0.00 O ATOM 1188 CB GLU A 76 119.128 8.799 -2.375 1.00 0.00 C ATOM 1189 CG GLU A 76 120.644 8.904 -2.552 1.00 0.00 C ATOM 1190 CD GLU A 76 120.962 9.979 -3.592 1.00 0.00 C ATOM 1191 OE1 GLU A 76 120.827 11.148 -3.268 1.00 0.00 O ATOM 1192 OE2 GLU A 76 121.336 9.616 -4.695 1.00 0.00 O ATOM 0 H GLU A 76 116.740 9.117 -3.061 1.00 0.00 H new ATOM 0 HA GLU A 76 119.079 8.340 -4.472 1.00 0.00 H new ATOM 0 HB2 GLU A 76 118.692 9.794 -2.285 1.00 0.00 H new ATOM 0 HB3 GLU A 76 118.895 8.265 -1.454 1.00 0.00 H new ATOM 0 HG2 GLU A 76 121.116 9.152 -1.601 1.00 0.00 H new ATOM 0 HG3 GLU A 76 121.051 7.944 -2.869 1.00 0.00 H new ATOM 1199 N PHE A 77 117.761 6.015 -2.507 1.00 0.00 N ATOM 1200 CA PHE A 77 117.834 4.550 -2.272 1.00 0.00 C ATOM 1201 C PHE A 77 117.430 3.817 -3.548 1.00 0.00 C ATOM 1202 O PHE A 77 118.206 3.066 -4.099 1.00 0.00 O ATOM 1203 CB PHE A 77 116.905 4.149 -1.122 1.00 0.00 C ATOM 1204 CG PHE A 77 115.620 3.563 -1.667 1.00 0.00 C ATOM 1205 CD1 PHE A 77 115.588 2.241 -2.130 1.00 0.00 C ATOM 1206 CD2 PHE A 77 114.461 4.344 -1.708 1.00 0.00 C ATOM 1207 CE1 PHE A 77 114.396 1.703 -2.632 1.00 0.00 C ATOM 1208 CE2 PHE A 77 113.271 3.807 -2.210 1.00 0.00 C ATOM 1209 CZ PHE A 77 113.237 2.487 -2.672 1.00 0.00 C ATOM 0 H PHE A 77 117.036 6.512 -1.990 1.00 0.00 H new ATOM 0 HA PHE A 77 118.855 4.279 -2.002 1.00 0.00 H new ATOM 0 HB2 PHE A 77 117.402 3.421 -0.481 1.00 0.00 H new ATOM 0 HB3 PHE A 77 116.683 5.019 -0.504 1.00 0.00 H new ATOM 0 HD1 PHE A 77 116.483 1.637 -2.100 1.00 0.00 H new ATOM 0 HD2 PHE A 77 114.485 5.363 -1.352 1.00 0.00 H new ATOM 0 HE1 PHE A 77 114.371 0.684 -2.988 1.00 0.00 H new ATOM 0 HE2 PHE A 77 112.377 4.412 -2.241 1.00 0.00 H new ATOM 0 HZ PHE A 77 112.318 2.073 -3.059 1.00 0.00 H new ATOM 1219 N PHE A 78 116.231 4.021 -4.041 1.00 0.00 N ATOM 1220 CA PHE A 78 115.848 3.295 -5.286 1.00 0.00 C ATOM 1221 C PHE A 78 116.814 3.669 -6.412 1.00 0.00 C ATOM 1222 O PHE A 78 117.266 2.827 -7.156 1.00 0.00 O ATOM 1223 CB PHE A 78 114.417 3.649 -5.694 1.00 0.00 C ATOM 1224 CG PHE A 78 113.913 2.656 -6.731 1.00 0.00 C ATOM 1225 CD1 PHE A 78 114.253 1.293 -6.649 1.00 0.00 C ATOM 1226 CD2 PHE A 78 113.100 3.103 -7.780 1.00 0.00 C ATOM 1227 CE1 PHE A 78 113.781 0.392 -7.612 1.00 0.00 C ATOM 1228 CE2 PHE A 78 112.628 2.197 -8.740 1.00 0.00 C ATOM 1229 CZ PHE A 78 112.969 0.844 -8.656 1.00 0.00 C ATOM 0 H PHE A 78 115.522 4.640 -3.647 1.00 0.00 H new ATOM 0 HA PHE A 78 115.901 2.222 -5.099 1.00 0.00 H new ATOM 0 HB2 PHE A 78 113.767 3.636 -4.819 1.00 0.00 H new ATOM 0 HB3 PHE A 78 114.385 4.660 -6.100 1.00 0.00 H new ATOM 0 HD1 PHE A 78 114.879 0.941 -5.842 1.00 0.00 H new ATOM 0 HD2 PHE A 78 112.836 4.148 -7.850 1.00 0.00 H new ATOM 0 HE1 PHE A 78 114.045 -0.653 -7.548 1.00 0.00 H new ATOM 0 HE2 PHE A 78 111.999 2.545 -9.546 1.00 0.00 H new ATOM 0 HZ PHE A 78 112.605 0.148 -9.398 1.00 0.00 H new ATOM 1239 N ASN A 79 117.141 4.922 -6.538 1.00 0.00 N ATOM 1240 CA ASN A 79 118.086 5.343 -7.614 1.00 0.00 C ATOM 1241 C ASN A 79 119.336 4.474 -7.544 1.00 0.00 C ATOM 1242 O ASN A 79 119.813 3.969 -8.541 1.00 0.00 O ATOM 1243 CB ASN A 79 118.489 6.806 -7.413 1.00 0.00 C ATOM 1244 CG ASN A 79 119.584 7.176 -8.416 1.00 0.00 C ATOM 1245 OD1 ASN A 79 120.029 6.343 -9.180 1.00 0.00 O ATOM 1246 ND2 ASN A 79 120.039 8.398 -8.445 1.00 0.00 N ATOM 0 H ASN A 79 116.796 5.676 -5.944 1.00 0.00 H new ATOM 0 HA ASN A 79 117.600 5.231 -8.583 1.00 0.00 H new ATOM 0 HB2 ASN A 79 117.623 7.455 -7.548 1.00 0.00 H new ATOM 0 HB3 ASN A 79 118.847 6.959 -6.395 1.00 0.00 H new ATOM 0 HD21 ASN A 79 120.769 8.655 -9.110 1.00 0.00 H new ATOM 0 HD22 ASN A 79 119.665 9.097 -7.803 1.00 0.00 H new ATOM 1253 N LYS A 80 119.869 4.293 -6.373 1.00 0.00 N ATOM 1254 CA LYS A 80 121.084 3.454 -6.241 1.00 0.00 C ATOM 1255 C LYS A 80 120.711 1.995 -6.501 1.00 0.00 C ATOM 1256 O LYS A 80 121.498 1.225 -7.012 1.00 0.00 O ATOM 1257 CB LYS A 80 121.653 3.600 -4.830 1.00 0.00 C ATOM 1258 CG LYS A 80 122.500 4.874 -4.752 1.00 0.00 C ATOM 1259 CD LYS A 80 123.910 4.594 -5.281 1.00 0.00 C ATOM 1260 CE LYS A 80 124.583 3.535 -4.407 1.00 0.00 C ATOM 1261 NZ LYS A 80 126.032 3.853 -4.267 1.00 0.00 N ATOM 0 H LYS A 80 119.516 4.690 -5.502 1.00 0.00 H new ATOM 0 HA LYS A 80 121.836 3.773 -6.963 1.00 0.00 H new ATOM 0 HB2 LYS A 80 120.843 3.644 -4.102 1.00 0.00 H new ATOM 0 HB3 LYS A 80 122.260 2.730 -4.579 1.00 0.00 H new ATOM 0 HG2 LYS A 80 122.034 5.668 -5.336 1.00 0.00 H new ATOM 0 HG3 LYS A 80 122.552 5.225 -3.721 1.00 0.00 H new ATOM 0 HD2 LYS A 80 123.860 4.250 -6.314 1.00 0.00 H new ATOM 0 HD3 LYS A 80 124.499 5.511 -5.278 1.00 0.00 H new ATOM 0 HE2 LYS A 80 124.110 3.504 -3.425 1.00 0.00 H new ATOM 0 HE3 LYS A 80 124.458 2.548 -4.852 1.00 0.00 H new ATOM 0 HZ1 LYS A 80 126.490 3.133 -3.673 1.00 0.00 H new ATOM 0 HZ2 LYS A 80 126.478 3.861 -5.206 1.00 0.00 H new ATOM 0 HZ3 LYS A 80 126.141 4.788 -3.824 1.00 0.00 H new ATOM 1275 N LEU A 81 119.513 1.607 -6.152 1.00 0.00 N ATOM 1276 CA LEU A 81 119.101 0.194 -6.383 1.00 0.00 C ATOM 1277 C LEU A 81 118.914 -0.058 -7.887 1.00 0.00 C ATOM 1278 O LEU A 81 119.510 -0.949 -8.451 1.00 0.00 O ATOM 1279 CB LEU A 81 117.780 -0.082 -5.644 1.00 0.00 C ATOM 1280 CG LEU A 81 117.931 0.171 -4.136 1.00 0.00 C ATOM 1281 CD1 LEU A 81 117.025 -0.796 -3.373 1.00 0.00 C ATOM 1282 CD2 LEU A 81 119.383 -0.039 -3.686 1.00 0.00 C ATOM 0 H LEU A 81 118.807 2.203 -5.720 1.00 0.00 H new ATOM 0 HA LEU A 81 119.876 -0.472 -6.005 1.00 0.00 H new ATOM 0 HB2 LEU A 81 116.993 0.556 -6.047 1.00 0.00 H new ATOM 0 HB3 LEU A 81 117.472 -1.114 -5.815 1.00 0.00 H new ATOM 0 HG LEU A 81 117.649 1.203 -3.927 1.00 0.00 H new ATOM 0 HD11 LEU A 81 117.127 -0.622 -2.302 1.00 0.00 H new ATOM 0 HD12 LEU A 81 115.989 -0.634 -3.670 1.00 0.00 H new ATOM 0 HD13 LEU A 81 117.312 -1.822 -3.603 1.00 0.00 H new ATOM 0 HD21 LEU A 81 119.462 0.146 -2.615 1.00 0.00 H new ATOM 0 HD22 LEU A 81 119.686 -1.064 -3.900 1.00 0.00 H new ATOM 0 HD23 LEU A 81 120.034 0.651 -4.223 1.00 0.00 H new ATOM 1294 N VAL A 82 118.095 0.710 -8.548 1.00 0.00 N ATOM 1295 CA VAL A 82 117.884 0.484 -10.007 1.00 0.00 C ATOM 1296 C VAL A 82 119.207 0.602 -10.772 1.00 0.00 C ATOM 1297 O VAL A 82 119.513 -0.208 -11.619 1.00 0.00 O ATOM 1298 CB VAL A 82 116.895 1.521 -10.541 1.00 0.00 C ATOM 1299 CG1 VAL A 82 115.464 1.045 -10.273 1.00 0.00 C ATOM 1300 CG2 VAL A 82 117.133 2.865 -9.841 1.00 0.00 C ATOM 0 H VAL A 82 117.564 1.482 -8.145 1.00 0.00 H new ATOM 0 HA VAL A 82 117.487 -0.521 -10.151 1.00 0.00 H new ATOM 0 HB VAL A 82 117.040 1.644 -11.614 1.00 0.00 H new ATOM 0 HG11 VAL A 82 114.758 1.783 -10.653 1.00 0.00 H new ATOM 0 HG12 VAL A 82 115.298 0.092 -10.775 1.00 0.00 H new ATOM 0 HG13 VAL A 82 115.317 0.921 -9.200 1.00 0.00 H new ATOM 0 HG21 VAL A 82 116.428 3.604 -10.222 1.00 0.00 H new ATOM 0 HG22 VAL A 82 116.989 2.746 -8.767 1.00 0.00 H new ATOM 0 HG23 VAL A 82 118.151 3.201 -10.036 1.00 0.00 H new ATOM 1310 N THR A 83 119.983 1.612 -10.509 1.00 0.00 N ATOM 1311 CA THR A 83 121.265 1.769 -11.258 1.00 0.00 C ATOM 1312 C THR A 83 122.358 0.842 -10.701 1.00 0.00 C ATOM 1313 O THR A 83 123.059 0.185 -11.445 1.00 0.00 O ATOM 1314 CB THR A 83 121.730 3.223 -11.163 1.00 0.00 C ATOM 1315 OG1 THR A 83 122.590 3.515 -12.255 1.00 0.00 O ATOM 1316 CG2 THR A 83 122.479 3.432 -9.852 1.00 0.00 C ATOM 0 H THR A 83 119.791 2.333 -9.814 1.00 0.00 H new ATOM 0 HA THR A 83 121.089 1.496 -12.299 1.00 0.00 H new ATOM 0 HB THR A 83 120.865 3.886 -11.195 1.00 0.00 H new ATOM 0 HG1 THR A 83 122.888 4.447 -12.197 1.00 0.00 H new ATOM 0 HG21 THR A 83 122.811 4.468 -9.784 1.00 0.00 H new ATOM 0 HG22 THR A 83 121.818 3.207 -9.015 1.00 0.00 H new ATOM 0 HG23 THR A 83 123.345 2.771 -9.818 1.00 0.00 H new ATOM 1324 N SER A 84 122.536 0.806 -9.408 1.00 0.00 N ATOM 1325 CA SER A 84 123.615 -0.051 -8.821 1.00 0.00 C ATOM 1326 C SER A 84 123.217 -1.533 -8.790 1.00 0.00 C ATOM 1327 O SER A 84 124.066 -2.400 -8.715 1.00 0.00 O ATOM 1328 CB SER A 84 123.906 0.414 -7.394 1.00 0.00 C ATOM 1329 OG SER A 84 123.666 1.812 -7.296 1.00 0.00 O ATOM 0 H SER A 84 121.983 1.331 -8.730 1.00 0.00 H new ATOM 0 HA SER A 84 124.499 0.049 -9.450 1.00 0.00 H new ATOM 0 HB2 SER A 84 123.274 -0.125 -6.688 1.00 0.00 H