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 97 MET CE :methyl 155:sc= -1.88! (180deg=-0.137) USER MOD Set 1.2: A 98 LYS NZ :NH3+ 175:sc= -3.81! (180deg=-4.04) USER MOD Set 2.1: A 21 GLN : amide:sc= -0.216 K(o=-0.32,f=-3.1!) USER MOD Set 2.2: A 25 TYR OH : rot 40:sc= -0.107 USER MOD Single : A 8 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 12 THR OG1 : rot 180:sc= -0.395 USER MOD Single : A 13 SER OG : rot -112:sc= -2.73 USER MOD Single : A 19 THR OG1 : rot 90:sc= -5.82! USER MOD Single : A 26 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 27 ASN : amide:sc= -0.0144 X(o=-0.014,f=0) USER MOD Single : A 28 LYS NZ :NH3+ -123:sc= 1.15 (180deg=-0.917) USER MOD Single : A 29 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 31 MET CE :methyl -175:sc= -1.21 (180deg=-1.27) USER MOD Single : A 32 GLN : amide:sc= -9.49! C(o=-9.5!,f=-16!) USER MOD Single : A 34 THR OG1 : rot 48:sc= -0.352 USER MOD Single : A 38 CYS SG : rot 66:sc= 0.114! USER MOD Single : A 45 SER OG : rot 80:sc= 0.507 USER MOD Single : A 49 SER OG : rot 34:sc= -1.07! USER MOD Single : A 50 SER OG : rot 180:sc= -0.0276 USER MOD Single : A 53 LYS NZ :NH3+ 145:sc= -3.03! (180deg=-3.62!) USER MOD Single : A 54 GLN : amide:sc= -10.8! C(o=-11!,f=-7.8!) USER MOD Single : A 55 LYS NZ :NH3+ 170:sc= 0 (180deg=-0.0397) USER MOD Single : A 56 MET CE :methyl -140:sc= -8.08! (180deg=-9.92!) USER MOD Single : A 62 SER OG : rot 180:sc= 0 USER MOD Single : A 63 SER OG : rot -18:sc= -4.28! USER MOD Single : A 67 LYS NZ :NH3+ -153:sc= -4.2! (180deg=-5.9!) USER MOD Single : A 71 THR OG1 : rot -110:sc= -2.38! USER MOD Single : A 79 ASN : amide:sc= -5.82! C(o=-5.8!,f=-9.4!) 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 118:sc= -1.48! USER MOD Single : A 93 LYS NZ :NH3+ -119:sc= -14.9! (180deg=-22.1!) USER MOD Single : A 96 THR OG1 : rot -100:sc= -0.664! USER MOD Single : A 99 TYR OH : rot -144:sc= -1.7 USER MOD Single : A 104 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 106 GLN : amide:sc= -0.892 X(o=-0.89,f=-0.81) USER MOD Single : A 111 GLN : amide:sc= -0.209 X(o=-0.21,f=-0.026) USER MOD Single : A 122 LYS NZ :NH3+ -143:sc= -0.389 (180deg=-2.05!) USER MOD Single : A 123 SER OG : rot 84:sc= 0.0787 USER MOD Single : A 126 ASN : amide:sc= -7.58! C(o=-7.6!,f=-6.1!) USER MOD Single : A 132 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 133 SER OG : rot 180:sc= 0 USER MOD Single : A 141 SER OG : rot 73:sc= 0.546 USER MOD ----------------------------------------------------------------- ATOM 105 N VAL A 7 112.942 3.484 -14.197 1.00 0.00 N ATOM 106 CA VAL A 7 113.290 4.491 -13.158 1.00 0.00 C ATOM 107 C VAL A 7 114.788 4.798 -13.201 1.00 0.00 C ATOM 108 O VAL A 7 115.193 5.913 -13.465 1.00 0.00 O ATOM 109 CB VAL A 7 112.931 3.943 -11.774 1.00 0.00 C ATOM 110 CG1 VAL A 7 113.432 2.503 -11.646 1.00 0.00 C ATOM 111 CG2 VAL A 7 113.588 4.814 -10.701 1.00 0.00 C ATOM 0 HA VAL A 7 112.730 5.405 -13.353 1.00 0.00 H new ATOM 0 HB VAL A 7 111.849 3.958 -11.644 1.00 0.00 H new ATOM 0 HG11 VAL A 7 113.176 2.115 -10.660 1.00 0.00 H new ATOM 0 HG12 VAL A 7 112.964 1.885 -12.412 1.00 0.00 H new ATOM 0 HG13 VAL A 7 114.514 2.482 -11.774 1.00 0.00 H new ATOM 0 HG21 VAL A 7 113.335 4.428 -9.714 1.00 0.00 H new ATOM 0 HG22 VAL A 7 114.670 4.797 -10.831 1.00 0.00 H new ATOM 0 HG23 VAL A 7 113.227 5.839 -10.793 1.00 0.00 H new ATOM 121 N LYS A 8 115.616 3.826 -12.922 1.00 0.00 N ATOM 122 CA LYS A 8 117.084 4.072 -12.923 1.00 0.00 C ATOM 123 C LYS A 8 117.396 5.212 -11.946 1.00 0.00 C ATOM 124 O LYS A 8 118.536 5.448 -11.596 1.00 0.00 O ATOM 125 CB LYS A 8 117.547 4.437 -14.338 1.00 0.00 C ATOM 126 CG LYS A 8 118.040 5.886 -14.376 1.00 0.00 C ATOM 127 CD LYS A 8 118.406 6.265 -15.813 1.00 0.00 C ATOM 128 CE LYS A 8 117.135 6.343 -16.661 1.00 0.00 C ATOM 129 NZ LYS A 8 117.367 7.250 -17.821 1.00 0.00 N ATOM 0 H LYS A 8 115.337 2.872 -12.693 1.00 0.00 H new ATOM 0 HA LYS A 8 117.614 3.173 -12.609 1.00 0.00 H new ATOM 0 HB2 LYS A 8 118.346 3.765 -14.652 1.00 0.00 H new ATOM 0 HB3 LYS A 8 116.725 4.306 -15.042 1.00 0.00 H new ATOM 0 HG2 LYS A 8 117.266 6.554 -13.999 1.00 0.00 H new ATOM 0 HG3 LYS A 8 118.907 6.003 -13.726 1.00 0.00 H new ATOM 0 HD2 LYS A 8 118.924 7.224 -15.826 1.00 0.00 H new ATOM 0 HD3 LYS A 8 119.090 5.527 -16.232 1.00 0.00 H new ATOM 0 HE2 LYS A 8 116.858 5.349 -17.012 1.00 0.00 H new ATOM 0 HE3 LYS A 8 116.305 6.711 -16.058 1.00 0.00 H new ATOM 0 HZ1 LYS A 8 116.503 7.304 -18.398 1.00 0.00 H new ATOM 0 HZ2 LYS A 8 117.612 8.200 -17.475 1.00 0.00 H new ATOM 0 HZ3 LYS A 8 118.148 6.880 -18.400 1.00 0.00 H new ATOM 143 N GLY A 9 116.389 5.917 -11.500 1.00 0.00 N ATOM 144 CA GLY A 9 116.622 7.035 -10.546 1.00 0.00 C ATOM 145 C GLY A 9 115.682 8.197 -10.869 1.00 0.00 C ATOM 146 O GLY A 9 116.075 9.163 -11.491 1.00 0.00 O ATOM 0 H GLY A 9 115.414 5.764 -11.758 1.00 0.00 H new ATOM 0 HA2 GLY A 9 116.455 6.694 -9.524 1.00 0.00 H new ATOM 0 HA3 GLY A 9 117.659 7.366 -10.606 1.00 0.00 H new ATOM 150 N ALA A 10 114.445 8.114 -10.446 1.00 0.00 N ATOM 151 CA ALA A 10 113.480 9.220 -10.727 1.00 0.00 C ATOM 152 C ALA A 10 112.062 8.653 -10.786 1.00 0.00 C ATOM 153 O ALA A 10 111.238 9.094 -11.562 1.00 0.00 O ATOM 154 CB ALA A 10 113.813 9.875 -12.071 1.00 0.00 C ATOM 0 H ALA A 10 114.063 7.329 -9.919 1.00 0.00 H new ATOM 0 HA ALA A 10 113.550 9.964 -9.934 1.00 0.00 H new ATOM 0 HB1 ALA A 10 113.105 10.680 -12.269 1.00 0.00 H new ATOM 0 HB2 ALA A 10 114.824 10.281 -12.037 1.00 0.00 H new ATOM 0 HB3 ALA A 10 113.747 9.131 -12.865 1.00 0.00 H new ATOM 160 N LEU A 11 111.773 7.676 -9.976 1.00 0.00 N ATOM 161 CA LEU A 11 110.412 7.077 -9.991 1.00 0.00 C ATOM 162 C LEU A 11 109.367 8.156 -9.700 1.00 0.00 C ATOM 163 O LEU A 11 109.679 9.327 -9.606 1.00 0.00 O ATOM 164 CB LEU A 11 110.334 5.962 -8.943 1.00 0.00 C ATOM 165 CG LEU A 11 110.113 6.539 -7.538 1.00 0.00 C ATOM 166 CD1 LEU A 11 110.429 5.460 -6.500 1.00 0.00 C ATOM 167 CD2 LEU A 11 111.035 7.738 -7.293 1.00 0.00 C ATOM 0 H LEU A 11 112.421 7.266 -9.303 1.00 0.00 H new ATOM 0 HA LEU A 11 110.210 6.654 -10.975 1.00 0.00 H new ATOM 0 HB2 LEU A 11 109.520 5.281 -9.192 1.00 0.00 H new ATOM 0 HB3 LEU A 11 111.254 5.378 -8.959 1.00 0.00 H new ATOM 0 HG LEU A 11 109.076 6.864 -7.454 1.00 0.00 H new ATOM 0 HD11 LEU A 11 110.274 5.862 -5.499 1.00 0.00 H new ATOM 0 HD12 LEU A 11 109.771 4.604 -6.653 1.00 0.00 H new ATOM 0 HD13 LEU A 11 111.467 5.144 -6.608 1.00 0.00 H new ATOM 0 HD21 LEU A 11 110.862 8.131 -6.291 1.00 0.00 H new ATOM 0 HD22 LEU A 11 112.074 7.422 -7.384 1.00 0.00 H new ATOM 0 HD23 LEU A 11 110.826 8.514 -8.029 1.00 0.00 H new ATOM 179 N THR A 12 108.128 7.775 -9.568 1.00 0.00 N ATOM 180 CA THR A 12 107.064 8.783 -9.294 1.00 0.00 C ATOM 181 C THR A 12 107.511 9.723 -8.170 1.00 0.00 C ATOM 182 O THR A 12 108.510 9.500 -7.516 1.00 0.00 O ATOM 183 CB THR A 12 105.777 8.067 -8.879 1.00 0.00 C ATOM 184 OG1 THR A 12 104.811 9.029 -8.478 1.00 0.00 O ATOM 185 CG2 THR A 12 106.069 7.118 -7.717 1.00 0.00 C ATOM 0 H THR A 12 107.805 6.810 -9.638 1.00 0.00 H new ATOM 0 HA THR A 12 106.883 9.366 -10.197 1.00 0.00 H new ATOM 0 HB THR A 12 105.392 7.494 -9.722 1.00 0.00 H new ATOM 0 HG1 THR A 12 103.985 8.573 -8.213 1.00 0.00 H new ATOM 0 HG21 THR A 12 105.151 6.609 -7.423 1.00 0.00 H