new ATOM 0 HB3 SER A 84 124.940 0.192 -7.131 1.00 0.00 H new ATOM 0 HG SER A 84 122.731 2.000 -7.520 1.00 0.00 H new ATOM 1335 N PHE A 85 121.951 -1.843 -8.809 1.00 0.00 N ATOM 1336 CA PHE A 85 121.548 -3.281 -8.738 1.00 0.00 C ATOM 1337 C PHE A 85 121.936 -4.037 -10.016 1.00 0.00 C ATOM 1338 O PHE A 85 121.592 -5.187 -10.182 1.00 0.00 O ATOM 1339 CB PHE A 85 120.040 -3.400 -8.492 1.00 0.00 C ATOM 1340 CG PHE A 85 119.271 -3.251 -9.788 1.00 0.00 C ATOM 1341 CD1 PHE A 85 119.834 -2.591 -10.890 1.00 0.00 C ATOM 1342 CD2 PHE A 85 117.991 -3.804 -9.891 1.00 0.00 C ATOM 1343 CE1 PHE A 85 119.117 -2.489 -12.087 1.00 0.00 C ATOM 1344 CE2 PHE A 85 117.278 -3.704 -11.090 1.00 0.00 C ATOM 1345 CZ PHE A 85 117.842 -3.048 -12.188 1.00 0.00 C ATOM 0 H PHE A 85 121.183 -1.174 -8.870 1.00 0.00 H new ATOM 0 HA PHE A 85 122.083 -3.735 -7.904 1.00 0.00 H new ATOM 0 HB2 PHE A 85 119.816 -4.366 -8.040 1.00 0.00 H new ATOM 0 HB3 PHE A 85 119.721 -2.635 -7.784 1.00 0.00 H new ATOM 0 HD1 PHE A 85 120.822 -2.161 -10.815 1.00 0.00 H new ATOM 0 HD2 PHE A 85 117.552 -4.309 -9.043 1.00 0.00 H new ATOM 0 HE1 PHE A 85 119.550 -1.977 -12.934 1.00 0.00 H new ATOM 0 HE2 PHE A 85 116.290 -4.134 -11.168 1.00 0.00 H new ATOM 0 HZ PHE A 85 117.291 -2.974 -13.114 1.00 0.00 H new ATOM 1355 N ASP A 86 122.641 -3.423 -10.926 1.00 0.00 N ATOM 1356 CA ASP A 86 123.021 -4.165 -12.162 1.00 0.00 C ATOM 1357 C ASP A 86 124.365 -4.858 -11.938 1.00 0.00 C ATOM 1358 O ASP A 86 124.970 -5.384 -12.851 1.00 0.00 O ATOM 1359 CB ASP A 86 123.112 -3.216 -13.354 1.00 0.00 C ATOM 1360 CG ASP A 86 123.934 -1.984 -12.971 1.00 0.00 C ATOM 1361 OD1 ASP A 86 124.808 -2.117 -12.131 1.00 0.00 O ATOM 1362 OD2 ASP A 86 123.676 -0.928 -13.525 1.00 0.00 O ATOM 0 H ASP A 86 122.966 -2.458 -10.871 1.00 0.00 H new ATOM 0 HA ASP A 86 122.256 -4.910 -12.380 1.00 0.00 H new ATOM 0 HB2 ASP A 86 123.573 -3.724 -14.201 1.00 0.00 H new ATOM 0 HB3 ASP A 86 122.113 -2.915 -13.669 1.00 0.00 H new ATOM 1367 N PHE A 87 124.815 -4.886 -10.716 1.00 0.00 N ATOM 1368 CA PHE A 87 126.098 -5.569 -10.394 1.00 0.00 C ATOM 1369 C PHE A 87 125.877 -6.392 -9.124 1.00 0.00 C ATOM 1370 O PHE A 87 125.694 -7.592 -9.174 1.00 0.00 O ATOM 1371 CB PHE A 87 127.214 -4.528 -10.176 1.00 0.00 C ATOM 1372 CG PHE A 87 128.011 -4.861 -8.929 1.00 0.00 C ATOM 1373 CD1 PHE A 87 128.391 -6.184 -8.666 1.00 0.00 C ATOM 1374 CD2 PHE A 87 128.354 -3.848 -8.022 1.00 0.00 C ATOM 1375 CE1 PHE A 87 129.101 -6.488 -7.505 1.00 0.00 C ATOM 1376 CE2 PHE A 87 129.073 -4.158 -6.863 1.00 0.00 C ATOM 1377 CZ PHE A 87 129.445 -5.480 -6.606 1.00 0.00 C ATOM 0 H PHE A 87 124.344 -4.460 -9.918 1.00 0.00 H new ATOM 0 HA PHE A 87 126.405 -6.217 -11.215 1.00 0.00 H new ATOM 0 HB2 PHE A 87 127.875 -4.507 -11.043 1.00 0.00 H new ATOM 0 HB3 PHE A 87 126.779 -3.533 -10.082 1.00 0.00 H new ATOM 0 HD1 PHE A 87 128.134 -6.968 -9.363 1.00 0.00 H new ATOM 0 HD2 PHE A 87 128.063 -2.827 -8.219 1.00 0.00 H new ATOM 0 HE1 PHE A 87 129.386 -7.510 -7.301 1.00 0.00 H new ATOM 0 HE2 PHE A 87 129.340 -3.376 -6.167 1.00 0.00 H new ATOM 0 HZ PHE A 87 129.999 -5.721 -5.711 1.00 0.00 H new ATOM 1387 N ASP A 88 125.886 -5.754 -7.987 1.00 0.00 N ATOM 1388 CA ASP A 88 125.668 -6.496 -6.716 1.00 0.00 C ATOM 1389 C ASP A 88 124.184 -6.461 -6.364 1.00 0.00 C ATOM 1390 O ASP A 88 123.730 -5.611 -5.625 1.00 0.00 O ATOM 1391 CB ASP A 88 126.460 -5.834 -5.594 1.00 0.00 C ATOM 1392 CG ASP A 88 126.518 -4.324 -5.833 1.00 0.00 C ATOM 1393 OD1 ASP A 88 125.777 -3.850 -6.678 1.00 0.00 O ATOM 1394 OD2 ASP A 88 127.299 -3.669 -5.167 1.00 0.00 O ATOM 0 H ASP A 88 126.035 -4.750 -7.884 1.00 0.00 H new ATOM 0 HA ASP A 88 125.999 -7.527 -6.837 1.00 0.00 H new ATOM 0 HB2 ASP A 88 125.992 -6.043 -4.632 1.00 0.00 H new ATOM 0 HB3 ASP A 88 127.468 -6.246 -5.554 1.00 0.00 H new ATOM 1399 N LEU A 89 123.424 -7.375 -6.887 1.00 0.00 N ATOM 1400 CA LEU A 89 121.971 -7.393 -6.585 1.00 0.00 C ATOM 1401 C LEU A 89 121.775 -7.561 -5.081 1.00 0.00 C ATOM 1402 O LEU A 89 121.060 -6.811 -4.448 1.00 0.00 O ATOM 1403 CB LEU A 89 121.310 -8.561 -7.319 1.00 0.00 C ATOM 1404 CG LEU A 89 121.840 -8.675 -8.759 1.00 0.00 C ATOM 1405 CD1 LEU A 89 122.452 -7.355 -9.239 1.00 0.00 C ATOM 1406 CD2 LEU A 89 122.905 -9.764 -8.832 1.00 0.00 C ATOM 0 H LEU A 89 123.747 -8.113 -7.513 1.00 0.00 H new ATOM 0 HA LEU A 89 121.517 -6.458 -6.913 1.00 0.00 H new ATOM 0 HB2 LEU A 89 121.503 -9.489 -6.782 1.00 0.00 H new ATOM 0 HB3 LEU A 89 120.229 -8.421 -7.335 1.00 0.00 H new ATOM 0 HG LEU A 89 120.996 -8.923 -9.403 1.00 0.00 H new ATOM 0 HD11 LEU A 89 122.816 -7.473 -10.260 1.00 0.00 H new ATOM 0 HD12 LEU A 89 121.695 -6.572 -9.212 1.00 0.00 H new ATOM 0 HD13 LEU A 89 123.282 -7.080 -8.587 1.00 0.00 H new ATOM 0 HD21 LEU A 89 123.277 -9.841 -9.854 1.00 0.00 H new ATOM 0 HD22 LEU A 89 123.729 -9.513 -8.164 1.00 0.00 H new ATOM 0 HD23 LEU A 89 122.471 -10.718 -8.531 1.00 0.00 H new ATOM 1418 N GLU A 90 122.396 -8.549 -4.506 1.00 0.00 N ATOM 1419 CA GLU A 90 122.236 -8.776 -3.043 1.00 0.00 C ATOM 1420 C GLU A 90 123.111 -7.803 -2.242 1.00 0.00 C ATOM 1421 O GLU A 90 122.668 -7.193 -1.286 1.00 0.00 O ATOM 1422 CB GLU A 90 122.651 -10.213 -2.706 1.00 0.00 C ATOM 1423 CG GLU A 90 122.833 -11.010 -3.996 1.00 0.00 C ATOM 1424 CD GLU A 90 124.179 -10.657 -4.632 1.00 0.00 C ATOM 1425 OE1 GLU A 90 125.193 -10.889 -3.993 1.00 0.00 O ATOM 1426 OE2 GLU A 90 124.173 -10.160 -5.746 1.00 0.00 O ATOM 0 H GLU A 90 123.008 -9.210 -4.984 1.00 0.00 H new ATOM 0 HA GLU A 90 121.192 -8.610 -2.778 1.00 0.00 H new ATOM 0 HB2 GLU A 90 123.579 -10.210 -2.135 1.00 0.00 H new ATOM 0 HB3 GLU A 90 121.893 -10.684 -2.080 1.00 0.00 H new ATOM 0 HG2 GLU A 90 122.788 -12.078 -3.785 1.00 0.00 H new ATOM 0 HG3 GLU A 90 122.022 -10.788 -4.690 1.00 0.00 H new ATOM 1433 N ILE A 91 124.357 -7.681 -2.603 1.00 0.00 N ATOM 1434 CA ILE A 91 125.275 -6.784 -1.840 1.00 0.00 C ATOM 1435 C ILE A 91 125.023 -5.310 -2.180 1.00 0.00 C ATOM 1436 O ILE A 91 125.272 -4.432 -1.376 1.00 0.00 O ATOM 1437 CB ILE A 91 126.720 -7.147 -2.191 1.00 0.00 C ATOM 1438 CG1 ILE A 91 126.761 -8.577 -2.735 1.00 0.00 C ATOM 1439 CG2 ILE A 91 127.599 -7.054 -0.943 1.00 0.00 C ATOM 1440 CD1 ILE A 91 128.203 -9.077 -2.754 1.00 0.00 C ATOM 0 H ILE A 91 124.782 -8.164 -3.395 1.00 0.00 H new ATOM 0 HA ILE A 91 125.092 -6.921 -0.774 1.00 0.00 H new ATOM 0 HB ILE A 91 127.094 -6.453 -2.944 1.00 0.00 H new ATOM 0 HG12 ILE A 91 126.147 -9.230 -2.115 1.00 0.00 H new ATOM 0 HG13 ILE A 91 126.342 -8.606 -3.741 1.00 0.00 H new ATOM 0 HG21 ILE A 91 128.626 -7.314 -1.201 1.00 0.00 H new ATOM 0 HG22 ILE A 91 127.569 -6.037 -0.552 1.00 0.00 H new ATOM 0 HG23 ILE A 91 127.229 -7.745 -0.185 1.00 0.00 H new ATOM 0 HD11 ILE A 91 128.230 -10.095 -3.142 1.00 0.00 H new ATOM 0 HD12 ILE A 91 128.804 -8.430 -3.392 1.00 0.00 H new ATOM 0 HD13 ILE A 91 128.606 -9.064 -1.741 1.00 0.00 H new ATOM 1452 N GLY A 92 124.556 -5.023 -3.362 1.00 0.00 N ATOM 1453 CA GLY A 92 124.322 -3.599 -3.744 1.00 0.00 C ATOM 1454 C GLY A 92 123.307 -2.947 -2.801 1.00 0.00 C ATOM 1455 O GLY A 92 123.551 -1.896 -2.241 1.00 0.00 O ATOM 0 H GLY A 92 124.326 -5.710 -4.080 1.00 0.00 H new ATOM 0 HA2 GLY A 92 125.262 -3.049 -3.711 1.00 0.00 H new ATOM 0 HA3 GLY A 92 123.958 -3.547 -4.770 1.00 0.00 H new ATOM 1459 N LYS A 93 122.164 -3.549 -2.635 1.00 0.00 N ATOM 1460 CA LYS A 93 121.126 -2.950 -1.745 1.00 0.00 C ATOM 1461 C LYS A 93 121.472 -3.193 -0.271 1.00 0.00 C ATOM 1462 O LYS A 93 120.925 -2.559 0.612 1.00 0.00 O ATOM 1463 CB LYS A 93 119.750 -3.564 -2.051 1.00 0.00 C ATOM 1464 CG LYS A 93 119.896 -4.862 -2.858 1.00 0.00 C ATOM 1465 CD LYS A 93 119.654 -4.583 -4.347 1.00 0.00 C ATOM 1466 CE LYS A 93 120.943 -4.079 -5.001 1.00 0.00 C ATOM 1467 NZ LYS A 93 121.195 -2.671 -4.584 1.00 0.00 N ATOM 0 H LYS A 93 121.901 -4.430 -3.076 1.00 0.00 H new ATOM 0 HA LYS A 93 121.097 -1.876 -1.931 1.00 0.00 H new ATOM 0 HB2 LYS A 93 119.223 -3.768 -1.119 1.00 0.00 H new ATOM 0 HB3 LYS A 93 119.145 -2.850 -2.610 1.00 0.00 H new ATOM 0 HG2 LYS A 93 120.893 -5.279 -2.715 1.00 0.00 H new ATOM 0 HG3 LYS A 93 119.185 -5.606 -2.498 1.00 0.00 H new ATOM 0 HD2 LYS A 93 119.315 -5.491 -4.845 1.00 0.00 H new ATOM 0 HD3 LYS A 93 118.864 -3.841 -4.463 1.00 0.00 H new ATOM 0 HE2 LYS A 93 121.782 -4.711 -4.710 1.00 0.00 H new ATOM 0 HE3 LYS A 93 120.860 -4.139 -6.086 1.00 0.00 H new ATOM 0 HZ1 LYS A 93 122.166 -2.401 -4.841 1.00 0.00 H new ATOM 0 HZ2 LYS A 93 120.522 -2.041 -5.065 1.00 0.00 H new ATOM 0 HZ3 LYS A 93 121.074 -2.587 -3.555 1.00 0.00 H new ATOM 1481 N GLY A 94 122.354 -4.112 0.009 1.00 0.00 N ATOM 1482 CA GLY A 94 122.702 -4.402 1.432 1.00 0.00 C ATOM 1483 C GLY A 94 123.467 -3.231 2.075 1.00 0.00 C ATOM 1484 O GLY A 94 123.155 -2.816 3.173 1.00 0.00 O ATOM 0 H GLY A 94 122.849 -4.675 -0.683 1.00 0.00 H new ATOM 0 HA2 GLY A 94 121.791 -4.598 1.998 1.00 0.00 H new ATOM 0 HA3 GLY A 94 123.309 -5.306 1.482 1.00 0.00 H new ATOM 1488 N GLU A 95 124.473 -2.704 1.423 1.00 0.00 N ATOM 1489 CA GLU A 95 125.245 -1.575 2.038 1.00 0.00 C ATOM 1490 C GLU A 95 124.566 -0.241 1.724 1.00 0.00 C ATOM 1491 O GLU A 95 124.469 0.637 2.564 1.00 0.00 O ATOM 1492 CB GLU A 95 126.676 -1.560 1.481 1.00 0.00 C ATOM 1493 CG GLU A 95 127.236 -0.129 1.505 1.00 0.00 C ATOM 1494 CD GLU A 95 126.744 0.632 0.273 1.00 0.00 C ATOM 1495 OE1 GLU A 95 126.626 0.014 -0.772 1.00 0.00 O ATOM 1496 OE2 GLU A 95 126.494 1.820 0.394 1.00 0.00 O ATOM 0 H GLU A 95 124.793 -3.001 0.501 1.00 0.00 H new ATOM 0 HA GLU A 95 125.275 -1.718 3.118 1.00 0.00 H new ATOM 0 HB2 GLU A 95 127.312 -2.218 2.073 1.00 0.00 H new ATOM 0 HB3 GLU A 95 126.682 -1.944 0.461 1.00 0.00 H new ATOM 0 HG2 GLU A 95 126.917 0.383 2.413 1.00 0.00 H new ATOM 0 HG3 GLU A 95 128.326 -0.154 1.519 1.00 0.00 H new ATOM 1503 N THR A 96 124.109 -0.069 0.519 1.00 0.00 N ATOM 1504 CA THR A 96 123.457 1.216 0.161 1.00 0.00 C ATOM 1505 C THR A 96 122.403 1.567 1.213 1.00 0.00 C ATOM 1506 O THR A 96 122.347 2.680 1.703 1.00 0.00 O ATOM 1507 CB THR A 96 122.812 1.095 -1.217 1.00 0.00 C ATOM 1508 OG1 THR A 96 122.151 -0.156 -1.318 1.00 0.00 O ATOM 1509 CG2 THR A 96 123.901 1.191 -2.285 1.00 0.00 C ATOM 0 H THR A 96 124.158 -0.759 -0.230 1.00 0.00 H new ATOM 0 HA THR A 96 124.203 2.010 0.132 1.00 0.00 H new ATOM 0 HB THR A 96 122.087 1.896 -1.361 1.00 0.00 H new ATOM 0 HG1 THR A 96 122.773 -0.827 -1.668 1.00 0.00 H new ATOM 0 HG21 THR A 96 123.450 1.106 -3.274 1.00 0.00 H new ATOM 0 HG22 THR A 96 124.410 2.151 -2.200 1.00 0.00 H new ATOM 0 HG23 THR A 96 124.621 0.385 -2.144 1.00 0.00 H new ATOM 1517 N MET A 97 121.581 0.624 1.582 1.00 0.00 N ATOM 1518 CA MET A 97 120.548 0.907 2.617 1.00 0.00 C ATOM 1519 C MET A 97 121.233 1.491 3.851 1.00 0.00 C ATOM 1520 O MET A 97 120.615 2.132 4.680 1.00 0.00 O ATOM 1521 CB MET A 97 119.838 -0.392 3.010 1.00 0.00 C ATOM 1522 CG MET A 97 120.861 -1.523 3.149 1.00 0.00 C ATOM 1523 SD MET A 97 121.625 -1.447 4.788 1.00 0.00 S ATOM 1524 CE MET A 97 120.285 -2.247 5.704 1.00 0.00 C ATOM 0 H MET A 97 121.580 -0.327 1.213 1.00 0.00 H new ATOM 0 HA MET A 97 119.818 1.612 2.219 1.00 0.00 H new ATOM 0 HB2 MET A 97 119.304 -0.255 3.950 1.00 0.00 H new ATOM 0 HB3 MET A 97 119.095 -0.653 2.257 1.00 0.00 H new ATOM 0 HG2 MET A 97 120.374 -2.488 3.007 1.00 0.00 H new ATOM 0 HG3 MET A 97 121.624 -1.435 2.376 1.00 0.00 H new ATOM 0 HE1 MET A 97 119.977 -1.607 6.531 1.00 0.00 H new ATOM 0 HE2 MET A 97 119.438 -2.413 5.038 1.00 0.00 H new ATOM 0 HE3 MET A 97 120.632 -3.203 6.096 1.00 0.00 H new ATOM 1534 N LYS A 98 122.507 1.255 3.982 1.00 0.00 N ATOM 1535 CA LYS A 98 123.248 1.768 5.165 1.00 0.00 C ATOM 1536 C LYS A 98 123.553 3.259 5.011 1.00 0.00 C ATOM 1537 O LYS A 98 123.436 4.012 5.953 1.00 0.00 O ATOM 1538 CB LYS A 98 124.565 1.003 5.300 1.00 0.00 C ATOM 1539 CG LYS A 98 124.824 0.677 6.772 1.00 0.00 C ATOM 1540 CD LYS A 98 126.151 -0.074 6.905 1.00 0.00 C ATOM 1541 CE LYS A 98 125.894 -1.581 6.851 1.00 0.00 C ATOM 1542 NZ LYS A 98 127.189 -2.310 6.973 1.00 0.00 N ATOM 0 H LYS A 98 123.070 0.726 3.316 1.00 0.00 H new ATOM 0 HA LYS A 98 122.630 1.626 6.052 1.00 0.00 H new ATOM 0 HB2 LYS A 98 124.524 0.084 4.716 1.00 0.00 H new ATOM 0 HB3 LYS A 98 125.385 1.599 4.900 1.00 0.00 H new ATOM 0 HG2 LYS A 98 124.854 1.595 7.359 1.00 0.00 H new ATOM 0 HG3 LYS A 98 124.010 0.071 7.170 1.00 0.00 H new ATOM 0 HD2 LYS A 98 126.828 0.219 6.103 1.00 0.00 H new ATOM 0 HD3 LYS A 98 126.637 0.189 7.845 1.00 0.00 H new ATOM 0 HE2 LYS A 98 125.221 -1.875 7.657 1.00 0.00 H new ATOM 0 HE3 LYS A 98 125.403 -1.844 5.914 1.00 0.00 H new ATOM 0 HZ1 LYS A 98 127.317 -2.931 6.148 1.00 0.00 H new ATOM 0 HZ2 LYS A 98 127.970 -1.625 7.015 1.00 0.00 H new ATOM 0 HZ3 LYS A 98 127.184 -2.884 7.840 1.00 0.00 H new ATOM 1556 N TYR A 99 123.969 3.702 3.856 1.00 0.00 N ATOM 1557 CA TYR A 99 124.293 5.152 3.725 1.00 0.00 C ATOM 1558 C TYR A 99 123.026 5.999 3.871 1.00 0.00 C ATOM 1559 O TYR A 99 123.086 7.116 4.346 1.00 0.00 O ATOM 1560 CB TYR A 99 125.011 5.437 2.399 1.00 0.00 C ATOM 1561 CG TYR A 99 124.031 5.569 1.263 1.00 0.00 C ATOM 1562 CD1 TYR A 99 123.211 6.697 1.162 1.00 0.00 C ATOM 1563 CD2 TYR A 99 123.963 4.564 0.299 1.00 0.00 C ATOM 1564 CE1 TYR A 99 122.318 6.814 0.090 1.00 0.00 C ATOM 1565 CE2 TYR A 99 123.073 4.679 -0.774 1.00 0.00 C ATOM 1566 CZ TYR A 99 122.249 5.805 -0.879 1.00 0.00 C ATOM 1567 OH TYR A 99 121.369 5.921 -1.936 1.00 0.00 O ATOM 0 H TYR A 99 124.097 3.139 3.015 1.00 0.00 H new ATOM 0 HA TYR A 99 124.975 5.428 4.530 1.00 0.00 H new ATOM 0 HB2 TYR A 99 125.593 6.354 2.488 1.00 0.00 H new ATOM 0 HB3 TYR A 99 125.714 4.633 2.184 1.00 0.00 H new ATOM 0 HD1 TYR A 99 123.266 7.476 1.908 1.00 0.00 H new ATOM 0 HD2 TYR A 99 124.599 3.695 0.381 1.00 0.00 H new ATOM 0 HE1 TYR A 99 121.682 7.683 0.010 1.00 0.00 H new ATOM 0 HE2 TYR A 99 123.022 3.900 -1.520 1.00 0.00 H new ATOM 0 HH TYR A 99 121.073 5.029 -2.214 1.00 0.00 H new ATOM 1577 N ILE A 100 121.875 5.489 3.516 1.00 0.00 N ATOM 1578 CA ILE A 100 120.642 6.309 3.704 1.00 0.00 C ATOM 1579 C ILE A 100 120.344 6.377 5.205 1.00 0.00 C ATOM 1580 O ILE A 100 120.222 7.439 5.782 1.00 0.00 O ATOM 1581 CB ILE A 100 119.457 5.667 2.983 1.00 0.00 C ATOM 1582 CG1 ILE A 100 119.706 5.662 1.475 1.00 0.00 C ATOM 1583 CG2 ILE A 100 118.191 6.474 3.279 1.00 0.00 C ATOM 1584 CD1 ILE A 100 120.634 4.503 1.113 1.00 0.00 C ATOM 0 H ILE A 100 121.736 4.562 3.113 1.00 0.00 H new ATOM 0 HA ILE A 100 120.797 7.306 3.292 1.00 0.00 H new ATOM 0 HB ILE A 100 119.337 4.641 3.332 1.00 0.00 H new ATOM 0 HG12 ILE A 100 118.761 5.565 0.940 1.00 0.00 H new ATOM 0 HG13 ILE A 100 120.151 6.608 1.167 1.00 0.00 H new ATOM 0 HG21 ILE A 100 117.342 6.020 2.767 1.00 0.00 H new ATOM 0 HG22 ILE A 100 118.006 6.480 4.353 1.00 0.00 H new ATOM 0 HG23 ILE A 100 118.322 7.498 2.928 1.00 0.00 H new ATOM 0 HD11 ILE A 100 120.811 4.501 0.037 1.00 0.00 H new ATOM 0 HD12 ILE A 100 121.583 4.620 1.636 1.00 0.00 H new ATOM 0 HD13 ILE A 100 120.171 3.561 1.407 1.00 0.00 H new ATOM 1596 N LEU A 101 120.249 5.239 5.839 1.00 0.00 N ATOM 1597 CA LEU A 101 119.984 5.203 7.309 1.00 0.00 C ATOM 1598 C LEU A 101 121.124 5.907 8.032 1.00 0.00 C ATOM 1599 O LEU A 101 120.923 6.850 8.771 1.00 0.00 O ATOM 1600 CB LEU A 101 119.946 3.737 7.758 1.00 0.00 C ATOM 1601 CG LEU A 101 118.901 3.548 8.852 1.00 0.00 C ATOM 1602 CD1 LEU A 101 119.147 4.554 9.976 1.00 0.00 C ATOM 1603 CD2 LEU A 101 117.513 3.769 8.263 1.00 0.00 C ATOM 0 H LEU A 101 120.344 4.324 5.398 1.00 0.00 H new ATOM 0 HA LEU A 101 119.038 5.695 7.536 1.00 0.00 H new ATOM 0 HB2 LEU A 101 119.714 3.095 6.908 1.00 0.00 H new ATOM 0 HB3 LEU A 101 120.927 3.436 8.126 1.00 0.00 H new ATOM 0 HG LEU A 101 118.971 2.537 9.254 1.00 0.00 H new ATOM 0 HD11 LEU A 101 118.399 4.417 10.757 1.00 0.00 H new ATOM 0 HD12 LEU A 101 120.141 4.396 10.394 1.00 0.00 H new ATOM 0 HD13 LEU A 101 119.077 5.567 9.580 1.00 0.00 H new ATOM 0 HD21 LEU A 101 116.762 3.635 9.041 1.00 0.00 H new ATOM 0 HD22 LEU A 101 117.444 4.781 7.863 1.00 0.00 H new ATOM 0 HD23 LEU A 101 117.339 3.050 7.463 1.00 0.00 H new ATOM 1615 N ALA A 102 122.323 5.456 7.814 1.00 0.00 N ATOM 1616 CA ALA A 102 123.483 6.094 8.476 1.00 0.00 C ATOM 1617 C ALA A 102 123.551 7.552 8.043 1.00 0.00 C ATOM 1618 O ALA A 102 123.050 8.432 8.715 1.00 0.00 O ATOM 1619 CB ALA A 102 124.771 5.379 8.063 1.00 0.00 C ATOM 0 H ALA A 102 122.548 4.670 7.204 1.00 0.00 H new ATOM 0 HA ALA A 102 123.372 6.030 9.558 1.00 0.00 H new ATOM 