new ATOM 0 HG22 THR A 12 106.809 6.380 -8.027 1.00 0.00 H new ATOM 0 HG23 THR A 12 106.455 7.687 -6.871 1.00 0.00 H new ATOM 193 N SER A 13 106.768 10.773 -7.945 1.00 0.00 N ATOM 194 CA SER A 13 107.123 11.743 -6.869 1.00 0.00 C ATOM 195 C SER A 13 107.147 11.032 -5.512 1.00 0.00 C ATOM 196 O SER A 13 107.213 11.659 -4.474 1.00 0.00 O ATOM 197 CB SER A 13 106.086 12.866 -6.837 1.00 0.00 C ATOM 198 OG SER A 13 105.229 12.681 -5.719 1.00 0.00 O ATOM 0 H SER A 13 105.922 11.002 -8.466 1.00 0.00 H new ATOM 0 HA SER A 13 108.110 12.159 -7.072 1.00 0.00 H new ATOM 0 HB2 SER A 13 106.583 13.834 -6.773 1.00 0.00 H new ATOM 0 HB3 SER A 13 105.505 12.867 -7.759 1.00 0.00 H new ATOM 0 HG SER A 13 104.327 12.460 -6.031 1.00 0.00 H new ATOM 204 N GLY A 14 107.076 9.731 -5.512 1.00 0.00 N ATOM 205 CA GLY A 14 107.075 8.981 -4.224 1.00 0.00 C ATOM 206 C GLY A 14 108.156 9.529 -3.288 1.00 0.00 C ATOM 207 O GLY A 14 108.023 9.490 -2.082 1.00 0.00 O ATOM 0 H GLY A 14 107.018 9.152 -6.350 1.00 0.00 H new ATOM 0 HA2 GLY A 14 106.098 9.063 -3.749 1.00 0.00 H new ATOM 0 HA3 GLY A 14 107.250 7.922 -4.412 1.00 0.00 H new ATOM 211 N ARG A 15 109.230 10.028 -3.825 1.00 0.00 N ATOM 212 CA ARG A 15 110.315 10.561 -2.953 1.00 0.00 C ATOM 213 C ARG A 15 109.803 11.741 -2.116 1.00 0.00 C ATOM 214 O ARG A 15 109.851 11.717 -0.902 1.00 0.00 O ATOM 215 CB ARG A 15 111.484 11.030 -3.822 1.00 0.00 C ATOM 216 CG ARG A 15 110.949 11.605 -5.137 1.00 0.00 C ATOM 217 CD ARG A 15 111.727 12.871 -5.506 1.00 0.00 C ATOM 218 NE ARG A 15 111.734 13.035 -6.987 1.00 0.00 N ATOM 219 CZ ARG A 15 112.321 14.068 -7.526 1.00 0.00 C ATOM 220 NH1 ARG A 15 112.901 14.958 -6.767 1.00 0.00 N ATOM 221 NH2 ARG A 15 112.328 14.212 -8.823 1.00 0.00 N ATOM 0 H ARG A 15 109.406 10.091 -4.828 1.00 0.00 H new ATOM 0 HA ARG A 15 110.644 9.768 -2.282 1.00 0.00 H new ATOM 0 HB2 ARG A 15 112.064 11.786 -3.292 1.00 0.00 H new ATOM 0 HB3 ARG A 15 112.157 10.197 -4.025 1.00 0.00 H new ATOM 0 HG2 ARG A 15 111.042 10.865 -5.932 1.00 0.00 H new ATOM 0 HG3 ARG A 15 109.888 11.835 -5.039 1.00 0.00 H new ATOM 0 HD2 ARG A 15 111.271 13.742 -5.035 1.00 0.00 H new ATOM 0 HD3 ARG A 15 112.749 12.805 -5.132 1.00 0.00 H new ATOM 0 HE ARG A 15 111.280 12.340 -7.579 1.00 0.00 H new ATOM 0 HH11 ARG A 15 112.895 14.845 -5.753 1.00 0.00 H new ATOM 0 HH12 ARG A 15 113.360 15.766 -7.188 1.00 0.00 H new ATOM 0 HH21 ARG A 15 111.874 13.517 -9.416 1.00 0.00 H new ATOM 0 HH22 ARG A 15 112.787 15.020 -9.244 1.00 0.00 H new ATOM 235 N GLU A 16 109.342 12.784 -2.750 1.00 0.00 N ATOM 236 CA GLU A 16 108.862 13.974 -1.985 1.00 0.00 C ATOM 237 C GLU A 16 107.417 13.779 -1.511 1.00 0.00 C ATOM 238 O GLU A 16 107.049 14.195 -0.430 1.00 0.00 O ATOM 239 CB GLU A 16 108.940 15.215 -2.884 1.00 0.00 C ATOM 240 CG GLU A 16 107.607 15.423 -3.609 1.00 0.00 C ATOM 241 CD GLU A 16 107.780 16.484 -4.698 1.00 0.00 C ATOM 242 OE1 GLU A 16 108.394 17.499 -4.416 1.00 0.00 O ATOM 243 OE2 GLU A 16 107.295 16.262 -5.796 1.00 0.00 O ATOM 0 H GLU A 16 109.276 12.865 -3.765 1.00 0.00 H new ATOM 0 HA GLU A 16 109.496 14.102 -1.108 1.00 0.00 H new ATOM 0 HB2 GLU A 16 109.178 16.094 -2.285 1.00 0.00 H new ATOM 0 HB3 GLU A 16 109.744 15.098 -3.611 1.00 0.00 H new ATOM 0 HG2 GLU A 16 107.270 14.485 -4.050 1.00 0.00 H new ATOM 0 HG3 GLU A 16 106.840 15.735 -2.900 1.00 0.00 H new ATOM 250 N GLU A 17 106.588 13.185 -2.320 1.00 0.00 N ATOM 251 CA GLU A 17 105.161 13.006 -1.926 1.00 0.00 C ATOM 252 C GLU A 17 105.011 11.935 -0.842 1.00 0.00 C ATOM 253 O GLU A 17 104.341 12.141 0.149 1.00 0.00 O ATOM 254 CB GLU A 17 104.348 12.594 -3.155 1.00 0.00 C ATOM 255 CG GLU A 17 102.960 12.125 -2.715 1.00 0.00 C ATOM 256 CD GLU A 17 101.941 12.448 -3.809 1.00 0.00 C ATOM 257 OE1 GLU A 17 102.101 11.944 -4.908 1.00 0.00 O ATOM 258 OE2 GLU A 17 101.017 13.194 -3.529 1.00 0.00 O ATOM 0 H GLU A 17 106.835 12.815 -3.238 1.00 0.00 H new ATOM 0 HA GLU A 17 104.796 13.952 -1.525 1.00 0.00 H new ATOM 0 HB2 GLU A 17 104.258 13.434 -3.843 1.00 0.00 H new ATOM 0 HB3 GLU A 17 104.860 11.796 -3.692 1.00 0.00 H new ATOM 0 HG2 GLU A 17 102.972 11.053 -2.520 1.00 0.00 H new ATOM 0 HG3 GLU A 17 102.677 12.616 -1.784 1.00 0.00 H new ATOM 265 N LEU A 18 105.592 10.783 -1.028 1.00 0.00 N ATOM 266 CA LEU A 18 105.429 9.703 -0.011 1.00 0.00 C ATOM 267 C LEU A 18 106.317 9.946 1.217 1.00 0.00 C ATOM 268 O LEU A 18 105.911 9.685 2.333 1.00 0.00 O ATOM 269 CB LEU A 18 105.780 8.352 -0.642 1.00 0.00 C ATOM 270 CG LEU A 18 104.532 7.466 -0.694 1.00 0.00 C ATOM 271 CD1 LEU A 18 104.097 7.107 0.731 1.00 0.00 C ATOM 272 CD2 LEU A 18 103.399 8.215 -1.405 1.00 0.00 C ATOM 0 H LEU A 18 106.169 10.542 -1.834 1.00 0.00 H new ATOM 0 HA LEU A 18 104.391 9.703 0.321 1.00 0.00 H new ATOM 0 HB2 LEU A 18 106.174 8.501 -1.647 1.00 0.00 H new ATOM 0 HB3 LEU A 18 106.562 7.861 -0.062 1.00 0.00 H new ATOM 0 HG LEU A 18 104.760 6.552 -1.243 1.00 0.00 H new ATOM 0 HD11 LEU A 18 103.209 6.476 0.692 1.00 0.00 H new ATOM 0 HD12 LEU A 18 104.902 6.570 1.233 1.00 0.00 H new ATOM 0 HD13 LEU A 18 103.871 8.019 1.283 1.00 0.00 H new ATOM 0 HD21 LEU A 18 102.512 7.583 -1.441 1.00 0.00 H new ATOM 0 HD22 LEU A 18 103.170 9.131 -0.860 1.00 0.00 H new ATOM 0 HD23 LEU A 18 103.708 8.464 -2.420 1.00 0.00 H new ATOM 284 N THR A 19 107.520 10.425 1.046 1.00 0.00 N ATOM 285 CA THR A 19 108.377 10.640 2.244 1.00 0.00 C ATOM 286 C THR A 19 107.748 11.717 3.123 1.00 0.00 C ATOM 287 O THR A 19 107.500 11.508 4.292 1.00 0.00 O ATOM 288 CB THR A 19 109.776 11.074 1.814 1.00 0.00 C ATOM 289 OG1 THR A 19 110.214 10.236 0.756 1.00 0.00 O ATOM 290 CG2 THR A 19 110.741 10.954 3.001 1.00 0.00 C ATOM 0 H THR A 19 107.938 10.672 0.149 1.00 0.00 H new ATOM 0 HA THR A 19 108.456 9.709 2.806 1.00 0.00 H new ATOM 0 HB THR A 19 109.753 12.110 1.477 1.00 0.00 H new ATOM 0 HG1 THR A 19 109.943 10.624 -0.102 1.00 0.00 H new ATOM 0 HG21 THR A 19 111.739 11.264 2.691 1.00 0.00 H new ATOM 0 HG22 THR A 19 110.398 11.593 3.815 1.00 0.00 H new ATOM 0 HG23 THR A 19 110.772 9.919 3.341 1.00 0.00 H new ATOM 298 N ARG A 20 107.478 12.862 2.565 1.00 0.00 N ATOM 299 CA ARG A 20 106.853 13.954 3.358 1.00 0.00 C ATOM 300 C ARG A 20 105.582 13.437 4.035 1.00 0.00 C ATOM 301 O ARG A 20 105.282 13.780 5.161 1.00 0.00 O ATOM 302 CB ARG A 20 106.497 15.107 2.425 1.00 0.00 C ATOM 303 CG ARG A 20 107.775 15.827 2.015 1.00 0.00 C ATOM 304 CD ARG A 20 107.457 16.863 0.935 1.00 0.00 C ATOM 305 NE ARG A 20 106.097 17.424 1.171 1.00 0.00 N ATOM 306 CZ ARG A 20 105.419 17.930 0.178 1.00 0.00 C ATOM 307 NH1 ARG A 20 105.932 17.945 -1.022 1.00 0.00 N ATOM 308 NH2 ARG A 20 104.227 18.421 0.384 1.00 0.00 N ATOM 0 H ARG A 20 107.664 13.090 1.588 1.00 0.00 H new ATOM 0 HA ARG A 20 107.552 14.297 4.121 1.00 0.00 H new ATOM 0 HB2 ARG A 20 105.977 14.731 1.544 1.00 0.00 H new ATOM 0 HB3 ARG A 20 105.819 15.799 2.924 1.00 0.00 H new ATOM 0 HG2 ARG A 20 108.223 16.315 2.881 1.00 0.00 H new ATOM 0 HG3 ARG A 20 108.505 15.109 1.641 1.00 0.00 H new ATOM 0 HD2 ARG A 20 108.199 17.661 0.952 1.00 0.00 H new ATOM 0 HD3 ARG A 20 107.506 16.402 -0.052 1.00 0.00 H new ATOM 0 HE ARG A 20 105.696 17.412 2.109 1.00 0.00 H new ATOM 0 HH11 ARG A 20 106.863 17.561 -1.183 1.00 0.00 H new ATOM 0 HH12 ARG A 20 105.402 18.341 -1.798 1.00 0.00 H new ATOM 0 HH21 ARG A 20 103.826 