0 HB1 ALA A 102 125.623 5.852 8.552 1.00 0.00 H new ATOM 0 HB2 ALA A 102 124.717 4.332 8.360 1.00 0.00 H new ATOM 0 HB3 ALA A 102 124.892 5.444 6.982 1.00 0.00 H new ATOM 1625 N LEU A 103 124.168 7.815 6.924 1.00 0.00 N ATOM 1626 CA LEU A 103 124.278 9.218 6.446 1.00 0.00 C ATOM 1627 C LEU A 103 124.981 10.050 7.517 1.00 0.00 C ATOM 1628 O LEU A 103 125.603 11.051 7.223 1.00 0.00 O ATOM 1629 CB LEU A 103 122.882 9.788 6.177 1.00 0.00 C ATOM 1630 CG LEU A 103 123.000 11.258 5.771 1.00 0.00 C ATOM 1631 CD1 LEU A 103 123.978 11.390 4.602 1.00 0.00 C ATOM 1632 CD2 LEU A 103 121.625 11.779 5.345 1.00 0.00 C ATOM 0 H LEU A 103 124.601 7.116 6.320 1.00 0.00 H new ATOM 0 HA LEU A 103 124.852 9.248 5.520 1.00 0.00 H new ATOM 0 HB2 LEU A 103 122.392 9.220 5.387 1.00 0.00 H new ATOM 0 HB3 LEU A 103 122.262 9.695 7.068 1.00 0.00 H new ATOM 0 HG LEU A 103 123.366 11.840 6.617 1.00 0.00 H new ATOM 0 HD11 LEU A 103 124.061 12.438 4.314 1.00 0.00 H new ATOM 0 HD12 LEU A 103 124.957 11.018 4.903 1.00 0.00 H new ATOM 0 HD13 LEU A 103 123.613 10.809 3.755 1.00 0.00 H new ATOM 0 HD21 LEU A 103 121.707 12.827 5.055 1.00 0.00 H new ATOM 0 HD22 LEU A 103 121.261 11.196 4.499 1.00 0.00 H new ATOM 0 HD23 LEU A 103 120.927 11.686 6.177 1.00 0.00 H new ATOM 1644 N LYS A 104 124.896 9.635 8.758 1.00 0.00 N ATOM 1645 CA LYS A 104 125.576 10.394 9.850 1.00 0.00 C ATOM 1646 C LYS A 104 126.778 11.123 9.253 1.00 0.00 C ATOM 1647 O LYS A 104 127.026 12.279 9.533 1.00 0.00 O ATOM 1648 CB LYS A 104 126.058 9.410 10.922 1.00 0.00 C ATOM 1649 CG LYS A 104 126.063 10.075 12.303 1.00 0.00 C ATOM 1650 CD LYS A 104 125.144 9.302 13.253 1.00 0.00 C ATOM 1651 CE LYS A 104 123.731 9.239 12.667 1.00 0.00 C ATOM 1652 NZ LYS A 104 122.734 9.460 13.751 1.00 0.00 N ATOM 0 H LYS A 104 124.386 8.805 9.060 1.00 0.00 H new ATOM 0 HA LYS A 104 124.888 11.110 10.300 1.00 0.00 H new ATOM 0 HB2 LYS A 104 125.410 8.534 10.937 1.00 0.00 H new ATOM 0 HB3 LYS A 104 127.061 9.060 10.677 1.00 0.00 H new ATOM 0 HG2 LYS A 104 127.077 10.099 12.702 1.00 0.00 H new ATOM 0 HG3 LYS A 104 125.729 11.109 12.220 1.00 0.00 H new ATOM 0 HD2 LYS A 104 125.529 8.294 13.407 1.00 0.00 H new ATOM 0 HD3 LYS A 104 125.122 9.788 14.229 1.00 0.00 H new ATOM 0 HE2 LYS A 104 123.614 9.995 11.891 1.00 0.00 H new ATOM 0 HE3 LYS A 104 123.564 8.270 12.196 1.00 0.00 H new ATOM 0 HZ1 LYS A 104 121.774 9.417 13.354 1.00 0.00 H new ATOM 0 HZ2 LYS A 104 122.841 8.723 14.477 1.00 0.00 H new ATOM 0 HZ3 LYS A 104 122.890 10.394 14.181 1.00 0.00 H new ATOM 1666 N ASP A 105 127.512 10.450 8.409 1.00 0.00 N ATOM 1667 CA ASP A 105 128.688 11.089 7.760 1.00 0.00 C ATOM 1668 C ASP A 105 128.518 10.983 6.243 1.00 0.00 C ATOM 1669 O ASP A 105 127.985 11.870 5.608 1.00 0.00 O ATOM 1670 CB ASP A 105 129.968 10.372 8.191 1.00 0.00 C ATOM 1671 CG ASP A 105 130.402 10.882 9.566 1.00 0.00 C ATOM 1672 OD1 ASP A 105 129.573 10.891 10.461 1.00 0.00 O ATOM 1673 OD2 ASP A 105 131.555 11.257 9.701 1.00 0.00 O ATOM 0 H ASP A 105 127.345 9.480 8.141 1.00 0.00 H new ATOM 0 HA ASP A 105 128.758 12.136 8.056 1.00 0.00 H new ATOM 0 HB2 ASP A 105 129.800 9.296 8.227 1.00 0.00 H new ATOM 0 HB3 ASP A 105 130.758 10.546 7.461 1.00 0.00 H new ATOM 1678 N GLN A 106 128.947 9.893 5.662 1.00 0.00 N ATOM 1679 CA GLN A 106 128.791 9.713 4.187 1.00 0.00 C ATOM 1680 C GLN A 106 129.791 8.665 3.682 1.00 0.00 C ATOM 1681 O GLN A 106 129.408 7.616 3.200 1.00 0.00 O ATOM 1682 CB GLN A 106 129.031 11.046 3.466 1.00 0.00 C ATOM 1683 CG GLN A 106 127.689 11.670 3.068 1.00 0.00 C ATOM 1684 CD GLN A 106 127.802 13.195 3.111 1.00 0.00 C ATOM 1685 OE1 GLN A 106 128.416 13.745 4.003 1.00 0.00 O ATOM 1686 NE2 GLN A 106 127.232 13.906 2.177 1.00 0.00 N ATOM 0 H GLN A 106 129.400 9.118 6.146 1.00 0.00 H new ATOM 0 HA GLN A 106 127.777 9.373 3.978 1.00 0.00 H new ATOM 0 HB2 GLN A 106 129.581 11.727 4.115 1.00 0.00 H new ATOM 0 HB3 GLN A 106 129.645 10.885 2.580 1.00 0.00 H new ATOM 0 HG2 GLN A 106 127.407 11.344 2.067 1.00 0.00 H new ATOM 0 HG3 GLN A 106 126.904 11.334 3.746 1.00 0.00 H new ATOM 0 HE21 GLN A 106 126.716 13.444 1.428 1.00 0.00 H new ATOM 0 HE22 GLN A 106 127.302 14.923 2.196 1.00 0.00 H new ATOM 1695 N PRO A 107 131.063 8.949 3.782 1.00 0.00 N ATOM 1696 CA PRO A 107 132.137 8.021 3.317 1.00 0.00 C ATOM 1697 C PRO A 107 132.187 6.709 4.108 1.00 0.00 C ATOM 1698 O PRO A 107 132.793 5.749 3.680 1.00 0.00 O ATOM 1699 CB PRO A 107 133.431 8.812 3.533 1.00 0.00 C ATOM 1700 CG PRO A 107 133.096 9.846 4.554 1.00 0.00 C ATOM 1701 CD PRO A 107 131.624 10.186 4.347 1.00 0.00 C ATOM 0 HA PRO A 107 131.968 7.720 2.283 1.00 0.00 H new ATOM 0 HB2 PRO A 107 134.235 8.163 3.880 1.00 0.00 H new ATOM 0 HB3 PRO A 107 133.770 9.272 2.605 1.00 0.00 H new ATOM 0 HG2 PRO A 107 133.271 9.469 5.562 1.00 0.00 H new ATOM 0 HG3 PRO A 107 133.721 10.731 4.432 1.00 0.00 H new ATOM 0 HD2 PRO A 107 131.138 10.455 5.285 1.00 0.00 H new ATOM 0 HD3 PRO A 107 131.498 11.030 3.669 1.00 0.00 H new ATOM 1709 N GLU A 108 131.567 6.650 5.256 1.00 0.00 N ATOM 1710 CA GLU A 108 131.613 5.382 6.044 1.00 0.00 C ATOM 1711 C GLU A 108 130.705 4.345 5.385 1.00 0.00 C ATOM 1712 O GLU A 108 131.122 3.248 5.056 1.00 0.00 O ATOM 1713 CB GLU A 108 131.144 5.639 7.482 1.00 0.00 C ATOM 1714 CG GLU A 108 130.346 6.940 7.548 1.00 0.00 C ATOM 1715 CD GLU A 108 129.055 6.790 6.742 1.00 0.00 C ATOM 1716 OE1 GLU A 108 128.392 5.778 6.906 1.00 0.00 O ATOM 1717 OE2 GLU A 108 128.751 7.684 5.973 1.00 0.00 O ATOM 0 H GLU A 108 131.037 7.412 5.679 1.00 0.00 H new ATOM 0 HA GLU A 108 132.637 5.010 6.068 1.00 0.00 H new ATOM 0 HB2 GLU A 108 130.529 4.808 7.826 1.00 0.00 H new ATOM 0 HB3 GLU A 108 132.004 5.696 8.149 1.00 0.00 H new ATOM 0 HG2 GLU A 108 130.113 7.184 8.585 1.00 0.00 H new ATOM 0 HG3 GLU A 108 130.940 7.764 7.152 1.00 0.00 H new ATOM 1724 N ALA A 109 129.469 4.688 5.173 1.00 0.00 N ATOM 1725 CA ALA A 109 128.538 3.734 4.526 1.00 0.00 C ATOM 1726 C ALA A 109 129.077 3.397 3.137 1.00 0.00 C ATOM 1727 O ALA A 109 129.005 2.273 2.679 1.00 0.00 O ATOM 1728 CB ALA A 109 127.160 4.384 4.415 1.00 0.00 C ATOM 0 H ALA A 109 129.064 5.591 5.421 1.00 0.00 H new ATOM 0 HA ALA A 109 128.453 2.820 5.113 1.00 0.00 H new ATOM 0 HB1 ALA A 109 126.467 3.689 3.940 1.00 0.00 H new ATOM 0 HB2 ALA A 109 126.795 4.636 5.411 1.00 0.00 H new ATOM 0 HB3 ALA A 109 127.233 5.291 3.815 1.00 0.00 H new ATOM 1734 N ALA A 110 129.637 4.370 2.475 1.00 0.00 N ATOM 1735 CA ALA A 110 130.207 4.126 1.125 1.00 0.00 C ATOM 1736 C ALA A 110 131.428 3.219 1.262 1.00 0.00 C ATOM 1737 O ALA A 110 131.697 2.394 0.412 1.00 0.00 O ATOM 1738 CB ALA A 110 130.623 5.457 0.495 1.00 0.00 C ATOM 0 H ALA A 110 129.724 5.328 2.814 1.00 0.00 H new ATOM 0 HA ALA A 110 129.461 3.649 0.489 1.00 0.00 H new ATOM 0 HB1 ALA A 110 131.041 5.276 -0.495 1.00 0.00 H new ATOM 0 HB2 ALA A 110 129.752 6.106 0.408 1.00 0.00 H new ATOM 0 HB3 ALA A 110 131.373 5.938 1.123 1.00 0.00 H new ATOM 1744 N GLN A 111 132.167 3.350 2.333 1.00 0.00 N ATOM 1745 CA GLN A 111 133.355 2.474 2.510 1.00 0.00 C ATOM 1746 C GLN A 111 132.905 1.033 2.321 1.00 0.00 C ATOM 1747 O GLN A 111 133.480 0.284 1.550 1.00 0.00 O ATOM 1748 CB GLN A 111 133.947 2.663 3.907 1.00 0.00 C ATOM 1749 CG GLN A 111 134.702 3.994 3.957 1.00 0.00 C ATOM 1750 CD GLN A 111 136.197 3.734 4.155 1.00 0.00 C ATOM 1751 OE1 GLN A 111 136.750 4.057 5.188 1.00 0.00 O ATOM 1752 NE2 GLN A 111 136.879 3.159 3.202 1.00 0.00 N ATOM 0 H GLN A 111 131.999 4.020 3.084 1.00 0.00 H new ATOM 0 HA GLN A 111 134.124 2.729 1.781 1.00 0.00 H new ATOM 0 HB2 GLN A 111 133.155 2.652 4.655 1.00 0.00 H new ATOM 0 HB3 GLN A 111 134.621 1.840 4.144 1.00 0.00 H new ATOM 0 HG2 GLN A 111 134.539 4.550 3.034 1.00 0.00 H new ATOM 0 HG3 GLN A 111 134.319 4.609 4.771 1.00 0.00 H new ATOM 0 HE21 GLN A 111 136.415 2.888 2.335 1.00 0.00 H new ATOM 0 HE22 GLN A 111 137.876 2.981 3.324 1.00 0.00 H new ATOM 1761 N LEU A 112 131.854 0.641 2.986 1.00 0.00 N ATOM 1762 CA LEU A 112 131.358 -0.741 2.793 1.00 0.00 C ATOM 1763 C LEU A 112 131.114 -0.923 1.300 1.00 0.00 C ATOM 1764 O LEU A 112 131.519 -1.897 0.703 1.00 0.00 O ATOM 1765 CB LEU A 112 130.053 -0.938 3.563 1.00 0.00 C ATOM 1766 CG LEU A 112 130.362 -1.481 4.957 1.00 0.00 C ATOM 1767 CD1 LEU A 112 130.994 -2.870 4.842 1.00 0.00 C ATOM 1768 CD2 LEU A 112 131.337 -0.541 5.665 1.00 0.00 C ATOM 0 H LEU A 112 131.326 1.212 3.646 1.00 0.00 H new ATOM 0 HA LEU A 112 132.081 -1.470 3.161 1.00 0.00 H new ATOM 0 HB2 LEU A 112 129.517 0.008 3.640 1.00 0.00 H new ATOM 0 HB3 LEU A 112 129.403 -1.630 3.027 1.00 0.00 H new ATOM 0 HG LEU A 112 129.437 -1.550 5.529 1.00 0.00 H new ATOM 0 HD11 LEU A 112 131.213 -3.254 5.838 1.00 0.00 H new ATOM 0 HD12 LEU A 112 130.302 -3.544 4.338 1.00 0.00 H new ATOM 0 HD13 LEU A 112 131.918 -2.803 4.268 1.00 0.00 H new ATOM 0 HD21 LEU A 112 131.558 -0.928 6.660 1.00 0.00 H new ATOM 0 HD22 LEU A 112 132.260 -0.473 5.089 1.00 0.00 H new ATOM 0 HD23 LEU A 112 130.890 0.449 5.752 1.00 0.00 H new ATOM 1780 N ALA A 113 130.479 0.037 0.685 1.00 0.00 N ATOM 1781 CA ALA A 113 130.234 -0.056 -0.778 1.00 0.00 C ATOM 1782 C ALA A 113 131.554 -0.407 -1.469 1.00 0.00 C ATOM 1783 O ALA A 113 131.577 -1.003 -2.528 1.00 0.00 O ATOM 1784 CB ALA A 113 129.723 1.288 -1.301 1.00 0.00 C ATOM 0 H ALA A 113 130.120 0.880 1.134 1.00 0.00 H new ATOM 0 HA ALA A 113 129.487 -0.823 -0.984 1.00 0.00 H new ATOM 0 HB1 ALA A 113 129.544 1.217 -2.374 1.00 0.00 H new ATOM 0 HB2 ALA A 113 128.793 1.546 -0.795 1.00 0.00 H new ATOM 0 HB3 ALA A 113 130.467 2.060 -1.108 1.00 0.00 H new ATOM 1790 N LEU A 114 132.657 -0.038 -0.870 1.00 0.00 N ATOM 1791 CA LEU A 114 133.984 -0.345 -1.480 1.00 0.00 C ATOM 1792 C LEU A 114 134.206 -1.855 -1.450 1.00 0.00 C ATOM 1793 O LEU A 114 134.415 -2.492 -2.475 1.00 0.00 O ATOM 1794 CB LEU A 114 135.089 0.351 -0.682 1.00 0.00 C ATOM 1795 CG LEU A 114 136.284 0.629 -1.595 1.00 0.00 C ATOM 1796 CD1 LEU A 114 136.694 -0.661 -2.307 1.00 0.00 C ATOM 1797 CD2 LEU A 114 135.900 1.686 -2.635 1.00 0.00 C ATOM 0 H LEU A 114 132.695 0.464 0.017 1.00 0.00 H new ATOM 0 HA LEU A 114 134.008 0.011 -2.510 1.00 0.00 H new ATOM 0 HB2 LEU A 114 134.715 1.284 -0.261 1.00 0.00 H new ATOM 0 HB3 LEU A 114 135.396 -0.275 0.155 1.00 0.00 H new ATOM 0 HG LEU A 114 137.119 0.995 -0.997 1.00 0.00 H new ATOM 0 HD11 LEU A 114 137.546 -0.463 -2.958 1.00 0.00 H new ATOM 0 HD12 LEU A 114 136.970 -1.413 -1.568 1.00 0.00 H new ATOM 0 HD13 LEU A 114 135.859 -1.028 -2.904 1.00 0.00 H new ATOM 0 HD21 LEU A 114 136.752 1.883 -3.285 1.00 0.00 H new ATOM 0 HD22 LEU A 114 135.064 1.322 -3.233 1.00 0.00 H new ATOM 0 HD23 LEU A 114 135.609 2.606 -2.128 1.00 0.00 H new ATOM 1809 N ARG A 115 134.133 -2.458 -0.295 1.00 0.00 N ATOM 1810 CA ARG A 115 134.311 -3.926 -0.263 1.00 0.00 C ATOM 1811 C ARG A 115 133.312 -4.488 -1.265 1.00 0.00 C ATOM 1812 O ARG A 115 133.635 -5.305 -2.097 1.00 0.00 O ATOM 1813 CB ARG A 115 134.046 -4.475 1.145 1.00 0.00 C ATOM 1814 CG ARG A 115 135.337 -4.415 1.964 1.00 0.00 C ATOM 1815 CD ARG A 115 135.539 -2.995 2.497 1.00 0.00 C ATOM 1816 NE ARG A 115 136.990 -2.757 2.739 1.00 0.00 N ATOM 1817 CZ ARG A 115 137.821 -2.715 1.733 1.00 0.00 C ATOM 1818 NH1 ARG A 115 137.381 -2.882 0.516 1.00 0.00 N ATOM 1819 NH2 ARG A 115 139.091 -2.507 1.945 1.00 0.00 N ATOM 0 H ARG A 115 133.962 -2.007 0.604 1.00 0.00 H new ATOM 0 HA ARG A 115 135.331 -4.211 -0.519 1.00 0.00 H new ATOM 0 HB2 ARG A 115 133.265 -3.893 1.634 1.00 0.00 H new ATOM 0 HB3 ARG A 115 133.687 -5.503 1.085 1.00 0.00 H new ATOM 0 HG2 ARG A 115 135.288 -5.122 2.792 1.00 0.00 H new ATOM 0 HG3 ARG A 115 136.186 -4.707 1.346 1.00 0.00 H new ATOM 0 HD2 ARG A 115 135.155 -2.268 1.781 1.00 0.00 H new ATOM 0 HD3 ARG A 115 134.978 -2.859 3.422 1.00 0.00 H new ATOM 0 HE ARG A 115 137.334 -2.627 3.690 1.00 0.00 H new ATOM 0 HH11 ARG A 115 136.388 -3.045 0.351 1.00 0.00 H new ATOM 0 HH12 ARG A 115 138.030 -2.849 -0.270 1.00 0.00 H new ATOM 0 HH21 ARG A 115 139.435 -2.377 2.897 1.00 0.00 H new ATOM 0 HH22 ARG A 115 139.741 -2.474 1.159 1.00 0.00 H new ATOM 1833 N VAL A 116 132.110 -4.000 -1.250 1.00 0.00 N ATOM 1834 CA VAL A 116 131.138 -4.477 -2.256 1.00 0.00 C ATOM 1835 C VAL A 116 131.855 -4.406 -3.600 1.00 0.00 C ATOM 1836 O VAL A 116 131.651 -5.216 -4.477 1.00 0.00 O ATOM 1837 CB VAL A 116 129.911 -3.560 -2.246 1.00 0.00 C ATOM 1838 CG1 VAL A 116 129.434 -3.296 -3.674 1.00 0.00 C ATOM 1839 CG2 VAL A 116 128.778 -4.213 -1.447 1.00 0.00 C ATOM 0 H VAL A 116 131.763 -3.301 -0.593 1.00 0.00 H new ATOM 0 HA VAL A 116 130.795 -5.492 -2.053 1.00 0.00 H new ATOM 0 HB VAL A 116 130.189 -2.614 -1.781 1.00 0.00 H new ATOM 0 HG11 VAL A 116 128.562 -2.643 -3.651 1.00 0.00 H new ATOM 0 HG12 VAL A 116 130.232 -2.816 -4.241 1.00 0.00 H new ATOM 0 HG13 VAL A 116 129.168 -4.240 -4.149 1.00 0.00 H new ATOM 0 HG21 VAL A 116 127.909 -3.555 -1.444 1.00 0.00 H new ATOM 0 HG22 VAL A 116 128.511 -5.165 -1.906 1.00 0.00 H new ATOM 0 HG23 VAL A 116 129.107 -4.384 -0.422 1.00 0.00 H new ATOM 1849 N GLY A 117 132.734 -3.453 -3.749 1.00 0.00 N ATOM 1850 CA GLY A 117 133.499 -3.352 -5.015 1.00 0.00 C ATOM 1851 C GLY A 117 134.096 -4.725 -5.306 1.00 0.00 C ATOM 1852 O GLY A 117 133.972 -5.260 -6.403 1.00 0.00 O ATOM 0 H GLY A 117 132.952 -2.744 -3.049 1.00 0.00 H new ATOM 0 HA2 GLY A 117 132.849 -3.037 -5.831 1.00 0.00 H new ATOM 0 HA3 GLY A 117 134.286 -2.603 -4.928 1.00 0.00 H new ATOM 1856 N ILE A 118 134.732 -5.324 -4.329 1.00 0.00 N ATOM 1857 CA ILE A 118 135.304 -6.670 -4.589 1.00 0.00 C ATOM 1858 C ILE A 118 134.195 -7.547 -5.153 1.00 0.00 C ATOM 1859 O ILE A 118 134.435 -8.431 -5.951 1.00 0.00 O ATOM 1860 CB ILE A 118 135.927 -7.302 -3.324 1.00 0.00 C ATOM 1861 CG1 ILE A 118 134.996 -7.248 -2.100 1.00 0.00 C ATOM 1862 CG2 ILE A 118 137.199 -6.533 -2.980 1.00 0.00 C ATOM 1863 CD1 ILE A 118 133.591 -7.765 -2.431 1.00 0.00 C ATOM 0 H ILE A 118 134.875 -4.949 -3.391 1.00 0.00 H new ATOM 0 HA ILE A 118 136.121 -6.579 -5.305 1.00 0.00 H new ATOM 0 HB ILE A 118 136.120 -8.351 -3.548 1.00 0.00 H new ATOM 0 HG12 ILE A 118 135.422 -7.844 -1.293 1.00 0.00 H new ATOM 0 HG13 ILE A 118 134.930 -6.222 -1.738 1.00 0.00 H new ATOM 0 HG21 ILE A 118 137.655 -6.964 -2.089 1.00 0.00 H new ATOM 0 HG22 ILE A 118 137.899 -6.597 -3.813 1.00 0.00 H new ATOM 0 HG23 ILE A 118 136.953 -5.488 -2.792 1.00 0.00 H new ATOM 0 HD11 ILE A 118 132.964 -7.711 -1.541 1.00 0.00 H new ATOM 0 HD12 ILE A 118 133.155 -7.153 -3.220 1.00 0.00 H new ATOM 0 HD13 ILE A 118 133.654 -8.800 -2.768 1.00 0.00 H new ATOM 1875 N ALA A 119 132.972 -7.298 -4.765 1.00 0.00 N ATOM 1876 CA ALA A 119 131.861 -8.108 -5.308 1.00 0.00 C ATOM 1877 C ALA A 119 131.650 -7.727 -6.769 1.00 0.00 C ATOM 1878 O ALA A 119 131.248 -8.541 -7.571 1.00 0.00 O ATOM 1879 CB ALA A 119 130.585 -7.868 -4.502 1.00 0.00 C ATOM 0 H ALA A 119 132.703 -6.573 -4.100 1.00 0.00 H new ATOM 0 HA ALA A 119 132.107 -9.168 -5.237 1.00 0.00 H new ATOM 0 HB1 ALA A 119 129.776 -8.471 -4.914 1.00 0.00 H new ATOM 0 HB2 ALA A 119 130.753 -8.148 -3.462 1.00 0.00 H new ATOM 0 HB3 ALA A 119 130.314 -6.813 -4.555 1.00 0.00 H new ATOM 1885 N VAL A 120 131.952 -6.515 -7.153 1.00 0.00 N ATOM 1886 CA VAL A 120 131.780 -6.177 -8.588 1.00 0.00 C ATOM 1887 C VAL A 120 132.495 -7.273 -9.345 1.00 0.00 C ATOM 1888 O VAL A 120 132.019 -7.781 -10.342 1.00 0.00 O ATOM 1889 CB VAL A 120 132.398 -4.819 -8.897 1.00 0.00 C ATOM 1890 CG1 VAL A 120 132.223 -4.509 -10.383 1.00 0.00 C ATOM 1891 CG2 VAL A 120 131.698 -3.746 -8.065 1.00 0.00 C ATOM 0 H VAL A 120 132.300 -5.767 -6.553 1.00 0.00 H new ATOM 0 HA VAL A 120 130.728 -6.112 -8.866 1.00 0.00 H new ATOM 0 HB VAL A 120 133.460 -4.834 -8.653 1.00 0.00 H new ATOM 0 HG11 VAL A 120 132.664 -3.538 -10.607 1.00 0.00 H new ATOM 0 HG12 VAL A 120 132.718 -5.278 -10.976 1.00 0.00 H new ATOM 0 HG13 VAL A 120 131.161 -4.490 -10.628 1.00 0.00 H new ATOM 0 HG21 VAL A 120 132.137 -2.772 -8.283 1.00 0.00 H new ATOM 0 HG22 VAL A 120 130.637 -3.729 -8.312 1.00 0.00 H new ATOM 0 HG23 VAL A 120 131.820 -3.970 -7.005 1.00 0.00 H new ATOM 1901 N ALA A 121 133.606 -7.698 -8.822 1.00 0.00 N ATOM 1902 CA ALA A 121 134.323 -8.832 -9.450 1.00 0.00 C ATOM 1903 C ALA A 121 133.720 -10.116 -8.867 1.00 0.00 C ATOM 1904 O ALA A 121 133.860 -11.195 -9.407 1.00 0.00 O ATOM 1905 CB ALA A 121 135.814 -8.757 -9.113 1.00 0.00 C ATOM 0 H ALA A 121 134.047 -7.309 -7.988 1.00 0.00 H new ATOM 0 HA ALA A 121 134.220 -8.808 -10.535 1.00 0.00 H new ATOM 