18.409 1.322 1.00 0.00 H new ATOM 0 HH22 ARG A 20 103.697 18.817 -0.393 1.00 0.00 H new ATOM 322 N GLN A 21 104.834 12.611 3.359 1.00 0.00 N ATOM 323 CA GLN A 21 103.589 12.068 3.962 1.00 0.00 C ATOM 324 C GLN A 21 103.954 11.176 5.145 1.00 0.00 C ATOM 325 O GLN A 21 103.132 10.875 5.988 1.00 0.00 O ATOM 326 CB GLN A 21 102.822 11.256 2.922 1.00 0.00 C ATOM 327 CG GLN A 21 102.336 12.183 1.806 1.00 0.00 C ATOM 328 CD GLN A 21 100.939 12.704 2.148 1.00 0.00 C ATOM 329 OE1 GLN A 21 100.503 12.611 3.278 1.00 0.00 O ATOM 330 NE2 GLN A 21 100.214 13.253 1.212 1.00 0.00 N ATOM 0 H GLN A 21 105.033 12.289 2.412 1.00 0.00 H new ATOM 0 HA GLN A 21 102.960 12.890 4.303 1.00 0.00 H new ATOM 0 HB2 GLN A 21 103.463 10.477 2.509 1.00 0.00 H new ATOM 0 HB3 GLN A 21 101.973 10.756 3.389 1.00 0.00 H new ATOM 0 HG2 GLN A 21 103.027 13.017 1.685 1.00 0.00 H new ATOM 0 HG3 GLN A 21 102.314 11.647 0.857 1.00 0.00 H new ATOM 0 HE21 GLN A 21 100.580 13.331 0.263 1.00 0.00 H new ATOM 0 HE22 GLN A 21 99.281 13.604 1.429 1.00 0.00 H new ATOM 339 N VAL A 22 105.182 10.739 5.209 1.00 0.00 N ATOM 340 CA VAL A 22 105.598 9.854 6.331 1.00 0.00 C ATOM 341 C VAL A 22 105.053 10.421 7.642 1.00 0.00 C ATOM 342 O VAL A 22 104.720 9.689 8.553 1.00 0.00 O ATOM 343 CB VAL A 22 107.129 9.814 6.398 1.00 0.00 C ATOM 344 CG1 VAL A 22 107.581 9.036 7.634 1.00 0.00 C ATOM 345 CG2 VAL A 22 107.679 9.135 5.145 1.00 0.00 C ATOM 0 H VAL A 22 105.914 10.957 4.533 1.00 0.00 H new ATOM 0 HA VAL A 22 105.210 8.848 6.173 1.00 0.00 H new ATOM 0 HB VAL A 22 107.507 10.835 6.459 1.00 0.00 H new ATOM 0 HG11 VAL A 22 108.670 9.014 7.672 1.00 0.00 H new ATOM 0 HG12 VAL A 22 107.197 9.522 8.531 1.00 0.00 H new ATOM 0 HG13 VAL A 22 107.199 8.016 7.582 1.00 0.00 H new ATOM 0 HG21 VAL A 22 108.768 9.107 5.194 1.00 0.00 H new ATOM 0 HG22 VAL A 22 107.293 8.118 5.083 1.00 0.00 H new ATOM 0 HG23 VAL A 22 107.370 9.695 4.262 1.00 0.00 H new ATOM 355 N GLY A 23 104.944 11.716 7.743 1.00 0.00 N ATOM 356 CA GLY A 23 104.403 12.315 8.993 1.00 0.00 C ATOM 357 C GLY A 23 102.946 11.882 9.155 1.00 0.00 C ATOM 358 O GLY A 23 102.243 12.340 10.034 1.00 0.00 O ATOM 0 H GLY A 23 105.205 12.383 7.017 1.00 0.00 H new ATOM 0 HA2 GLY A 23 104.991 11.991 9.852 1.00 0.00 H new ATOM 0 HA3 GLY A 23 104.471 13.402 8.951 1.00 0.00 H new ATOM 362 N ARG A 24 102.488 10.999 8.307 1.00 0.00 N ATOM 363 CA ARG A 24 101.078 10.531 8.400 1.00 0.00 C ATOM 364 C ARG A 24 101.039 9.002 8.323 1.00 0.00 C ATOM 365 O ARG A 24 100.333 8.353 9.070 1.00 0.00 O ATOM 366 CB ARG A 24 100.269 11.119 7.242 1.00 0.00 C ATOM 367 CG ARG A 24 100.239 12.644 7.361 1.00 0.00 C ATOM 368 CD ARG A 24 99.444 13.045 8.605 1.00 0.00 C ATOM 369 NE ARG A 24 98.779 14.357 8.369 1.00 0.00 N ATOM 370 CZ ARG A 24 99.496 15.443 8.268 1.00 0.00 C ATOM 371 NH1 ARG A 24 100.795 15.379 8.375 1.00 0.00 N ATOM 372 NH2 ARG A 24 98.914 16.592 8.062 1.00 0.00 N ATOM 0 H ARG A 24 103.033 10.582 7.553 1.00 0.00 H new ATOM 0 HA ARG A 24 100.650 10.858 9.348 1.00 0.00 H new ATOM 0 HB2 ARG A 24 100.712 10.827 6.290 1.00 0.00 H new ATOM 0 HB3 ARG A 24 99.254 10.723 7.256 1.00 0.00 H new ATOM 0 HG2 ARG A 24 101.255 13.034 7.425 1.00 0.00 H new ATOM 0 HG3 ARG A 24 99.785 13.080 6.471 1.00 0.00 H new ATOM 0 HD2 ARG A 24 98.698 12.284 8.834 1.00 0.00 H new ATOM 0 HD3 ARG A 24 100.107 13.111 9.467 1.00 0.00 H new ATOM 0 HE ARG A 24 97.764 14.407 8.286 1.00 0.00 H new ATOM 0 HH11 ARG A 24 101.250 14.481 8.537 1.00 0.00 H new ATOM 0 HH12 ARG A 24 101.356 16.227 8.296 1.00 0.00 H new ATOM 0 HH21 ARG A 24 97.899 16.642 7.980 1.00 0.00 H new ATOM 0 HH22 ARG A 24 99.474 17.441 7.983 1.00 0.00 H new ATOM 386 N TYR A 25 101.787 8.421 7.424 1.00 0.00 N ATOM 387 CA TYR A 25 101.783 6.934 7.302 1.00 0.00 C ATOM 388 C TYR A 25 102.921 6.345 8.135 1.00 0.00 C ATOM 389 O TYR A 25 102.862 5.210 8.566 1.00 0.00 O ATOM 390 CB TYR A 25 101.977 6.533 5.838 1.00 0.00 C ATOM 391 CG TYR A 25 101.280 7.522 4.935 1.00 0.00 C ATOM 392 CD1 TYR A 25 100.156 8.222 5.392 1.00 0.00 C ATOM 393 CD2 TYR A 25 101.757 7.738 3.637 1.00 0.00 C ATOM 394 CE1 TYR A 25 99.511 9.134 4.552 1.00 0.00 C ATOM 395 CE2 TYR A 25 101.112 8.651 2.798 1.00 0.00 C ATOM 396 CZ TYR A 25 99.988 9.350 3.254 1.00 0.00 C ATOM 397 OH TYR A 25 99.351 10.250 2.425 1.00 0.00 O ATOM 0 H TYR A 25 102.399 8.910 6.770 1.00 0.00 H new ATOM 0 HA TYR A 25 100.828 6.552 7.663 1.00 0.00 H new ATOM 0 HB2 TYR A 25 103.040 6.497 5.600 1.00 0.00 H new ATOM 0 HB3 TYR A 25 101.579 5.532 5.671 1.00 0.00 H new ATOM 0 HD1 TYR A 25 99.788 8.057 6.394 1.00 0.00 H new ATOM 0 HD2 TYR A 25 102.624 7.199 3.284 1.00 0.00 H new ATOM 0 HE1 TYR A 25 98.644 9.672 4.905 1.00 0.00 H new ATOM 0 HE2 TYR A 25 101.481 8.817 1.797 1.00 0.00 H new ATOM 0 HH TYR A 25 99.083 11.038 2.942 1.00 0.00 H new ATOM 407 N LYS A 26 103.961 7.099 8.358 1.00 0.00 N ATOM 408 CA LYS A 26 105.100 6.568 9.155 1.00 0.00 C ATOM 409 C LYS A 26 105.611 5.282 8.501 1.00 0.00 C ATOM 410 O LYS A 26 106.491 4.620 9.014 1.00 0.00 O ATOM 411 CB LYS A 26 104.631 6.265 10.580 1.00 0.00 C ATOM 412 CG LYS A 26 104.777 7.520 11.443 1.00 0.00 C ATOM 413 CD LYS A 26 104.177 7.261 12.827 1.00 0.00 C ATOM 414 CE LYS A 26 103.758 8.589 13.459 1.00 0.00 C ATOM 415 NZ LYS A 26 103.484 8.385 14.909 1.00 0.00 N ATOM 0 H LYS A 26 104.071 8.056 8.024 1.00 0.00 H new ATOM 0 HA LYS A 26 105.900 7.307 9.189 1.00 0.00 H new ATOM 0 HB2 LYS A 26 103.592 5.936 10.570 1.00 0.00 H new ATOM 0 HB3 LYS A 26 105.219 5.450 11.002 1.00 0.00 H new ATOM 0 HG2 LYS A 26 105.829 7.790 11.536 1.00 0.00 H new ATOM 0 HG3 LYS A 26 104.273 8.361 10.968 1.00 0.00 H new ATOM 0 HD2 LYS A 26 103.316 6.598 12.743 1.00 0.00 H new ATOM 0 HD3 LYS A 26 104.906 6.758 13.462 1.00 0.00 H new ATOM 0 HE2 LYS A 26 104.546 9.331 13.328 1.00 0.00 H new ATOM 0 HE3 LYS A 26 102.869 8.976 12.961 1.00 0.00 H new ATOM 0 HZ1 LYS A 26 103.199 9.288 15.339 1.00 0.00 H new ATOM 0 HZ2 LYS A 26 102.718 7.690 15.023 1.00 0.00 H new ATOM 0 HZ3 LYS A 26 104.343 8.034 15.379 1.00 0.00 H new ATOM 429 N ASN A 27 105.063 4.923 7.370 1.00 0.00 N ATOM 430 CA ASN A 27 105.514 3.682 6.683 1.00 0.00 C ATOM 431 C ASN A 27 106.551 4.035 5.616 1.00 0.00 C ATOM 432 O ASN A 27 106.542 5.115 5.059 1.00 0.00 O ATOM 433 CB ASN A 27 104.314 2.999 6.023 1.00 0.00 C ATOM 434 CG ASN A 27 103.683 2.011 7.005 1.00 0.00 C ATOM 435 OD1 ASN A 27 103.352 0.900 6.639 1.00 0.00 O ATOM 436 ND2 ASN A 27 103.502 2.369 8.247 1.00 0.00 N ATOM 0 H ASN A 27 104.322 5.437 6.894 1.00 0.00 H new ATOM 0 HA ASN A 27 105.961 3.006 7.412 1.00 0.00 H new ATOM 0 HB2 ASN A 27 103.580 3.745 5.719 1.00 0.00 H new ATOM 0 HB3 ASN A 27 104.631 2.478 5.120 1.00 0.00 H new ATOM 0 HD21 ASN A 27 103.083 1.717 8.910 1.00 0.00 H new ATOM 0 HD22 ASN A 27 103.780 3.301 8.555 1.00 0.00 H new ATOM 443 N LYS A 28 107.445 3.131 5.328 1.00 0.00 N ATOM 444 CA LYS A 28 108.487 3.403 4.300 1.00 0.00 C ATOM 445 C LYS A 28 108.533 2.229 3.316 1.00 0.00 C ATOM 446 O LYS A 28 108.693 2.397 2.119 1.00 0.00 O ATOM 447 CB LYS A 28 109.841 3.542 4.989 1.00 0.00 C ATOM 448 CG LYS A 28 109.958 4.935 5.614 1.00 0.00 C ATOM 449 CD LYS A 28 109.000 5.053 6.805 1.00 0.00 C ATOM 450 CE LYS A 28 109.735 5.670 7.997 1.00 0.00 C ATOM 451 NZ LYS A 28 108.876 5.577 9.212 1.00 0.00 N ATOM 0 H LYS A 28 107.499 2.210 