0 HB1 ALA A 121 136.335 -9.594 -9.578 1.00 0.00 H new ATOM 0 HB2 ALA A 121 136.225 -7.820 -9.488 1.00 0.00 H new ATOM 0 HB3 ALA A 121 135.945 -8.804 -8.032 1.00 0.00 H new ATOM 1911 N LYS A 122 133.050 -9.982 -7.746 1.00 0.00 N ATOM 1912 CA LYS A 122 132.419 -11.156 -7.069 1.00 0.00 C ATOM 1913 C LYS A 122 130.971 -10.816 -6.674 1.00 0.00 C ATOM 1914 O LYS A 122 130.578 -10.984 -5.537 1.00 0.00 O ATOM 1915 CB LYS A 122 133.225 -11.512 -5.815 1.00 0.00 C ATOM 1916 CG LYS A 122 134.156 -12.687 -6.122 1.00 0.00 C ATOM 1917 CD LYS A 122 135.058 -12.952 -4.916 1.00 0.00 C ATOM 1918 CE LYS A 122 136.361 -12.165 -5.068 1.00 0.00 C ATOM 1919 NZ LYS A 122 136.075 -10.705 -4.983 1.00 0.00 N ATOM 0 H LYS A 122 132.913 -9.093 -7.266 1.00 0.00 H new ATOM 0 HA LYS A 122 132.411 -12.006 -7.752 1.00 0.00 H new ATOM 0 HB2 LYS A 122 133.806 -10.650 -5.487 1.00 0.00 H new ATOM 0 HB3 LYS A 122 132.551 -11.772 -4.999 1.00 0.00 H new ATOM 0 HG2 LYS A 122 133.571 -13.577 -6.355 1.00 0.00 H new ATOM 0 HG3 LYS A 122 134.762 -12.465 -7.001 1.00 0.00 H new ATOM 0 HD2 LYS A 122 134.550 -12.659 -3.997 1.00 0.00 H new ATOM 0 HD3 LYS A 122 135.272 -14.018 -4.836 1.00 0.00 H new ATOM 0 HE2 LYS A 122 137.065 -12.454 -4.288 1.00 0.00 H new ATOM 0 HE3 LYS A 122 136.830 -12.399 -6.024 1.00 0.00 H new ATOM 0 HZ1 LYS A 122 136.886 -10.217 -4.553 1.00 0.00 H new ATOM 0 HZ2 LYS A 122 135.910 -10.327 -5.938 1.00 0.00 H new ATOM 0 HZ3 LYS A 122 135.229 -10.550 -4.398 1.00 0.00 H new ATOM 1933 N SER A 123 130.185 -10.309 -7.588 1.00 0.00 N ATOM 1934 CA SER A 123 128.776 -9.931 -7.247 1.00 0.00 C ATOM 1935 C SER A 123 128.167 -10.971 -6.314 1.00 0.00 C ATOM 1936 O SER A 123 127.142 -10.748 -5.701 1.00 0.00 O ATOM 1937 CB SER A 123 127.944 -9.841 -8.526 1.00 0.00 C ATOM 1938 OG SER A 123 128.811 -9.862 -9.653 1.00 0.00 O ATOM 0 H SER A 123 130.456 -10.139 -8.557 1.00 0.00 H new ATOM 0 HA SER A 123 128.780 -8.963 -6.747 1.00 0.00 H new ATOM 0 HB2 SER A 123 127.243 -10.674 -8.577 1.00 0.00 H new ATOM 0 HB3 SER A 123 127.352 -8.926 -8.525 1.00 0.00 H new ATOM 0 HG SER A 123 128.280 -9.806 -10.475 1.00 0.00 H new ATOM 1944 N ASP A 124 128.791 -12.097 -6.194 1.00 0.00 N ATOM 1945 CA ASP A 124 128.254 -13.148 -5.291 1.00 0.00 C ATOM 1946 C ASP A 124 129.402 -14.048 -4.831 1.00 0.00 C ATOM 1947 O ASP A 124 129.346 -15.255 -4.957 1.00 0.00 O ATOM 1948 CB ASP A 124 127.201 -13.971 -6.041 1.00 0.00 C ATOM 1949 CG ASP A 124 127.894 -14.983 -6.955 1.00 0.00 C ATOM 1950 OD1 ASP A 124 128.779 -14.579 -7.691 1.00 0.00 O ATOM 1951 OD2 ASP A 124 127.528 -16.146 -6.903 1.00 0.00 O ATOM 0 H ASP A 124 129.653 -12.341 -6.682 1.00 0.00 H new ATOM 0 HA ASP A 124 127.788 -12.690 -4.418 1.00 0.00 H new ATOM 0 HB2 ASP A 124 126.557 -14.489 -5.331 1.00 0.00 H new ATOM 0 HB3 ASP A 124 126.562 -13.313 -6.629 1.00 0.00 H new ATOM 1956 N GLY A 125 130.450 -13.469 -4.302 1.00 0.00 N ATOM 1957 CA GLY A 125 131.598 -14.301 -3.845 1.00 0.00 C ATOM 1958 C GLY A 125 132.332 -13.614 -2.688 1.00 0.00 C ATOM 1959 O GLY A 125 132.853 -14.268 -1.807 1.00 0.00 O ATOM 0 H GLY A 125 130.558 -12.464 -4.168 1.00 0.00 H new ATOM 0 HA2 GLY A 125 131.241 -15.280 -3.526 1.00 0.00 H new ATOM 0 HA3 GLY A 125 132.287 -14.467 -4.673 1.00 0.00 H new ATOM 1963 N ASN A 126 132.394 -12.306 -2.680 1.00 0.00 N ATOM 1964 CA ASN A 126 133.115 -11.612 -1.571 1.00 0.00 C ATOM 1965 C ASN A 126 132.160 -10.689 -0.802 1.00 0.00 C ATOM 1966 O ASN A 126 130.970 -10.664 -1.046 1.00 0.00 O ATOM 1967 CB ASN A 126 134.282 -10.806 -2.144 1.00 0.00 C ATOM 1968 CG ASN A 126 135.572 -11.621 -2.026 1.00 0.00 C ATOM 1969 OD1 ASN A 126 135.531 -12.820 -1.832 1.00 0.00 O ATOM 1970 ND2 ASN A 126 136.724 -11.018 -2.137 1.00 0.00 N ATOM 0 H ASN A 126 131.982 -11.695 -3.385 1.00 0.00 H new ATOM 0 HA ASN A 126 133.500 -12.359 -0.877 1.00 0.00 H new ATOM 0 HB2 ASN A 126 134.089 -10.559 -3.188 1.00 0.00 H new ATOM 0 HB3 ASN A 126 134.385 -9.863 -1.607 1.00 0.00 H new ATOM 0 HD21 ASN A 126 137.589 -11.553 -2.061 1.00 0.00 H new ATOM 0 HD22 ASN A 126 136.759 -10.012 -2.300 1.00 0.00 H new ATOM 1977 N PHE A 127 132.681 -9.949 0.144 1.00 0.00 N ATOM 1978 CA PHE A 127 131.828 -9.038 0.967 1.00 0.00 C ATOM 1979 C PHE A 127 131.285 -9.808 2.169 1.00 0.00 C ATOM 1980 O PHE A 127 131.466 -11.004 2.281 1.00 0.00 O ATOM 1981 CB PHE A 127 130.656 -8.497 0.146 1.00 0.00 C ATOM 1982 CG PHE A 127 130.260 -7.150 0.706 1.00 0.00 C ATOM 1983 CD1 PHE A 127 131.083 -6.043 0.488 1.00 0.00 C ATOM 1984 CD2 PHE A 127 129.083 -7.009 1.454 1.00 0.00 C ATOM 1985 CE1 PHE A 127 130.734 -4.794 1.013 1.00 0.00 C ATOM 1986 CE2 PHE A 127 128.734 -5.757 1.980 1.00 0.00 C ATOM 1987 CZ PHE A 127 129.561 -4.650 1.758 1.00 0.00 C ATOM 0 H PHE A 127 133.672 -9.937 0.384 1.00 0.00 H new ATOM 0 HA PHE A 127 132.437 -8.198 1.299 1.00 0.00 H new ATOM 0 HB2 PHE A 127 130.939 -8.403 -0.902 1.00 0.00 H new ATOM 0 HB3 PHE A 127 129.813 -9.187 0.188 1.00 0.00 H new ATOM 0 HD1 PHE A 127 131.991 -6.151 -0.087 1.00 0.00 H new ATOM 0 HD2 PHE A 127 128.446 -7.864 1.625 1.00 0.00 H new ATOM 0 HE1 PHE A 127 131.372 -3.940 0.842 1.00 0.00 H new ATOM 0 HE2 PHE A 127 127.827 -5.647 2.556 1.00 0.00 H new ATOM 0 HZ PHE A 127 129.293 -3.685 2.162 1.00 0.00 H new ATOM 1997 N ASP A 128 130.625 -9.132 3.068 1.00 0.00 N ATOM 1998 CA ASP A 128 130.070 -9.816 4.262 1.00 0.00 C ATOM 1999 C ASP A 128 131.215 -10.293 5.153 1.00 0.00 C ATOM 2000 O ASP A 128 130.998 -10.871 6.194 1.00 0.00 O ATOM 2001 CB ASP A 128 129.224 -11.012 3.817 1.00 0.00 C ATOM 2002 CG ASP A 128 128.282 -10.581 2.693 1.00 0.00 C ATOM 2003 OD1 ASP A 128 128.700 -10.624 1.547 1.00 0.00 O ATOM 2004 OD2 ASP A 128 127.158 -10.216 2.995 1.00 0.00 O ATOM 0 H ASP A 128 130.447 -8.129 3.024 1.00 0.00 H new ATOM 0 HA ASP A 128 129.444 -9.123 4.823 1.00 0.00 H new ATOM 0 HB2 ASP A 128 129.870 -11.820 3.474 1.00 0.00 H new ATOM 0 HB3 ASP A 128 128.650 -11.398 4.659 1.00 0.00 H new ATOM 2009 N ASP A 129 132.434 -10.046 4.761 1.00 0.00 N ATOM 2010 CA ASP A 129 133.584 -10.485 5.602 1.00 0.00 C ATOM 2011 C ASP A 129 134.182 -9.271 6.306 1.00 0.00 C ATOM 2012 O ASP A 129 134.479 -9.307 7.484 1.00 0.00 O ATOM 2013 CB ASP A 129 134.646 -11.142 4.717 1.00 0.00 C ATOM 2014 CG ASP A 129 134.051 -12.374 4.034 1.00 0.00 C ATOM 2015 OD1 ASP A 129 133.343 -13.112 4.699 1.00 0.00 O ATOM 2016 OD2 ASP A 129 134.313 -12.559 2.857 1.00 0.00 O ATOM 0 H ASP A 129 132.684 -9.561 3.899 1.00 0.00 H new ATOM 0 HA ASP A 129 133.241 -11.206 6.344 1.00 0.00 H new ATOM 0 HB2 ASP A 129 135.000 -10.433 3.968 1.00 0.00 H new ATOM 0 HB3 ASP A 129 135.509 -11.428 5.318 1.00 0.00 H new ATOM 2021 N ASP A 130 134.353 -8.191 5.598 1.00 0.00 N ATOM 2022 CA ASP A 130 134.921 -6.974 6.233 1.00 0.00 C ATOM 2023 C ASP A 130 133.807 -6.238 6.974 1.00 0.00 C ATOM 2024 O ASP A 130 134.056 -5.436 7.850 1.00 0.00 O ATOM 2025 CB ASP A 130 135.512 -6.061 5.158 1.00 0.00 C ATOM 2026 CG ASP A 130 136.784 -5.398 5.690 1.00 0.00 C ATOM 2027 OD1 ASP A 130 137.568 -6.087 6.322 1.00 0.00 O ATOM 2028 OD2 ASP A 130 136.954 -4.213 5.455 1.00 0.00 O ATOM 0 H ASP A 130 134.124 -8.100 4.608 1.00 0.00 H new ATOM 0 HA ASP A 130 135.708 -7.256 6.933 1.00 0.00 H new ATOM 0 HB2 ASP A 130 135.738 -6.638 4.261 1.00 0.00 H new ATOM 0 HB3 ASP A 130 134.785 -5.300 4.873 1.00 0.00 H new ATOM 2033 N GLU A 131 132.575 -6.510 6.633 1.00 0.00 N ATOM 2034 CA GLU A 131 131.448 -5.827 7.319 1.00 0.00 C ATOM 2035 C GLU A 131 131.636 -5.942 8.827 1.00 0.00 C ATOM 2036 O GLU A 131 131.188 -5.108 9.580 1.00 0.00 O ATOM 2037 CB GLU A 131 130.128 -6.481 6.914 1.00 0.00 C ATOM 2038 CG GLU A 131 129.735 -6.023 5.506 1.00 0.00 C ATOM 2039 CD GLU A 131 128.672 -4.926 5.601 1.00 0.00 C ATOM 2040 OE1 GLU A 131 128.606 -4.280 6.633 1.00 0.00 O ATOM 2041 OE2 GLU A 131 127.943 -4.750 4.639 1.00 0.00 O ATOM 0 H GLU A 131 132.304 -7.176 5.909 1.00 0.00 H new ATOM 0 HA GLU A 131 131.428 -4.776 7.032 1.00 0.00 H new ATOM 0 HB2 GLU A 131 130.226 -7.566 6.940 1.00 0.00 H new ATOM 0 HB3 GLU A 131 129.346 -6.215 7.625 1.00 0.00 H new ATOM 0 HG2 GLU A 131 130.611 -5.649 4.976 1.00 0.00 H new ATOM 0 HG3 GLU A 131 129.351 -6.867 4.932 1.00 0.00 H new ATOM 2048 N LYS A 132 132.300 -6.964 9.280 1.00 0.00 N ATOM 2049 CA LYS A 132 