5.763 1.00 0.00 H new ATOM 0 HA LYS A 28 108.254 4.323 3.764 1.00 0.00 H new ATOM 0 HB2 LYS A 28 109.949 2.777 5.758 1.00 0.00 H new ATOM 0 HB3 LYS A 28 110.645 3.387 4.269 1.00 0.00 H new ATOM 0 HG2 LYS A 28 110.983 5.112 5.941 1.00 0.00 H new ATOM 0 HG3 LYS A 28 109.725 5.698 4.871 1.00 0.00 H new ATOM 0 HD2 LYS A 28 108.143 5.669 6.535 1.00 0.00 H new ATOM 0 HD3 LYS A 28 108.614 4.069 7.073 1.00 0.00 H new ATOM 0 HE2 LYS A 28 110.678 5.151 8.165 1.00 0.00 H new ATOM 0 HE3 LYS A 28 109.978 6.712 7.789 1.00 0.00 H new ATOM 0 HZ1 LYS A 28 108.728 6.528 9.606 1.00 0.00 H new ATOM 0 HZ2 LYS A 28 107.958 5.161 8.957 1.00 0.00 H new ATOM 0 HZ3 LYS A 28 109.343 4.977 9.922 1.00 0.00 H new ATOM 465 N LYS A 29 108.391 1.038 3.828 1.00 0.00 N ATOM 466 CA LYS A 29 108.417 -0.180 2.969 1.00 0.00 C ATOM 467 C LYS A 29 107.163 -0.207 2.086 1.00 0.00 C ATOM 468 O LYS A 29 107.004 -1.049 1.228 1.00 0.00 O ATOM 469 CB LYS A 29 108.450 -1.408 3.899 1.00 0.00 C ATOM 470 CG LYS A 29 107.426 -2.464 3.455 1.00 0.00 C ATOM 471 CD LYS A 29 106.008 -1.982 3.787 1.00 0.00 C ATOM 472 CE LYS A 29 105.371 -2.923 4.813 1.00 0.00 C ATOM 473 NZ LYS A 29 105.001 -4.205 4.149 1.00 0.00 N ATOM 0 H LYS A 29 108.256 0.854 4.822 1.00 0.00 H new ATOM 0 HA LYS A 29 109.292 -0.183 2.319 1.00 0.00 H new ATOM 0 HB2 LYS A 29 109.450 -1.843 3.898 1.00 0.00 H new ATOM 0 HB3 LYS A 29 108.238 -1.099 4.923 1.00 0.00 H new ATOM 0 HG2 LYS A 29 107.517 -2.645 2.384 1.00 0.00 H new ATOM 0 HG3 LYS A 29 107.625 -3.411 3.957 1.00 0.00 H new ATOM 0 HD2 LYS A 29 106.042 -0.967 4.182 1.00 0.00 H new ATOM 0 HD3 LYS A 29 105.402 -1.952 2.881 1.00 0.00 H new ATOM 0 HE2 LYS A 29 106.067 -3.112 5.630 1.00 0.00 H new ATOM 0 HE3 LYS A 29 104.487 -2.458 5.249 1.00 0.00 H new ATOM 0 HZ1 LYS A 29 104.568 -4.845 4.846 1.00 0.00 H new ATOM 0 HZ2 LYS A 29 104.322 -4.016 3.384 1.00 0.00 H new ATOM 0 HZ3 LYS A 29 105.854 -4.650 3.754 1.00 0.00 H new ATOM 487 N PHE A 30 106.263 0.698 2.309 1.00 0.00 N ATOM 488 CA PHE A 30 104.999 0.713 1.514 1.00 0.00 C ATOM 489 C PHE A 30 105.246 1.061 0.033 1.00 0.00 C ATOM 490 O PHE A 30 105.238 0.204 -0.832 1.00 0.00 O ATOM 491 CB PHE A 30 104.138 1.822 2.117 1.00 0.00 C ATOM 492 CG PHE A 30 104.975 3.094 2.259 1.00 0.00 C ATOM 493 CD1 PHE A 30 106.308 3.146 1.793 1.00 0.00 C ATOM 494 CD2 PHE A 30 104.411 4.233 2.847 1.00 0.00 C ATOM 495 CE1 PHE A 30 107.052 4.321 1.916 1.00 0.00 C ATOM 496 CE2 PHE A 30 105.167 5.408 2.972 1.00 0.00 C ATOM 497 CZ PHE A 30 106.485 5.449 2.504 1.00 0.00 C ATOM 0 H PHE A 30 106.342 1.435 3.010 1.00 0.00 H new ATOM 0 HA PHE A 30 104.535 -0.273 1.549 1.00 0.00 H new ATOM 0 HB2 PHE A 30 103.273 2.012 1.482 1.00 0.00 H new ATOM 0 HB3 PHE A 30 103.757 1.513 3.091 1.00 0.00 H new ATOM 0 HD1 PHE A 30 106.753 2.273 1.340 1.00 0.00 H new ATOM 0 HD2 PHE A 30 103.392 4.207 3.205 1.00 0.00 H new ATOM 0 HE1 PHE A 30 108.069 4.355 1.554 1.00 0.00 H new ATOM 0 HE2 PHE A 30 104.731 6.283 3.431 1.00 0.00 H new ATOM 0 HZ PHE A 30 107.063 6.356 2.599 1.00 0.00 H new ATOM 507 N MET A 31 105.499 2.310 -0.251 1.00 0.00 N ATOM 508 CA MET A 31 105.777 2.741 -1.644 1.00 0.00 C ATOM 509 C MET A 31 107.227 2.434 -1.991 1.00 0.00 C ATOM 510 O MET A 31 107.534 1.911 -3.044 1.00 0.00 O ATOM 511 CB MET A 31 105.531 4.244 -1.766 1.00 0.00 C ATOM 512 CG MET A 31 106.195 4.769 -3.039 1.00 0.00 C ATOM 513 SD MET A 31 106.012 3.547 -4.362 1.00 0.00 S ATOM 514 CE MET A 31 106.706 4.551 -5.696 1.00 0.00 C ATOM 0 H MET A 31 105.524 3.061 0.439 1.00 0.00 H new ATOM 0 HA MET A 31 105.120 2.206 -2.330 1.00 0.00 H new ATOM 0 HB2 MET A 31 104.460 4.447 -1.792 1.00 0.00 H new ATOM 0 HB3 MET A 31 105.933 4.761 -0.894 1.00 0.00 H new ATOM 0 HG2 MET A 31 105.740 5.714 -3.336 1.00 0.00 H new ATOM 0 HG3 MET A 31 107.251 4.967 -2.856 1.00 0.00 H new ATOM 0 HE1 MET A 31 106.610 4.017 -6.641 1.00 0.00 H new ATOM 0 HE2 MET A 31 106.168 5.497 -5.757 1.00 0.00 H new ATOM 0 HE3 MET A 31 107.759 4.746 -5.495 1.00 0.00 H new ATOM 524 N GLN A 32 108.126 2.783 -1.111 1.00 0.00 N ATOM 525 CA GLN A 32 109.561 2.547 -1.380 1.00 0.00 C ATOM 526 C GLN A 32 109.855 1.049 -1.273 1.00 0.00 C ATOM 527 O GLN A 32 110.727 0.529 -1.936 1.00 0.00 O ATOM 528 CB GLN A 32 110.392 3.350 -0.378 1.00 0.00 C ATOM 529 CG GLN A 32 110.157 4.844 -0.611 1.00 0.00 C ATOM 530 CD GLN A 32 110.942 5.652 0.424 1.00 0.00 C ATOM 531 OE1 GLN A 32 110.416 6.567 1.024 1.00 0.00 O ATOM 532 NE2 GLN A 32 112.190 5.349 0.659 1.00 0.00 N ATOM 0 H GLN A 32 107.921 3.223 -0.214 1.00 0.00 H new ATOM 0 HA GLN A 32 109.822 2.874 -2.387 1.00 0.00 H new ATOM 0 HB2 GLN A 32 110.114 3.081 0.641 1.00 0.00 H new ATOM 0 HB3 GLN A 32 111.450 3.114 -0.493 1.00 0.00 H new ATOM 0 HG2 GLN A 32 110.471 5.120 -1.618 1.00 0.00 H new ATOM 0 HG3 GLN A 32 109.094 5.072 -0.535 1.00 0.00 H new ATOM 0 HE21 GLN A 32 112.632 4.580 0.155 1.00 0.00 H new ATOM 0 HE22 GLN A 32 112.723 5.881 1.347 1.00 0.00 H new ATOM 541 N GLY A 33 109.128 0.335 -0.460 1.00 0.00 N ATOM 542 CA GLY A 33 109.382 -1.125 -0.363 1.00 0.00 C ATOM 543 C GLY A 33 108.907 -1.768 -1.662 1.00 0.00 C ATOM 544 O GLY A 33 109.448 -2.757 -2.117 1.00 0.00 O ATOM 0 H GLY A 33 108.380 0.694 0.133 1.00 0.00 H new ATOM 0 HA2 GLY A 33 110.443 -1.319 -0.207 1.00 0.00 H new ATOM 0 HA3 GLY A 33 108.852 -1.549 0.490 1.00 0.00 H new ATOM 548 N THR A 34 107.899 -1.197 -2.270 1.00 0.00 N ATOM 549 CA THR A 34 107.384 -1.754 -3.551 1.00 0.00 C ATOM 550 C THR A 34 108.398 -1.493 -4.669 1.00 0.00 C ATOM 551 O THR A 34 108.572 -2.304 -5.557 1.00 0.00 O ATOM 552 CB THR A 34 106.054 -1.080 -3.901 1.00 0.00 C ATOM 553 OG1 THR A 34 106.026 0.226 -3.342 1.00 0.00 O ATOM 554 CG2 THR A 34 104.897 -1.905 -3.335 1.00 0.00 C ATOM 0 H THR A 34 107.411 -0.368 -1.932 1.00 0.00 H new ATOM 0 HA THR A 34 107.232 -2.828 -3.444 1.00 0.00 H new ATOM 0 HB THR A 34 105.953 -1.014 -4.984 1.00 0.00 H new ATOM 0 HG1 THR A 34 106.863 0.690 -3.554 1.00 0.00 H new ATOM 0 HG21 THR A 34 103.951 -1.424 -3.585 1.00 0.00 H new ATOM 0 HG22 THR A 34 104.920 -2.906 -3.765 1.00 0.00 H new ATOM 0 HG23 THR A 34 104.995 -1.973 -2.251 1.00 0.00 H new ATOM 562 N VAL A 35 109.075 -0.372 -4.639 1.00 0.00 N ATOM 563 CA VAL A 35 110.073 -0.088 -5.712 1.00 0.00 C ATOM 564 C VAL A 35 111.330 -0.925 -5.458 1.00 0.00 C ATOM 565 O VAL A 35 111.853 -1.561 -6.350 1.00 0.00 O ATOM 566 CB VAL A 35 110.435 1.405 -5.730 1.00 0.00 C ATOM 567 CG1 VAL A 35 109.163 2.252 -5.691 1.00 0.00 C ATOM 568 CG2 VAL A 35 111.301 1.747 -4.521 1.00 0.00 C ATOM 0 H VAL A 35 108.981 0.351 -3.926 1.00 0.00 H new ATOM 0 HA VAL A 35 109.643 -0.348 -6.679 1.00 0.00 H new ATOM 0 HB VAL A 35 110.987 1.619 -6.645 1.00 0.00 H new ATOM 0 HG11 VAL A 35 109.429 3.309 -5.704 1.00 0.00 H new ATOM 0 HG12 VAL A 35 108.546 2.022 -6.560 1.00 0.00 H new ATOM 0 HG13 VAL A 35 108.605 2.029 -4.781 1.00 0.00 H new ATOM 0 HG21 VAL A 35 111.553 2.807 -4.542 1.00 0.00 H new ATOM 0 HG22 VAL A 35 110.753 1.522 -3.606 1.00 0.00 H new ATOM 0 HG23 VAL A 35 112.216 1.156 -4.550 1.00 0.00 H new ATOM 578 N ALA A 36 111.819 -0.939 -4.247 1.00 0.00 N ATOM 579 CA ALA A 36 113.035 -1.746 -3.952 1.00 0.00 C ATOM 580 C ALA A 36 112.863 -3.137 -4.562 1.00 0.00 C ATOM 581 O ALA A 36 113.678 -3.590 -5.341 1.00 0.00 O ATOM 582 CB ALA A 36 113.213 -1.868 -2.437 1.00 0.00 C ATOM 0 H ALA A 36 