132.516 -7.103 10.743 1.00 0.00 C ATOM 2050 C LYS A 132 133.513 -6.036 11.190 1.00 0.00 C ATOM 2051 O LYS A 132 133.228 -5.241 12.059 1.00 0.00 O ATOM 2052 CB LYS A 132 133.060 -8.498 11.042 1.00 0.00 C ATOM 2053 CG LYS A 132 132.339 -9.507 10.145 1.00 0.00 C ATOM 2054 CD LYS A 132 131.934 -10.734 10.962 1.00 0.00 C ATOM 2055 CE LYS A 132 133.164 -11.302 11.666 1.00 0.00 C ATOM 2056 NZ LYS A 132 133.020 -12.778 11.805 1.00 0.00 N ATOM 0 H LYS A 132 132.700 -7.705 8.705 1.00 0.00 H new ATOM 0 HA LYS A 132 131.578 -6.971 11.282 1.00 0.00 H new ATOM 0 HB2 LYS A 132 134.134 -8.532 10.861 1.00 0.00 H new ATOM 0 HB3 LYS A 132 132.905 -8.747 12.092 1.00 0.00 H new ATOM 0 HG2 LYS A 132 131.456 -9.047 9.702 1.00 0.00 H new ATOM 0 HG3 LYS A 132 132.989 -9.805 9.323 1.00 0.00 H new ATOM 0 HD2 LYS A 132 131.175 -10.462 11.695 1.00 0.00 H new ATOM 0 HD3 LYS A 132 131.493 -11.489 10.311 1.00 0.00 H new ATOM 0 HE2 LYS A 132 134.063 -11.066 11.097 1.00 0.00 H new ATOM 0 HE3 LYS A 132 133.278 -10.843 12.648 1.00 0.00 H new ATOM 0 HZ1 LYS A 132 133.858 -13.165 12.285 1.00 0.00 H new ATOM 0 HZ2 LYS A 132 132.170 -12.993 12.365 1.00 0.00 H new ATOM 0 HZ3 LYS A 132 132.931 -13.208 10.862 1.00 0.00 H new ATOM 2070 N SER A 133 134.669 -5.994 10.582 1.00 0.00 N ATOM 2071 CA SER A 133 135.672 -4.955 10.955 1.00 0.00 C ATOM 2072 C SER A 133 135.151 -3.589 10.491 1.00 0.00 C ATOM 2073 O SER A 133 135.449 -2.552 11.064 1.00 0.00 O ATOM 2074 CB SER A 133 136.999 -5.257 10.257 1.00 0.00 C ATOM 2075 OG SER A 133 136.779 -5.368 8.857 1.00 0.00 O ATOM 0 H SER A 133 134.962 -6.634 9.844 1.00 0.00 H new ATOM 0 HA SER A 133 135.827 -4.951 12.034 1.00 0.00 H new ATOM 0 HB2 SER A 133 137.719 -4.465 10.462 1.00 0.00 H new ATOM 0 HB3 SER A 133 137.424 -6.183 10.644 1.00 0.00 H new ATOM 0 HG SER A 133 135.816 -5.379 8.677 1.00 0.00 H new ATOM 2081 N ALA A 134 134.361 -3.594 9.455 1.00 0.00 N ATOM 2082 CA ALA A 134 133.799 -2.324 8.923 1.00 0.00 C ATOM 2083 C ALA A 134 132.719 -1.807 9.869 1.00 0.00 C ATOM 2084 O ALA A 134 132.732 -0.658 10.258 1.00 0.00 O ATOM 2085 CB ALA A 134 133.194 -2.568 7.538 1.00 0.00 C ATOM 0 H ALA A 134 134.078 -4.433 8.949 1.00 0.00 H new ATOM 0 HA ALA A 134 134.595 -1.584 8.843 1.00 0.00 H new ATOM 0 HB1 ALA A 134 132.783 -1.636 7.151 1.00 0.00 H new ATOM 0 HB2 ALA A 134 133.968 -2.932 6.862 1.00 0.00 H new ATOM 0 HB3 ALA A 134 132.400 -3.311 7.614 1.00 0.00 H new ATOM 2091 N VAL A 135 131.783 -2.637 10.250 1.00 0.00 N ATOM 2092 CA VAL A 135 130.726 -2.150 11.174 1.00 0.00 C ATOM 2093 C VAL A 135 131.396 -1.503 12.382 1.00 0.00 C ATOM 2094 O VAL A 135 131.042 -0.424 12.798 1.00 0.00 O ATOM 2095 CB VAL A 135 129.839 -3.300 11.645 1.00 0.00 C ATOM 2096 CG1 VAL A 135 128.799 -2.748 12.626 1.00 0.00 C ATOM 2097 CG2 VAL A 135 129.130 -3.930 10.440 1.00 0.00 C ATOM 0 H VAL A 135 131.707 -3.614 9.965 1.00 0.00 H new ATOM 0 HA VAL A 135 130.100 -1.429 10.648 1.00 0.00 H new ATOM 0 HB VAL A 135 130.445 -4.061 12.137 1.00 0.00 H new ATOM 0 HG11 VAL A 135 128.158 -3.559 12.971 1.00 0.00 H new ATOM 0 HG12 VAL A 135 129.307 -2.299 13.480 1.00 0.00 H new ATOM 0 HG13 VAL A 135 128.192 -1.993 12.126 1.00 0.00 H new ATOM 0 HG21 VAL A 135 128.497 -4.751 10.778 1.00 0.00 H new ATOM 0 HG22 VAL A 135 128.515 -3.178 9.945 1.00 0.00 H new ATOM 0 HG23 VAL A 135 129.873 -4.310 9.739 1.00 0.00 H new ATOM 2107 N ARG A 136 132.374 -2.149 12.942 1.00 0.00 N ATOM 2108 CA ARG A 136 133.069 -1.556 14.115 1.00 0.00 C ATOM 2109 C ARG A 136 133.400 -0.103 13.794 1.00 0.00 C ATOM 2110 O ARG A 136 133.137 0.796 14.570 1.00 0.00 O ATOM 2111 CB ARG A 136 134.359 -2.333 14.376 1.00 0.00 C ATOM 2112 CG ARG A 136 134.220 -3.731 13.786 1.00 0.00 C ATOM 2113 CD ARG A 136 135.057 -4.733 14.587 1.00 0.00 C ATOM 2114 NE ARG A 136 136.496 -4.572 14.234 1.00 0.00 N ATOM 2115 CZ ARG A 136 137.420 -4.969 15.065 1.00 0.00 C ATOM 2116 NH1 ARG A 136 137.085 -5.508 16.206 1.00 0.00 N ATOM 2117 NH2 ARG A 136 138.680 -4.828 14.756 1.00 0.00 N ATOM 0 H ARG A 136 132.723 -3.059 12.641 1.00 0.00 H new ATOM 0 HA ARG A 136 132.435 -1.605 15.000 1.00 0.00 H new ATOM 0 HB2 ARG A 136 135.208 -1.817 13.927 1.00 0.00 H new ATOM 0 HB3 ARG A 136 134.553 -2.393 15.447 1.00 0.00 H new ATOM 0 HG2 ARG A 136 133.173 -4.034 13.794 1.00 0.00 H new ATOM 0 HG3 ARG A 136 134.543 -3.727 12.745 1.00 0.00 H new ATOM 0 HD2 ARG A 136 134.913 -4.571 15.655 1.00 0.00 H new ATOM 0 HD3 ARG A 136 134.730 -5.750 14.372 1.00 0.00 H new ATOM 0 HE ARG A 136 136.758 -4.151 13.343 1.00 0.00 H new ATOM 0 HH11 ARG A 136 136.100 -5.619 16.448 1.00 0.00 H new ATOM 0 HH12 ARG A 136 137.808 -5.818 16.855 1.00 0.00 H new ATOM 0 HH21 ARG A 136 138.943 -4.407 13.865 1.00 0.00 H new ATOM 0 HH22 ARG A 136 139.402 -5.138 15.406 1.00 0.00 H new ATOM 2131 N GLU A 137 133.968 0.134 12.645 1.00 0.00 N ATOM 2132 CA GLU A 137 134.311 1.531 12.260 1.00 0.00 C ATOM 2133 C GLU A 137 133.036 2.294 11.876 1.00 0.00 C ATOM 2134 O GLU A 137 132.963 3.500 12.007 1.00 0.00 O ATOM 2135 CB GLU A 137 135.270 1.510 11.068 1.00 0.00 C ATOM 2136 CG GLU A 137 136.704 1.331 11.569 1.00 0.00 C ATOM 2137 CD GLU A 137 137.275 2.689 11.980 1.00 0.00 C ATOM 2138 OE1 GLU A 137 137.256 3.591 11.158 1.00 0.00 O ATOM 2139 OE2 GLU A 137 137.722 2.804 13.109 1.00 0.00 O ATOM 0 H GLU A 137 134.209 -0.579 11.956 1.00 0.00 H new ATOM 0 HA GLU A 137 134.787 2.029 13.105 1.00 0.00 H new ATOM 0 HB2 GLU A 137 135.006 0.698 10.390 1.00 0.00 H new ATOM 0 HB3 GLU A 137 135.184 2.438 10.503 1.00 0.00 H new ATOM 0 HG2 GLU A 137 136.721 0.646 12.417 1.00 0.00 H new ATOM 0 HG3 GLU A 137 137.321 0.887 10.788 1.00 0.00 H new ATOM 2146 N ILE A 138 132.037 1.607 11.386 1.00 0.00 N ATOM 2147 CA ILE A 138 130.780 2.304 10.977 1.00 0.00 C ATOM 2148 C ILE A 138 129.945 2.661 12.216 1.00 0.00 C ATOM 2149 O ILE A 138 129.615 3.806 12.442 1.00 0.00 O ATOM 2150 CB ILE A 138 129.984 1.376 10.038 1.00 0.00 C ATOM 2151 CG1 ILE A 138 129.514 2.166 8.810 1.00 0.00 C ATOM 2152 CG2 ILE A 138 128.764 0.785 10.758 1.00 0.00 C ATOM 2153 CD1 ILE A 138 130.584 2.107 7.715 1.00 0.00 C ATOM 0 H ILE A 138 132.036 0.596 11.251 1.00 0.00 H new ATOM 0 HA ILE A 138 131.022 3.230 10.455 1.00 0.00 H new ATOM 0 HB ILE A 138 130.636 0.560 9.728 1.00 0.00 H new ATOM 0 HG12 ILE A 138 128.576 1.753 8.438 1.00 0.00 H new ATOM 0 HG13 ILE A 138 129.319 3.202 9.086 1.00 0.00 H new ATOM 0 HG21 ILE A 138 128.219 0.134 10.075 1.00 0.00 H new ATOM 0 HG22 ILE A 138 129.095 0.209 11.622 1.00 0.00 H new ATOM 0 HG23 ILE A 138 128.111 1.592 11.089 1.00 0.00 H new ATOM 0 HD11 ILE A 138 130.246 2.670 6.845 1.00 0.00 H new ATOM 0 HD12 ILE A 138 131.512 2.540 8.089 1.00 0.00 H new ATOM 0 HD13 ILE A 138 130.757 1.069 7.431 1.00 0.00 H new ATOM 2165 N ALA A 139 129.603 1.693 13.017 1.00 0.00 N ATOM 2166 CA ALA A 139 128.795 1.971 14.233 1.00 0.00 C ATOM 2167 C ALA A 139 129.468 3.075 15.044 1.00 0.00 C ATOM 2168 O ALA A 139 128.815 3.898 15.654 1.00 0.00 O ATOM 2169 CB ALA A 139 128.705 0.699 15.076 1.00 0.00 C ATOM 0 H ALA A 139 129.851 0.713 12.879 1.00 0.00 H new ATOM 0 HA ALA A 139 127.793 2.291 13.947 1.00 0.00 H new ATOM 0 HB1 ALA A 139 128.113 0.896 15.970 1.00 0.00 H new ATOM 0 HB2 ALA A 139 128.230 -0.091 14.494 1.00 0.00 H new ATOM 0 HB3 ALA A 139 129.707 0.383 15.366 1.00 0.00 H new ATOM 2175 N ARG A 140 130.771 3.100 15.057 1.00 0.00 N ATOM 2176 CA ARG A 140 131.482 4.153 15.829 1.00 0.00 C ATOM 2177 C ARG A 140 131.439 5.469 15.049 1.00 0.00 C ATOM 2178 O ARG A 140 131.083 6.503 15.578 1.00 0.00 O ATOM 2179 CB ARG A 140 132.937 3.732 16.047 1.00 0.00 C ATOM 2180 CG ARG A 140 133.047 2.923 17.341 1.00 0.00 C ATOM 2181 CD ARG A 140 133.334 3.867 18.511 1.00 0.00 C ATOM 2182 NE ARG A 140 134.684 4.474 18.340 1.00 0.00 N ATOM 2183 CZ ARG A 140 135.752 3.781 18.626 1.00 0.00 C ATOM 2184 NH1 ARG A 140 135.637 2.557 19.062 1.00 0.00 N ATOM 2185 NH2 ARG A 140 136.934 4.313 18.476 1.00 0.00 N ATOM 0 H ARG A 140 131.372 2.438 14.567 1.00 0.00 H new ATOM 0 HA ARG A 140 130.997 4.288 16.796 1.00 0.00 H new ATOM 0 HB2 ARG A 140 133.285 3.136 15.203 1.00 0.00 H new ATOM 0 HB3 ARG A 140 133.577 4.613 16.101 1.00 0.00 H new ATOM 0 HG2 ARG A 140 132.121 2.376 17.520 1.00 0.00 H new ATOM 0 HG3 ARG A 140 133.843 2.183 