111.430 -0.429 -3.454 1.00 0.00 H new ATOM 0 HA ALA A 36 113.914 -1.262 -4.377 1.00 0.00 H new ATOM 0 HB1 ALA A 36 114.103 -2.459 -2.222 1.00 0.00 H new ATOM 0 HB2 ALA A 36 113.323 -0.874 -2.002 1.00 0.00 H new ATOM 0 HB3 ALA A 36 112.340 -2.358 -2.006 1.00 0.00 H new ATOM 588 N VAL A 37 111.801 -3.813 -4.219 1.00 0.00 N ATOM 589 CA VAL A 37 111.568 -5.171 -4.785 1.00 0.00 C ATOM 590 C VAL A 37 111.523 -5.079 -6.309 1.00 0.00 C ATOM 591 O VAL A 37 112.069 -5.915 -7.008 1.00 0.00 O ATOM 592 CB VAL A 37 110.241 -5.726 -4.266 1.00 0.00 C ATOM 593 CG1 VAL A 37 109.124 -4.717 -4.537 1.00 0.00 C ATOM 594 CG2 VAL A 37 109.924 -7.040 -4.982 1.00 0.00 C ATOM 0 H VAL A 37 111.085 -3.484 -3.572 1.00 0.00 H new ATOM 0 HA VAL A 37 112.377 -5.836 -4.481 1.00 0.00 H new ATOM 0 HB VAL A 37 110.317 -5.904 -3.193 1.00 0.00 H new ATOM 0 HG11 VAL A 37 108.178 -5.113 -4.167 1.00 0.00 H new ATOM 0 HG12 VAL A 37 109.349 -3.780 -4.028 1.00 0.00 H new ATOM 0 HG13 VAL A 37 109.048 -4.538 -5.610 1.00 0.00 H new ATOM 0 HG21 VAL A 37 108.978 -7.437 -4.613 1.00 0.00 H new ATOM 0 HG22 VAL A 37 109.848 -6.861 -6.055 1.00 0.00 H new ATOM 0 HG23 VAL A 37 110.719 -7.760 -4.790 1.00 0.00 H new ATOM 604 N CYS A 38 110.891 -4.063 -6.839 1.00 0.00 N ATOM 605 CA CYS A 38 110.840 -3.932 -8.317 1.00 0.00 C ATOM 606 C CYS A 38 112.268 -4.034 -8.841 1.00 0.00 C ATOM 607 O CYS A 38 112.513 -4.470 -9.945 1.00 0.00 O ATOM 608 CB CYS A 38 110.240 -2.578 -8.706 1.00 0.00 C ATOM 609 SG CYS A 38 108.524 -2.491 -8.135 1.00 0.00 S ATOM 0 H CYS A 38 110.415 -3.329 -6.315 1.00 0.00 H new ATOM 0 HA CYS A 38 110.217 -4.717 -8.745 1.00 0.00 H new ATOM 0 HB2 CYS A 38 110.823 -1.770 -8.264 1.00 0.00 H new ATOM 0 HB3 CYS A 38 110.282 -2.447 -9.787 1.00 0.00 H new ATOM 0 HG CYS A 38 108.498 -2.505 -6.835 1.00 0.00 H new ATOM 615 N ALA A 39 113.217 -3.632 -8.046 1.00 0.00 N ATOM 616 CA ALA A 39 114.631 -3.719 -8.482 1.00 0.00 C ATOM 617 C ALA A 39 115.144 -5.155 -8.314 1.00 0.00 C ATOM 618 O ALA A 39 115.741 -5.724 -9.206 1.00 0.00 O ATOM 619 CB ALA A 39 115.483 -2.775 -7.638 1.00 0.00 C ATOM 0 H ALA A 39 113.072 -3.247 -7.113 1.00 0.00 H new ATOM 0 HA ALA A 39 114.698 -3.435 -9.532 1.00 0.00 H new ATOM 0 HB1 ALA A 39 116.523 -2.839 -7.958 1.00 0.00 H new ATOM 0 HB2 ALA A 39 115.127 -1.753 -7.764 1.00 0.00 H new ATOM 0 HB3 ALA A 39 115.409 -3.058 -6.588 1.00 0.00 H new ATOM 625 N ARG A 40 114.940 -5.728 -7.158 1.00 0.00 N ATOM 626 CA ARG A 40 115.445 -7.108 -6.892 1.00 0.00 C ATOM 627 C ARG A 40 115.251 -8.009 -8.113 1.00 0.00 C ATOM 628 O ARG A 40 116.118 -8.786 -8.451 1.00 0.00 O ATOM 629 CB ARG A 40 114.697 -7.702 -5.700 1.00 0.00 C ATOM 630 CG ARG A 40 115.197 -9.126 -5.437 1.00 0.00 C ATOM 631 CD ARG A 40 114.215 -10.137 -6.034 1.00 0.00 C ATOM 632 NE ARG A 40 112.841 -9.853 -5.531 1.00 0.00 N ATOM 633 CZ ARG A 40 111.954 -10.810 -5.482 1.00 0.00 C ATOM 634 NH1 ARG A 40 112.270 -12.014 -5.873 1.00 0.00 N ATOM 635 NH2 ARG A 40 110.751 -10.561 -5.042 1.00 0.00 N ATOM 0 H ARG A 40 114.441 -5.296 -6.380 1.00 0.00 H new ATOM 0 HA ARG A 40 116.511 -7.048 -6.673 1.00 0.00 H new ATOM 0 HB2 ARG A 40 114.851 -7.083 -4.816 1.00 0.00 H new ATOM 0 HB3 ARG A 40 113.625 -7.713 -5.899 1.00 0.00 H new ATOM 0 HG2 ARG A 40 116.185 -9.262 -5.876 1.00 0.00 H new ATOM 0 HG3 ARG A 40 115.299 -9.294 -4.365 1.00 0.00 H new ATOM 0 HD2 ARG A 40 114.234 -10.080 -7.122 1.00 0.00 H new ATOM 0 HD3 ARG A 40 114.511 -11.151 -5.763 1.00 0.00 H new ATOM 0 HE ARG A 40 112.594 -8.912 -5.225 1.00 0.00 H new ATOM 0 HH11 ARG A 40 113.210 -12.208 -6.217 1.00 0.00 H new ATOM 0 HH12 ARG A 40 111.577 -12.761 -5.834 1.00 0.00 H new ATOM 0 HH21 ARG A 40 110.504 -9.620 -4.737 1.00 0.00 H new ATOM 0 HH22 ARG A 40 110.057 -11.308 -5.003 1.00 0.00 H new ATOM 649 N ILE A 41 114.129 -7.941 -8.772 1.00 0.00 N ATOM 650 CA ILE A 41 113.934 -8.827 -9.959 1.00 0.00 C ATOM 651 C ILE A 41 114.380 -8.126 -11.247 1.00 0.00 C ATOM 652 O ILE A 41 114.645 -8.767 -12.245 1.00 0.00 O ATOM 653 CB ILE A 41 112.464 -9.228 -10.078 1.00 0.00 C ATOM 654 CG1 ILE A 41 111.578 -8.115 -9.522 1.00 0.00 C ATOM 655 CG2 ILE A 41 112.229 -10.509 -9.283 1.00 0.00 C ATOM 656 CD1 ILE A 41 111.949 -6.794 -10.190 1.00 0.00 C ATOM 0 H ILE A 41 113.349 -7.323 -8.548 1.00 0.00 H new ATOM 0 HA ILE A 41 114.545 -9.719 -9.819 1.00 0.00 H new ATOM 0 HB ILE A 41 112.216 -9.393 -11.127 1.00 0.00 H new ATOM 0 HG12 ILE A 41 110.528 -8.345 -9.703 1.00 0.00 H new ATOM 0 HG13 ILE A 41 111.705 -8.038 -8.442 1.00 0.00 H new ATOM 0 HG21 ILE A 41 111.182 -10.800 -9.364 1.00 0.00 H new ATOM 0 HG22 ILE A 41 112.859 -11.305 -9.681 1.00 0.00 H new ATOM 0 HG23 ILE A 41 112.478 -10.338 -8.236 1.00 0.00 H new ATOM 0 HD11 ILE A 41 111.319 -5.997 -9.796 1.00 0.00 H new ATOM 0 HD12 ILE A 41 112.995 -6.564 -9.986 1.00 0.00 H new ATOM 0 HD13 ILE A 41 111.799 -6.876 -11.267 1.00 0.00 H new ATOM 668 N ALA A 42 114.457 -6.822 -11.251 1.00 0.00 N ATOM 669 CA ALA A 42 114.874 -6.114 -12.495 1.00 0.00 C ATOM 670 C ALA A 42 116.399 -5.984 -12.531 1.00 0.00 C ATOM 671 O ALA A 42 116.962 -5.447 -13.464 1.00 0.00 O ATOM 672 CB ALA A 42 114.226 -4.728 -12.534 1.00 0.00 C ATOM 0 H ALA A 42 114.251 -6.221 -10.453 1.00 0.00 H new ATOM 0 HA ALA A 42 114.549 -6.685 -13.365 1.00 0.00 H new ATOM 0 HB1 ALA A 42 114.530 -4.210 -13.443 1.00 0.00 H new ATOM 0 HB2 ALA A 42 113.141 -4.833 -12.522 1.00 0.00 H new ATOM 0 HB3 ALA A 42 114.544 -4.153 -11.665 1.00 0.00 H new ATOM 678 N VAL A 43 117.067 -6.461 -11.514 1.00 0.00 N ATOM 679 CA VAL A 43 118.560 -6.360 -11.471 1.00 0.00 C ATOM 680 C VAL A 43 119.147 -6.402 -12.887 1.00 0.00 C ATOM 681 O VAL A 43 120.173 -5.812 -13.157 1.00 0.00 O ATOM 682 CB VAL A 43 119.126 -7.506 -10.627 1.00 0.00 C ATOM 683 CG1 VAL A 43 118.058 -8.014 -9.664 1.00 0.00 C ATOM 684 CG2 VAL A 43 119.584 -8.656 -11.526 1.00 0.00 C ATOM 0 H VAL A 43 116.643 -6.918 -10.707 1.00 0.00 H new ATOM 0 HA VAL A 43 118.837 -5.408 -11.018 1.00 0.00 H new ATOM 0 HB VAL A 43 119.981 -7.132 -10.064 1.00 0.00 H new ATOM 0 HG11 VAL A 43 118.465 -8.829 -9.066 1.00 0.00 H new ATOM 0 HG12 VAL A 43 117.745 -7.203 -9.007 1.00 0.00 H new ATOM 0 HG13 VAL A 43 117.199 -8.374 -10.230 1.00 0.00 H new ATOM 0 HG21 VAL A 43 119.984 -9.462 -10.911 1.00 0.00 H new ATOM 0 HG22 VAL A 43 118.737 -9.026 -12.103 1.00 0.00 H new ATOM 0 HG23 VAL A 43 120.359 -8.300 -12.206 1.00 0.00 H new ATOM 694 N ALA A 44 118.513 -7.088 -13.792 1.00 0.00 N ATOM 695 CA ALA A 44 119.045 -7.159 -15.183 1.00 0.00 C ATOM 696 C ALA A 44 120.455 -7.756 -15.159 1.00 0.00 C ATOM 697 O ALA A 44 120.957 -8.225 -16.161 1.00 0.00 O ATOM 698 CB ALA A 44 119.093 -5.752 -15.784 1.00 0.00 C ATOM 0 H ALA A 44 117.648 -7.604 -13.631 1.00 0.00 H new ATOM 0 HA ALA A 44 118.395 -7.789 -15.790 1.00 0.00 H new ATOM 0 HB1 ALA A 44 119.482 -5.804 -16.801 1.00 0.00 H new ATOM 0 HB2 ALA A 44 118.089 -5.329 -15.801 1.00 0.00 H new ATOM 0 HB3 ALA A 44 119.743 -5.120 -15.179 1.00 0.00 H new ATOM 704 N SER A 45 121.098 -7.742 -14.022 1.00 0.00 N ATOM 705 CA SER A 45 122.472 -8.309 -13.936 1.00 0.00 C ATOM 706 C SER A 45 122.419 -9.814 -14.162 1.00 0.00 C ATOM 707 O SER A 45 121.625 -10.317 -14.932 1.00 0.00 O ATOM 708 CB SER A 45 123.056 -8.039 -12.551 1.00 0.00 C ATOM 709 OG SER A 45 124.472 -7.968 -12.645 1.00 0.00 O ATOM 0 H SER A 45 120.730 -7.362 -13.150 1.00 0.00 H new ATOM 0 HA SER A 45 123.097 -7.841 -14.697 1.00 0.00 H new ATOM 0 HB2 SER A 45 122.659 -7.106 -12.152 1.00 0.00 H new ATOM 0 HB3 SER A 45 122.765 -8.830 -11.860 1.00 0.00 H new ATOM 0 HG SER A 45 124.734 -7.084 -12.978 1.00 0.00 H new ATOM 715 N ASP A 46 123.263 -10.533 -13.486 1.00 0.00 N ATOM 716 CA ASP A 46 123.278 -12.014 -13.642 1.00 0.00 C ATOM 717 C ASP A 46 123.317 -12.667 -12.259 1.00 0.00 C ATOM 718 O ASP A 46 124.205 -13.436 -11.951 1.00 0.00 O ATOM 719 CB ASP A 46 124.516 -12.432 -14.438 1.00 0.00 C ATOM 720 CG ASP A 46 124.652 -13.955 -14.408 1.00 0.00 C ATOM 721 OD1 ASP A 46 123.848 -14.615 -15.046 1.00 0.00 O ATOM 722 OD2 ASP A 46 125.559 -14.436 -13.748 1.00 0.00 O ATOM 0 H ASP A 46 123.948 -10.160 -12.828 1.00 0.00 H new ATOM 0 HA ASP A 46 122.382 -12.334 -14.173 1.00 0.00 H new ATOM 0 HB2 ASP A 46 124.434 -12.084 -15.468 1.00 0.00 H new ATOM 0 HB3 ASP A 46 125.407 -11.968 -14.015 1.00 0.00 H new ATOM 727 N GLY A 47 122.362 -12.366 -11.421 1.00 0.00 N ATOM 728 CA GLY A 47 122.354 -12.971 -10.060 1.00 0.00 C ATOM 729 C GLY A 47 120.969 -12.827 -9.431 1.00 0.00 C ATOM 730 O GLY A 47 120.351 -13.796 -9.037 1.00 0.00 O ATOM 0 H GLY A 47 121.590 -11.730 -11.620 1.00 0.00 H new ATOM 0 HA2 GLY A 47 122.627 -14.024 -10.120 1.00 0.00 H new ATOM 0 HA3 GLY A 47 123.100 -12.484 -9.432 1.00 0.00 H new ATOM 734 N VAL A 48 120.479 -11.625 -9.328 1.00 0.00 N ATOM 735 CA VAL A 48 119.138 -11.414 -8.720 1.00 0.00 C ATOM 736 C VAL A 48 119.212 -11.666 -7.215 1.00 0.00 C ATOM 737 O VAL A 48 119.963 -12.499 -6.748 1.00 0.00 O ATOM 738 CB VAL A 48 118.127 -12.372 -9.352 1.00 0.00 C ATOM 739 CG1 VAL A 48 116.724 -11.768 -9.255 1.00 0.00 C ATOM 740 CG2 VAL A 48 118.485 -12.595 -10.825 1.00 0.00 C ATOM 0 H VAL A 48 120.951 -10.776 -9.640 1.00 0.00 H new ATOM 0 HA VAL A 48 118.820 -10.387 -8.900 1.00 0.00 H new ATOM 0 HB VAL A 48 118.151 -13.325 -8.824 1.00 0.00 H new ATOM 0 HG11 VAL A 48 116.002 -12.450 -9.705 1.00 0.00 H new ATOM 0 HG12 VAL A 48 116.468 -11.609 -8.208 1.00 0.00 H new ATOM 0 HG13 VAL A 48 116.701 -10.815 -9.783 1.00 0.00 H new ATOM 0 HG21 VAL A 48 117.764 -13.278 -11.275 1.00 0.00 H new ATOM 0 HG22 VAL A 48 118.461 -11.642 -11.354 1.00 0.00 H new ATOM 0 HG23 VAL A 48 119.484 -13.024 -10.896 1.00 0.00 H new ATOM 750 N SER A 49 118.439 -10.944 -6.451 1.00 0.00 N ATOM 751 CA SER A 49 118.462 -11.131 -4.975 1.00 0.00 C ATOM 752 C SER A 49 117.110 -11.668 -4.501 1.00 0.00 C ATOM 753 O SER A 49 116.499 -12.495 -5.148 1.00 0.00 O ATOM 754 CB SER A 49 118.743 -9.788 -4.300 1.00 0.00 C ATOM 755 OG SER A 49 118.573 -9.924 -2.896 1.00 0.00 O ATOM 0 H SER A 49 117.791 -10.231 -6.787 1.00 0.00 H new ATOM 0 HA SER A 49 119.243 -11.844 -4.712 1.00 0.00 H new ATOM 0 HB2 SER A 49 119.758 -9.460 -4.525 1.00 0.00 H new ATOM 0 HB3 SER A 49 118.068 -9.025 -4.687 1.00 0.00 H new ATOM 0 HG SER A 49 118.849 -10.822 -2.619 1.00 0.00 H new ATOM 761 N SER A 50 116.644 -11.204 -3.373 1.00 0.00 N ATOM 762 CA SER A 50 115.340 -11.678 -2.836 1.00 0.00 C ATOM 763 C SER A 50 115.363 -11.516 -1.319 1.00 0.00 C ATOM 764 O SER A 50 114.663 -10.697 -0.760 1.00 0.00 O ATOM 765 CB SER A 50 115.137 -13.153 -3.188 1.00 0.00 C ATOM 766 OG SER A 50 114.346 -13.771 -2.181 1.00 0.00 O ATOM 0 H SER A 50 117.118 -10.509 -2.796 1.00 0.00 H new ATOM 0 HA SER A 50 114.525 -11.099 -3.269 1.00 0.00 H new ATOM 0 HB2 SER A 50 114.648 -13.243 -4.158 1.00 0.00 H new ATOM 0 HB3 SER A 50 116.101 -13.656 -3.269 1.00 0.00 H new ATOM 0 HG SER A 50 114.212 -14.716 -2.404 1.00 0.00 H new ATOM 772 N GLU A 51 116.178 -12.285 -0.652 1.00 0.00 N ATOM 773 CA GLU A 51 116.267 -12.172 0.828 1.00 0.00 C ATOM 774 C GLU A 51 116.978 -10.867 1.193 1.00 0.00 C ATOM 775 O GLU A 51 116.669 -10.239 2.185 1.00 0.00 O ATOM 776 CB GLU A 51 117.057 -13.358 1.384 1.00 0.00 C ATOM 777 CG GLU A 51 116.201 -14.624 1.305 1.00 0.00 C ATOM 778 CD GLU A 51 117.109 -15.856 1.311 1.00 0.00 C ATOM 779 OE1 GLU A 51 118.205 -15.756 1.837 1.00 0.00 O ATOM 780 OE2 GLU A 51 116.692 -16.877 0.791 1.00 0.00 O ATOM 0 H GLU A 51 116.787 -12.988 -1.070 1.00 0.00 H new ATOM 0 HA GLU A 51 115.265 -12.174 1.256 1.00 0.00 H new ATOM 0 HB2 GLU A 51 117.978 -13.493 0.817 1.00 0.00 H new ATOM 0 HB3 GLU A 51 117.345 -13.165 2.417 1.00 0.00 H new ATOM 0 HG2 GLU A 51 115.512 -14.663 2.149 1.00 0.00 H new ATOM 0 HG3 GLU A 51 115.595 -14.610 0.399 1.00 0.00 H new ATOM 787 N GLU A 52 117.937 -10.455 0.404 1.00 0.00 N ATOM 788 CA GLU A 52 118.665 -9.193 0.722 1.00 0.00 C ATOM 789 C GLU A 52 117.750 -7.992 0.471 1.00 0.00 C ATOM 790 O GLU A 52 117.565 -7.159 1.335 1.00 0.00 O ATOM 791 CB GLU A 52 119.905 -9.082 -0.167 1.00 0.00 C ATOM 792 CG GLU A 52 121.137 -9.560 0.605 1.00 0.00 C ATOM 793 CD GLU A 52 121.392 -8.627 1.790 1.00 0.00 C ATOM 794 OE1 GLU A 52 122.046 -7.617 1.594 1.00 0.00 O ATOM 795 OE2 GLU A 52 120.929 -8.940 2.875 1.00 0.00 O ATOM 0 H GLU A 52 118.245 -10.935 -0.441 1.00 0.00 H new ATOM 0 HA GLU A 52 118.966 -9.205 1.770 1.00 0.00 H new ATOM 0 HB2 GLU A 52 119.773 -9.681 -1.068 1.00 0.00 H new ATOM 0 HB3 GLU A 52 120.043 -8.050 -0.488 1.00 0.00 H new ATOM 0 HG2 GLU A 52 120.985 -10.580 0.958 1.00 0.00 H new ATOM 0 HG3 GLU A 52 122.007 -9.577 -0.052 1.00 0.00 H new ATOM 802 N LYS A 53 117.159 -7.896 -0.692 1.00 0.00 N ATOM 803 CA LYS A 53 116.250 -6.742 -0.948 1.00 0.00 C ATOM 804 C LYS A 53 115.223 -6.694 0.173 1.00 0.00 C ATOM 805 O LYS A 53 114.901 -5.648 0.698 1.00 0.00 O ATOM 806 CB LYS A 53 115.522 -6.916 -2.287 1.00 0.00 C ATOM 807 CG LYS A 53 114.359 -5.919 -2.369 1.00 0.00 C ATOM 808 CD LYS A 53 113.054 -6.575 -1.892 1.00 0.00 C ATOM 809 CE LYS A 53 112.719 -7.792 -2.759 1.00 0.00 C ATOM 810 NZ LYS A 53 113.139 -9.035 -2.052 1.00 0.00 N ATOM 0 H LYS A 53 117.264 -8.555 -1.463 1.00 0.00 H new ATOM 0 HA LYS A 53 116.831 -5.821 -0.987 1.00 0.00 H new ATOM 0 HB2 LYS A 53 116.214 -6.753 -3.113 1.00 0.00 H new ATOM 0 HB3 LYS A 53 115.148 -7.936 -2.380 1.00 0.00 H new ATOM 0 HG2 LYS A 53 114.578 -5.044 -1.757 1.00 0.00 H new ATOM 0 HG3 LYS A 53 114.243 -5.569 -3.395 1.00 0.00 H new ATOM 0 HD2 LYS A 53 113.152 -6.879 -0.850 1.00 0.00 H new ATOM 0 HD3 LYS A 53 112.239 -5.853 -1.938 1.00 0.00 H new ATOM 0 HE2 LYS A 53 111.649 -7.822 -2.965 1.00 0.00 H new ATOM 0 HE3 LYS A 53 113.227 -7.718 -3.721 1.00 0.00 H new ATOM 0 HZ1 LYS A 53 112.464 -9.798 -2.261 1.00 0.00 H new ATOM 0 HZ2 LYS A 53 114.088 -9.314 -2.374 1.00 0.00 H new ATOM 0 HZ3 LYS A 53 113.158 -8.862 -1.027 1.00 0.00 H new ATOM 824 N GLN A 54 114.706 -7.832 0.538 1.00 0.00 N ATOM 825 CA GLN A 54 113.691 -7.885 1.622 1.00 0.00 C ATOM 826 C GLN A 54 114.227 -7.147 2.858 1.00 0.00 C ATOM 827 O GLN A 54 113.523 -6.379 3.491 1.00 0.00 O ATOM 828 CB GLN A 54 113.390 -9.358 1.941 1.00 0.00 C ATOM 829 CG GLN A 54 113.956 -9.750 3.308 1.00 0.00 C ATOM 830 CD GLN A 54 113.138 -9.084 4.416 1.00 0.00 C ATOM 831 OE1 GLN A 54 113.336 -9.358 5.583 1.00 0.00 O ATOM 832 NE2 GLN A 54 112.218 -8.214 4.098 1.00 0.00 N ATOM 0 H GLN A 54 114.946 -8.735 0.128 1.00 0.00 H new ATOM 0 HA GLN A 54 112.768 -7.397 1.310 1.00 0.00 H new ATOM 0 HB2 GLN A 54 112.313 -9.524 1.928 1.00 0.00 H new ATOM 0 HB3 GLN A 54 113.820 -9.996 1.169 1.00 0.00 H new ATOM 0 HG2 GLN A 54 113.931 -10.833 3.425 1.00 0.00 H new ATOM 0 HG3 GLN A 54 