17.253 1.00 0.00 H new ATOM 0 HD2 ARG A 140 132.575 4.648 18.556 1.00 0.00 H new ATOM 0 HD3 ARG A 140 133.286 3.321 19.453 1.00 0.00 H new ATOM 0 HE ARG A 140 134.773 5.431 17.999 1.00 0.00 H new ATOM 0 HH11 ARG A 140 134.713 2.142 19.179 1.00 0.00 H new ATOM 0 HH12 ARG A 140 136.471 2.015 19.286 1.00 0.00 H new ATOM 0 HH21 ARG A 140 137.023 5.270 18.135 1.00 0.00 H new ATOM 0 HH22 ARG A 140 137.769 3.772 18.699 1.00 0.00 H new ATOM 2199 N SER A 141 131.794 5.439 13.792 1.00 0.00 N ATOM 2200 CA SER A 141 131.766 6.691 12.983 1.00 0.00 C ATOM 2201 C SER A 141 130.371 7.310 13.068 1.00 0.00 C ATOM 2202 O SER A 141 130.218 8.508 13.201 1.00 0.00 O ATOM 2203 CB SER A 141 132.092 6.366 11.524 1.00 0.00 C ATOM 2204 OG SER A 141 133.335 5.681 11.462 1.00 0.00 O ATOM 0 H SER A 141 132.101 4.604 13.292 1.00 0.00 H new ATOM 0 HA SER A 141 132.505 7.393 13.369 1.00 0.00 H new ATOM 0 HB2 SER A 141 131.303 5.751 11.091 1.00 0.00 H new ATOM 0 HB3 SER A 141 132.139 7.283 10.937 1.00 0.00 H new ATOM 0 HG SER A 141 133.178 4.715 11.504 1.00 0.00 H new ATOM 2210 N LEU A 142 129.351 6.499 12.998 1.00 0.00 N ATOM 2211 CA LEU A 142 127.966 7.032 13.081 1.00 0.00 C ATOM 2212 C LEU A 142 127.524 7.033 14.547 1.00 0.00 C ATOM 2213 O LEU A 142 127.384 8.074 15.158 1.00 0.00 O ATOM 2214 CB LEU A 142 127.025 6.153 12.252 1.00 0.00 C ATOM 2215 CG LEU A 142 127.744 5.673 10.988 1.00 0.00 C ATOM 2216 CD1 LEU A 142 126.993 4.482 10.400 1.00 0.00 C ATOM 2217 CD2 LEU A 142 127.776 6.801 9.958 1.00 0.00 C ATOM 0 H LEU A 142 129.420 5.487 12.887 1.00 0.00 H new ATOM 0 HA LEU A 142 127.935 8.048 12.688 1.00 0.00 H new ATOM 0 HB2 LEU A 142 126.697 5.297 12.842 1.00 0.00 H new ATOM 0 HB3 LEU A 142 126.131 6.715 11.982 1.00 0.00 H new ATOM 0 HG LEU A 142 128.763 5.379 11.241 1.00 0.00 H new ATOM 0 HD11 LEU A 142 127.503 4.139 9.500 1.00 0.00 H new ATOM 0 HD12 LEU A 142 126.963 3.674 11.131 1.00 0.00 H new ATOM 0 HD13 LEU A 142 125.976 4.782 10.148 1.00 0.00 H new ATOM 0 HD21 LEU A 142 128.288 6.458 9.059 1.00 0.00 H new ATOM 0 HD22 LEU A 142 126.756 7.093 9.706 1.00 0.00 H new ATOM 0 HD23 LEU A 142 128.306 7.658 10.373 1.00 0.00 H new ATOM 2229 N GLY A 143 127.319 5.878 15.125 1.00 0.00 N ATOM 2230 CA GLY A 143 126.907 5.837 16.558 1.00 0.00 C ATOM 2231 C GLY A 143 126.047 4.601 16.848 1.00 0.00 C ATOM 2232 O GLY A 143 125.074 4.678 17.572 1.00 0.00 O ATOM 0 H GLY A 143 127.418 4.970 14.671 1.00 0.00 H new ATOM 0 HA2 GLY A 143 127.792 5.826 17.194 1.00 0.00 H new ATOM 0 HA3 GLY A 143 126.348 6.739 16.805 1.00 0.00 H new ATOM 2236 N PHE A 144 126.391 3.458 16.310 1.00 0.00 N ATOM 2237 CA PHE A 144 125.574 2.237 16.592 1.00 0.00 C ATOM 2238 C PHE A 144 126.361 1.279 17.489 1.00 0.00 C ATOM 2239 O PHE A 144 127.029 1.686 18.418 1.00 0.00 O ATOM 2240 CB PHE A 144 125.221 1.508 15.293 1.00 0.00 C ATOM 2241 CG PHE A 144 124.886 2.495 14.204 1.00 0.00 C ATOM 2242 CD1 PHE A 144 124.307 3.730 14.519 1.00 0.00 C ATOM 2243 CD2 PHE A 144 125.151 2.165 12.871 1.00 0.00 C ATOM 2244 CE1 PHE A 144 123.997 4.635 13.499 1.00 0.00 C ATOM 2245 CE2 PHE A 144 124.839 3.068 11.851 1.00 0.00 C ATOM 2246 CZ PHE A 144 124.263 4.305 12.165 1.00 0.00 C ATOM 0 H PHE A 144 127.192 3.317 15.695 1.00 0.00 H new ATOM 0 HA PHE A 144 124.657 2.553 17.090 1.00 0.00 H new ATOM 0 HB2 PHE A 144 126.059 0.884 14.981 1.00 0.00 H new ATOM 0 HB3 PHE A 144 124.374 0.843 15.462 1.00 0.00 H new ATOM 0 HD1 PHE A 144 124.100 3.983 15.548 1.00 0.00 H new ATOM 0 HD2 PHE A 144 125.597 1.212 12.630 1.00 0.00 H new ATOM 0 HE1 PHE A 144 123.552 5.589 13.741 1.00 0.00 H new ATOM 0 HE2 PHE A 144 125.042 2.812 10.822 1.00 0.00 H new ATOM 0 HZ PHE A 144 124.024 5.005 11.378 1.00 0.00 H new ATOM 2256 N ASP A 145 126.281 0.003 17.212 1.00 0.00 N ATOM 2257 CA ASP A 145 127.015 -0.998 18.038 1.00 0.00 C ATOM 2258 C ASP A 145 128.385 -1.274 17.405 1.00 0.00 C ATOM 2259 O ASP A 145 128.474 -1.851 16.339 1.00 0.00 O ATOM 2260 CB ASP A 145 126.212 -2.299 18.086 1.00 0.00 C ATOM 2261 CG ASP A 145 125.277 -2.279 19.297 1.00 0.00 C ATOM 2262 OD1 ASP A 145 125.731 -1.903 20.364 1.00 0.00 O ATOM 2263 OD2 ASP A 145 124.123 -2.640 19.135 1.00 0.00 O ATOM 0 H ASP A 145 125.735 -0.389 16.445 1.00 0.00 H new ATOM 0 HA ASP A 145 127.149 -0.610 19.048 1.00 0.00 H new ATOM 0 HB2 ASP A 145 125.634 -2.416 17.169 1.00 0.00 H new ATOM 0 HB3 ASP A 145 126.887 -3.153 18.148 1.00 0.00 H new ATOM 2268 N PRO A 146 129.444 -0.862 18.052 1.00 0.00 N ATOM 2269 CA PRO A 146 130.829 -1.065 17.539 1.00 0.00 C ATOM 2270 C PRO A 146 131.104 -2.507 17.094 1.00 0.00 C ATOM 2271 O PRO A 146 131.751 -3.261 17.792 1.00 0.00 O ATOM 2272 CB PRO A 146 131.719 -0.706 18.730 1.00 0.00 C ATOM 2273 CG PRO A 146 130.905 0.215 19.575 1.00 0.00 C ATOM 2274 CD PRO A 146 129.440 -0.153 19.342 1.00 0.00 C ATOM 0 HA PRO A 146 131.008 -0.458 16.651 1.00 0.00 H new ATOM 0 HB2 PRO A 146 132.007 -1.598 19.287 1.00 0.00 H new ATOM 0 HB3 PRO A 146 132.640 -0.225 18.400 1.00 0.00 H new ATOM 0 HG2 PRO A 146 131.168 0.108 20.627 1.00 0.00 H new ATOM 0 HG3 PRO A 146 131.091 1.254 19.304 1.00 0.00 H new ATOM 0 HD2 PRO A 146 129.057 -0.786 20.142 1.00 0.00 H new ATOM 0 HD3 PRO A 146 128.808 0.734 19.306 1.00 0.00 H new ATOM 2282 N ALA A 147 130.639 -2.888 15.929 1.00 0.00 N ATOM 2283 CA ALA A 147 130.902 -4.270 15.429 1.00 0.00 C ATOM 2284 C ALA A 147 129.851 -5.248 15.947 1.00 0.00 C ATOM 2285 O ALA A 147 129.654 -5.386 17.138 1.00 0.00 O ATOM 2286 CB ALA A 147 132.275 -4.730 15.914 1.00 0.00 C ATOM 0 H ALA A 147 130.088 -2.300 15.304 1.00 0.00 H new ATOM 0 HA ALA A 147 130.864 -4.252 14.340 1.00 0.00 H new ATOM 0 HB1 ALA A 147 132.470 -5.739 15.551 1.00 0.00 H new ATOM 0 HB2 ALA A 147 133.041 -4.053 15.534 1.00 0.00 H new ATOM 0 HB3 ALA A 147 132.296 -4.727 17.004 1.00 0.00 H new ATOM 2292 N GLU A 148 129.197 -5.953 15.060 1.00 0.00 N ATOM 2293 CA GLU A 148 128.181 -6.952 15.504 1.00 0.00 C ATOM 2294 C GLU A 148 127.204 -7.278 14.364 1.00 0.00 C ATOM 2295 O GLU A 148 126.065 -7.623 14.606 1.00 0.00 O ATOM 2296 CB GLU A 148 127.392 -6.393 16.697 1.00 0.00 C ATOM 2297 CG GLU A 148 127.919 -7.001 18.003 1.00 0.00 C ATOM 2298 CD GLU A 148 127.058 -8.205 18.391 1.00 0.00 C ATOM 2299 OE1 GLU A 148 126.386 -8.732 17.520 1.00 0.00 O ATOM 2300 OE2 GLU A 148 127.087 -8.579 19.552 1.00 0.00 O ATOM 0 H GLU A 148 129.322 -5.880 14.050 1.00 0.00 H new ATOM 0 HA GLU A 148 128.702 -7.864 15.796 1.00 0.00 H new ATOM 0 HB2 GLU A 148 127.484 -5.307 16.728 1.00 0.00 H new ATOM 0 HB3 GLU A 148 126.332 -6.620 16.582 1.00 0.00 H new ATOM 0 HG2 GLU A 148 128.958 -7.308 17.880 1.00 0.00 H new ATOM 0 HG3 GLU A 148 127.899 -6.255 18.798 1.00 0.00 H new ATOM 2307 N PHE A 149 127.619 -7.173 13.124 1.00 0.00 N ATOM 2308 CA PHE A 149 126.673 -7.481 12.012 1.00 0.00 C ATOM 2309 C PHE A 149 127.275 -8.527 11.079 1.00 0.00 C ATOM 2310 O PHE A 149 126.772 -9.627 10.966 1.00 0.00 O ATOM 2311 CB PHE A 149 126.372 -6.202 11.233 1.00 0.00 C ATOM 2312 CG PHE A 149 125.959 -5.123 12.203 1.00 0.00 C ATOM 2313 CD1 PHE A 149 126.838 -4.718 13.214 1.00 0.00 C ATOM 2314 CD2 PHE A 149 124.693 -4.537 12.101 1.00 0.00 C ATOM 2315 CE1 PHE A 149 126.453 -3.726 14.120 1.00 0.00 C ATOM 2316 CE2 PHE A 149 124.309 -3.543 13.007 1.00 0.00 C ATOM 2317 CZ PHE A 149 125.190 -3.138 14.017 1.00 0.00 C ATOM 0 H PHE A 149 128.557 -6.892 12.839 1.00 0.00 H new ATOM 0 HA PHE A 149 125.749 -7.879 12.430 1.00 0.00 H new ATOM 0 HB2 PHE A 149 127.252 -5.887 10.672 1.00 0.00 H new ATOM 0 HB3 PHE A 149 125.578 -6.381 10.508 1.00 0.00 H new ATOM 0 HD1 PHE A 149 127.814 -5.172 13.294 1.00 0.00 H new ATOM 0 HD2 PHE A 149 124.013 -4.852 11.323 1.00 0.00 H new ATOM 0 HE1 PHE A 149 127.132 -3.414 14.900 1.00 0.00 H new ATOM 0 HE2 PHE A 149 123.333 -3.088 12.927 1.00 0.00 H new ATOM 0 HZ PHE A 149 124.893 -2.371 14.717 1.00 0.00 H new ATOM 2327 N GLY A 150 128.342 -8.201 10.407 1.00 0.00 N ATOM 2328 CA GLY A 150 128.960 -9.185 9.483 1.00 0.00 C ATOM 2329 C GLY A 150 127.864 -10.028 8.824 1.00 0.00 C ATOM 2330 O GLY A 150 127.738 -11.207 9.084 1.00 0.00 O ATOM 0 H GLY A 150 128.811 -7.297 10.459 1.00 0.00 H new ATOM 0 HA2 GLY A 150 129.543 -8.668 8.721 1.00 0.00 H new ATOM 0 HA3 GLY A 150 129.650 -9.829 10.029 1.00 0.00 H new