115.000 -9.446 3.381 1.00 0.00 H new ATOM 0 HE21 GLN A 54 112.051 -7.983 3.119 1.00 0.00 H new ATOM 0 HE22 GLN A 54 111.666 -7.765 4.829 1.00 0.00 H new ATOM 841 N LYS A 55 115.470 -7.355 3.202 1.00 0.00 N ATOM 842 CA LYS A 55 116.033 -6.647 4.384 1.00 0.00 C ATOM 843 C LYS A 55 116.054 -5.147 4.086 1.00 0.00 C ATOM 844 O LYS A 55 115.700 -4.336 4.918 1.00 0.00 O ATOM 845 CB LYS A 55 117.453 -7.150 4.670 1.00 0.00 C ATOM 846 CG LYS A 55 117.427 -8.114 5.859 1.00 0.00 C ATOM 847 CD LYS A 55 116.656 -9.379 5.477 1.00 0.00 C ATOM 848 CE LYS A 55 117.003 -10.502 6.456 1.00 0.00 C ATOM 849 NZ LYS A 55 116.461 -10.171 7.804 1.00 0.00 N ATOM 0 H LYS A 55 116.115 -7.980 2.718 1.00 0.00 H new ATOM 0 HA LYS A 55 115.418 -6.841 5.263 1.00 0.00 H new ATOM 0 HB2 LYS A 55 117.856 -7.652 3.790 1.00 0.00 H new ATOM 0 HB3 LYS A 55 118.111 -6.308 4.886 1.00 0.00 H new ATOM 0 HG2 LYS A 55 118.444 -8.371 6.154 1.00 0.00 H new ATOM 0 HG3 LYS A 55 116.957 -7.635 6.718 1.00 0.00 H new ATOM 0 HD2 LYS A 55 115.584 -9.184 5.496 1.00 0.00 H new ATOM 0 HD3 LYS A 55 116.908 -9.678 4.460 1.00 0.00 H new ATOM 0 HE2 LYS A 55 116.585 -11.446 6.106 1.00 0.00 H new ATOM 0 HE3 LYS A 55 118.084 -10.632 6.509 1.00 0.00 H new ATOM 0 HZ1 LYS A 55 116.546 -11.001 8.425 1.00 0.00 H new ATOM 0 HZ2 LYS A 55 116.999 -9.378 8.209 1.00 0.00 H new ATOM 0 HZ3 LYS A 55 115.460 -9.903 7.719 1.00 0.00 H new ATOM 863 N MET A 56 116.454 -4.768 2.899 1.00 0.00 N ATOM 864 CA MET A 56 116.477 -3.322 2.556 1.00 0.00 C ATOM 865 C MET A 56 115.102 -2.723 2.856 1.00 0.00 C ATOM 866 O MET A 56 114.995 -1.672 3.456 1.00 0.00 O ATOM 867 CB MET A 56 116.797 -3.150 1.068 1.00 0.00 C ATOM 868 CG MET A 56 118.308 -3.261 0.848 1.00 0.00 C ATOM 869 SD MET A 56 118.763 -5.000 0.615 1.00 0.00 S ATOM 870 CE MET A 56 119.266 -5.359 2.317 1.00 0.00 C ATOM 0 H MET A 56 116.764 -5.397 2.158 1.00 0.00 H new ATOM 0 HA MET A 56 117.241 -2.814 3.145 1.00 0.00 H new ATOM 0 HB2 MET A 56 116.278 -3.911 0.484 1.00 0.00 H new ATOM 0 HB3 MET A 56 116.439 -2.181 0.719 1.00 0.00 H new ATOM 0 HG2 MET A 56 118.602 -2.678 -0.024 1.00 0.00 H new ATOM 0 HG3 MET A 56 118.842 -2.847 1.703 1.00 0.00 H new ATOM 0 HE1 MET A 56 120.154 -5.991 2.308 1.00 0.00 H new ATOM 0 HE2 MET A 56 119.489 -4.426 2.835 1.00 0.00 H new ATOM 0 HE3 MET A 56 118.458 -5.877 2.834 1.00 0.00 H new ATOM 880 N ILE A 57 114.041 -3.382 2.463 1.00 0.00 N ATOM 881 CA ILE A 57 112.693 -2.826 2.765 1.00 0.00 C ATOM 882 C ILE A 57 112.640 -2.528 4.261 1.00 0.00 C ATOM 883 O ILE A 57 112.118 -1.519 4.689 1.00 0.00 O ATOM 884 CB ILE A 57 111.593 -3.829 2.394 1.00 0.00 C ATOM 885 CG1 ILE A 57 112.087 -4.747 1.275 1.00 0.00 C ATOM 886 CG2 ILE A 57 110.344 -3.078 1.914 1.00 0.00 C ATOM 887 CD1 ILE A 57 110.976 -5.731 0.898 1.00 0.00 C ATOM 0 H ILE A 57 114.051 -4.266 1.955 1.00 0.00 H new ATOM 0 HA ILE A 57 112.526 -1.920 2.182 1.00 0.00 H new ATOM 0 HB ILE A 57 111.345 -4.424 3.273 1.00 0.00 H new ATOM 0 HG12 ILE A 57 112.375 -4.156 0.406 1.00 0.00 H new ATOM 0 HG13 ILE A 57 112.974 -5.290 1.600 1.00 0.00 H new ATOM 0 HG21 ILE A 57 109.566 -3.795 1.652 1.00 0.00 H new ATOM 0 HG22 ILE A 57 109.983 -2.426 2.710 1.00 0.00 H new ATOM 0 HG23 ILE A 57 110.594 -2.478 1.039 1.00 0.00 H new ATOM 0 HD11 ILE A 57 111.326 -6.387 0.100 1.00 0.00 H new ATOM 0 HD12 ILE A 57 110.709 -6.330 1.769 1.00 0.00 H new ATOM 0 HD13 ILE A 57 110.101 -5.178 0.556 1.00 0.00 H new ATOM 899 N GLY A 58 113.208 -3.387 5.064 1.00 0.00 N ATOM 900 CA GLY A 58 113.220 -3.122 6.530 1.00 0.00 C ATOM 901 C GLY A 58 113.944 -1.793 6.755 1.00 0.00 C ATOM 902 O GLY A 58 113.497 -0.935 7.497 1.00 0.00 O ATOM 0 H GLY A 58 113.660 -4.253 4.771 1.00 0.00 H new ATOM 0 HA2 GLY A 58 112.203 -3.074 6.919 1.00 0.00 H new ATOM 0 HA3 GLY A 58 113.726 -3.928 7.061 1.00 0.00 H new ATOM 906 N PHE A 59 115.051 -1.607 6.085 1.00 0.00 N ATOM 907 CA PHE A 59 115.797 -0.330 6.222 1.00 0.00 C ATOM 908 C PHE A 59 114.833 0.803 5.889 1.00 0.00 C ATOM 909 O PHE A 59 114.823 1.835 6.525 1.00 0.00 O ATOM 910 CB PHE A 59 116.983 -0.332 5.247 1.00 0.00 C ATOM 911 CG PHE A 59 117.057 0.978 4.497 1.00 0.00 C ATOM 912 CD1 PHE A 59 117.671 2.089 5.083 1.00 0.00 C ATOM 913 CD2 PHE A 59 116.519 1.075 3.208 1.00 0.00 C ATOM 914 CE1 PHE A 59 117.746 3.297 4.383 1.00 0.00 C ATOM 915 CE2 PHE A 59 116.594 2.283 2.507 1.00 0.00 C ATOM 916 CZ PHE A 59 117.206 3.394 3.095 1.00 0.00 C ATOM 0 H PHE A 59 115.468 -2.287 5.449 1.00 0.00 H new ATOM 0 HA PHE A 59 116.184 -0.204 7.233 1.00 0.00 H new ATOM 0 HB2 PHE A 59 117.911 -0.497 5.795 1.00 0.00 H new ATOM 0 HB3 PHE A 59 116.879 -1.156 4.541 1.00 0.00 H new ATOM 0 HD1 PHE A 59 118.087 2.014 6.077 1.00 0.00 H new ATOM 0 HD2 PHE A 59 116.046 0.217 2.755 1.00 0.00 H new ATOM 0 HE1 PHE A 59 118.220 4.155 4.836 1.00 0.00 H new ATOM 0 HE2 PHE A 59 116.180 2.357 1.512 1.00 0.00 H new ATOM 0 HZ PHE A 59 117.262 4.328 2.555 1.00 0.00 H new ATOM 926 N LEU A 60 113.999 0.596 4.908 1.00 0.00 N ATOM 927 CA LEU A 60 113.003 1.636 4.543 1.00 0.00 C ATOM 928 C LEU A 60 112.228 2.007 5.802 1.00 0.00 C ATOM 929 O LEU A 60 112.049 3.165 6.117 1.00 0.00 O ATOM 930 CB LEU A 60 112.045 1.061 3.495 1.00 0.00 C ATOM 931 CG LEU A 60 112.092 1.867 2.189 1.00 0.00 C ATOM 932 CD1 LEU A 60 113.535 2.267 1.846 1.00 0.00 C ATOM 933 CD2 LEU A 60 111.541 0.988 1.067 1.00 0.00 C ATOM 0 H LEU A 60 113.966 -0.252 4.343 1.00 0.00 H new ATOM 0 HA LEU A 60 113.494 2.518 4.132 1.00 0.00 H new ATOM 0 HB2 LEU A 60 112.306 0.022 3.293 1.00 0.00 H new ATOM 0 HB3 LEU A 60 111.029 1.063 3.889 1.00 0.00 H new ATOM 0 HG LEU A 60 111.500 2.775 2.305 1.00 0.00 H new ATOM 0 HD11 LEU A 60 113.543 2.837 0.917 1.00 0.00 H new ATOM 0 HD12 LEU A 60 113.944 2.878 2.650 1.00 0.00 H new ATOM 0 HD13 LEU A 60 114.143 1.370 1.727 1.00 0.00 H new ATOM 0 HD21 LEU A 60 111.564 1.540 0.127 1.00 0.00 H new ATOM 0 HD22 LEU A 60 112.152 0.090 0.975 1.00 0.00 H new ATOM 0 HD23 LEU A 60 110.513 0.706 1.297 1.00 0.00 H new ATOM 945 N ARG A 61 111.781 1.028 6.539 1.00 0.00 N ATOM 946 CA ARG A 61 111.034 1.329 7.786 1.00 0.00 C ATOM 947 C ARG A 61 111.831 2.357 8.581 1.00 0.00 C ATOM 948 O ARG A 61 111.280 3.235 9.215 1.00 0.00 O ATOM 949 CB ARG A 61 110.877 0.048 8.609 1.00 0.00 C ATOM 950 CG ARG A 61 110.353 -1.074 7.710 1.00 0.00 C ATOM 951 CD ARG A 61 110.318 -2.385 8.497 1.00 0.00 C ATOM 952 NE ARG A 61 109.240 -2.321 9.523 1.00 0.00 N ATOM 953 CZ ARG A 61 108.904 -3.394 10.184 1.00 0.00 C ATOM 954 NH1 ARG A 61 109.513 -4.524 9.947 1.00 0.00 N ATOM 955 NH2 ARG A 61 107.960 -3.338 11.083 1.00 0.00 N ATOM 0 H ARG A 61 111.902 0.037 6.330 1.00 0.00 H new ATOM 0 HA ARG A 61 110.044 1.721 7.551 1.00 0.00 H new ATOM 0 HB2 ARG A 61 111.835 -0.237 9.044 1.00 0.00 H new ATOM 0 HB3 ARG A 61 110.188 0.217 9.437 1.00 0.00 H new ATOM 0 HG2 ARG A 61 109.355 -0.828 7.348 1.00 0.00 H new ATOM 0 HG3 ARG A 61 110.992 -1.181 6.834 1.00 0.00 H new ATOM 0 HD2 ARG A 61 110.142 -3.222 7.822 1.00 0.00 H new ATOM 0 HD3 ARG A 61 111.281 -2.559 8.977 1.00 0.00 H new ATOM 0 HE ARG A 61 108.765 -1.438 9.709 1.00 0.00 H new ATOM 0 HH11 ARG A 61 110.252 -4.568 9.245 1.00 0.00 H new ATOM 0 HH12 ARG A 61 109.250 -5.363 10.464 1.00 0.00 H new ATOM 0 HH21 ARG A 61 107.485 -2.455 11.269 1.00 0.00 H new ATOM 0 HH22 ARG A 61 107.697 -4.177 11.600 1.00 0.00 H new ATOM 969 N SER A 62 113.132 2.260 8.541 1.00 0.00 N ATOM 970 CA SER A 62 113.974 3.240 9.285 1.00 0.00 C ATOM 971 C SER A 62 114.769 4.111 8.298 1.00 0.00 C ATOM 972 O SER A 62 115.616 4.883 8.695 1.00 0.00 O ATOM 973 CB SER A 62 114.937 2.488 10.204 1.00 0.00 C ATOM 974 OG SER A 62 114.195 1.837 11.227 1.00 0.00 O ATOM 0 H SER A 62 113.648 1.546 8.026 1.00 0.00 H new ATOM 0 HA SER A 62 113.330 3.885 9.882 1.00 0.00 H new ATOM 0 HB2 SER A 62 115.509 1.757 9.632 1.00 0.00 H new ATOM 0 HB3 SER A 62 115.655 3.181 10.644 1.00 0.00 H new ATOM 0 HG SER A 62 114.808 1.352 11.818 1.00 0.00 H new ATOM 980 N SER A 63 114.515 3.987 7.018 1.00 0.00 N ATOM 981 CA SER A 63 115.270 4.803 6.016 1.00 0.00 C ATOM 982 C SER A 63 115.369 6.255 6.479 1.00 0.00 C ATOM 983 O SER A 63 114.864 6.624 7.518 1.00 0.00 O ATOM 984 CB SER A 63 114.559 4.764 4.664 1.00 0.00 C ATOM 985 OG SER A 63 113.167 4.574 4.866 1.00 0.00 O ATOM 0 H SER A 63 113.817 3.356 6.624 1.00 0.00 H new ATOM 0 HA SER A 63 116.271 4.383 5.919 1.00 0.00 H new ATOM 0 HB2 SER A 63 114.735 5.693 4.122 1.00 0.00 H new ATOM 0 HB3 SER A 63 114.962 3.957 4.052 1.00 0.00 H new ATOM 0 HG SER A 63 113.012 4.222 5.767 1.00 0.00 H new ATOM 991 N GLU A 64 116.015 7.085 5.704 1.00 0.00 N ATOM 992 CA GLU A 64 116.145 8.516 6.088 1.00 0.00 C ATOM 993 C GLU A 64 114.757 9.155 6.109 1.00 0.00 C ATOM 994 O GLU A 64 114.556 10.205 6.685 1.00 0.00 O ATOM 995 CB GLU A 64 117.028 9.243 5.070 1.00 0.00 C ATOM 996 CG GLU A 64 117.270 10.684 5.533 1.00 0.00 C ATOM 997 CD GLU A 64 118.760 10.892 5.815 1.00 0.00 C ATOM 998 OE1 GLU A 64 119.556 10.579 4.945 1.00 0.00 O ATOM 999 OE2 GLU A 64 119.079 11.359 6.895 1.00 0.00 O ATOM 0 H GLU A 64 116.458 6.831 4.821 1.00 0.00 H new ATOM 0 HA GLU A 64 116.600 8.591 7.076 1.00 0.00 H new ATOM 0 HB2 GLU A 64 117.979 8.721 4.961 1.00 0.00 H new ATOM 0 HB3 GLU A 64 116.549 9.241 4.091 1.00 0.00 H new ATOM 0 HG2 GLU A 64 116.934 11.383 4.768 1.00 0.00 H new ATOM 0 HG3 GLU A 64 116.688 10.890 6.431 1.00 0.00 H new ATOM 1006 N GLU A 65 113.797 8.526 5.486 1.00 0.00 N ATOM 1007 CA GLU A 65 112.420 9.094 5.473 1.00 0.00 C ATOM 1008 C GLU A 65 112.075 9.604 6.872 1.00 0.00 C ATOM 1009 O GLU A 65 111.127 10.340 7.059 1.00 0.00 O ATOM 1010 CB GLU A 65 111.421 8.007 5.063 1.00 0.00 C ATOM 1011 CG GLU A 65 111.388 7.867 3.535 1.00 0.00 C ATOM 1012 CD GLU A 65 111.934 6.496 3.129 1.00 0.00 C ATOM 1013 OE1 GLU A 65 111.178 5.540 3.182 1.00 0.00 O ATOM 1014 OE2 GLU A 65 113.098 6.426 2.771 1.00 0.00 O ATOM 0 H GLU A 65 113.908 7.644 4.986 1.00 0.00 H new ATOM 0 HA GLU A 65 112.369 9.917 4.760 1.00 0.00 H new ATOM 0 HB2 GLU A 65 111.700 7.056 5.517 1.00 0.00 H new ATOM 0 HB3 GLU A 65 110.427 8.257 5.434 1.00 0.00 H new ATOM 0 HG2 GLU A 65 110.367 7.984 3.172 1.00 0.00 H new ATOM 0 HG3 GLU A 65 111.983 8.656 3.075 1.00 0.00 H new ATOM 1021 N LEU A 66 112.842 9.224 7.858 1.00 0.00 N ATOM 1022 CA LEU A 66 112.557 9.699 9.244 1.00 0.00 C ATOM 1023 C LEU A 66 112.355 11.212 9.209 1.00 0.00 C ATOM 1024 O LEU A 66 111.604 11.773 9.982 1.00 0.00 O ATOM 1025 CB LEU A 66 113.741 9.376 10.165 1.00 0.00 C ATOM 1026 CG LEU A 66 114.176 7.919 9.975 1.00 0.00 C ATOM 1027 CD1 LEU A 66 115.702 7.851 9.851 1.00 0.00 C ATOM 1028 CD2 LEU A 66 113.733 7.090 11.183 1.00 0.00 C ATOM 0 H LEU A 66 113.650 8.608 7.766 1.00 0.00 H new ATOM 0 HA LEU A 66 111.664 9.202 9.622 1.00 0.00 H new ATOM 0 HB2 LEU A 66 114.574 10.044 9.946 1.00 0.00 H new ATOM 0 HB3 LEU A 66 113.460 9.547 11.204 1.00 0.00 H new ATOM 0 HG LEU A 66 113.717 7.522 9.070 1.00 0.00 H new ATOM 0 HD11 LEU A 66 116.010 6.814 9.716 1.00 0.00 H new ATOM 0 HD12 LEU A 66 116.024 8.440 8.992 1.00 0.00 H new ATOM 0 HD13 LEU A 66 116.159 8.250 10.757 1.00 0.00 H new ATOM 0 HD21 LEU A 66 114.043 6.054 11.047 1.00 0.00 H new ATOM 0 HD22 LEU A 66 114.192 7.490 12.087 1.00 0.00 H new ATOM 0 HD23 LEU A 66 112.648 7.135 11.277 1.00 0.00 H new ATOM 1040 N LYS A 67 113.029 11.873 8.310 1.00 0.00 N ATOM 1041 CA LYS A 67 112.898 13.352 8.202 1.00 0.00 C ATOM 1042 C LYS A 67 111.521 13.710 7.642 1.00 0.00 C ATOM 1043 O LYS A 67 110.832 14.548 8.183 1.00 0.00 O ATOM 1044 CB LYS A 67 113.981 13.888 7.266 1.00 0.00 C ATOM 1045 CG LYS A 67 114.186 12.902 6.110 1.00 0.00 C ATOM 1046 CD LYS A 67 113.955 13.608 4.777 1.00 0.00 C ATOM 1047 CE LYS A 67 113.749 12.555 3.689 1.00 0.00 C ATOM 1048 NZ LYS A 67 114.975 11.717 3.568 1.00 0.00 N ATOM 0 H LYS A 67 113.670 11.448 7.640 1.00 0.00 H new ATOM 0 HA LYS A 67 113.011 13.798 9.190 1.00 0.00 H new ATOM 0 HB2 LYS A 67 113.692 14.865 6.879 1.00 0.00 H new ATOM 0 HB3 LYS A 67 114.914 14.025 7.812 1.00 0.00 H new ATOM 0 HG2 LYS A 67 115.196 12.493 6.144 1.00 0.00 H new ATOM 0 HG3 LYS A 67 113.498 12.062 6.211 1.00 0.00 H new ATOM 0 HD2 LYS A 67 113.083 14.259 4.841 1.00 0.00 H new ATOM 0 HD3 LYS A 67 114.808 14.241 4.533 1.00 0.00 H new ATOM 0 HE2 LYS A 67 112.891 11.929 3.932 1.00 0.00 H new ATOM 0 HE3 LYS A 67 113.531 13.039 2.737 1.00 0.00 H new ATOM 0 HZ1 LYS A 67 115.043 11.339 2.601 1.00 0.00 H new ATOM 0 HZ2 LYS A 67 115.814 12.297 3.773 1.00 0.00 H new ATOM 0 HZ3 LYS A 67 114.925 10.929 4.245 1.00 0.00 H new ATOM 1062 N VAL A 68 111.119 13.088 6.557 1.00 0.00 N ATOM 1063 CA VAL A 68 109.787 13.397 5.960 1.00 0.00 C ATOM 1064 C VAL A 68 109.933 14.583 5.004 1.00 0.00 C ATOM 1065 O VAL A 68 109.153 15.510 5.048 1.00 0.00 O ATOM 1066 CB VAL A 68 108.797 13.758 7.083 1.00 0.00 C ATOM 1067 CG1 VAL A 68 107.360 13.699 6.563 1.00 0.00 C ATOM 1068 CG2 VAL A 68 108.954 12.773 8.249 1.00 0.00 C ATOM 0 H VAL A 68 111.660 12.379 6.062 1.00 0.00 H new ATOM 0 HA VAL A 68 109.414 12.530 5.415 1.00 0.00 H new ATOM 0 HB VAL A 68 109.012 14.770 7.425 1.00 0.00 H new ATOM 0 HG11 VAL A 68 106.671 13.956 7.368 1.00 0.00 H new ATOM 0 HG12 VAL A 68 107.241 14.407 5.743 1.00 0.00 H new ATOM 0 HG13 VAL A 68 107.143 12.692 6.208 1.00 0.00 H new ATOM 0 HG21 VAL A 68 108.252 13.032 9.041 1.00 0.00 H new ATOM 0 HG22 VAL A 68 108.750 11.761 7.900 1.00 0.00 H new ATOM 0 HG23 VAL A 68 109.972 12.825 8.635 1.00 0.00 H new ATOM 1078 N PHE A 69 110.923 14.566 4.138 1.00 0.00 N ATOM 1079 CA PHE A 69 111.096 15.722 3.199 1.00 0.00 C ATOM 1080 C PHE A 69 112.201 15.472 2.158 1.00 0.00 C ATOM 1081 O PHE A 69 111.950 15.484 0.970 1.00 0.00 O ATOM 1082 CB PHE A 69 111.475 16.975 3.997 1.00 0.00 C ATOM 1083 CG PHE A 69 110.285 17.483 4.773 1.00 0.00 C ATOM 1084 CD1 PHE A 69 109.235 18.128 4.108 1.00 0.00 C ATOM 1085 CD2 PHE A 69 110.233 17.309 6.161 1.00 0.00 C ATOM 1086 CE1 PHE A 69 108.133 18.598 4.832 1.00 0.00 C ATOM 1087 CE2 PHE A 69 109.131 17.779 6.885 1.00 0.00 C ATOM 1088 CZ PHE A 69 108.081 18.424 6.221 1.00 0.00 C ATOM 0 H PHE A 69 111.607 13.815 4.042 1.00 0.00 H new ATOM 0 HA PHE A 69 110.149 15.851 2.675 1.00 0.00 H new ATOM 0 HB2 PHE A 69 112.292 16.745 4.681 1.00 0.00 H new ATOM 0 HB3 PHE A 69 111.834 17.750 3.320 1.00 0.00 H new ATOM 0 HD1 PHE A 69 109.275 18.263 3.037 1.00 0.00 H new ATOM 0 HD2 PHE A 69 111.043 16.812 6.673 1.00 0.00 H new ATOM 0 HE1 PHE A 69 107.323 19.095 4.320 1.00 0.00 H new ATOM 0 HE2 PHE A 69 109.091 17.644 7.956 1.00 0.00 H new ATOM 0 HZ PHE A 69 107.231 18.787 6.779 1.00 0.00 H new ATOM 1098 N ASP A 70 113.429 15.301 2.582 1.00 0.00 N ATOM 1099 CA ASP A 70 114.535 15.118 1.591 1.00 0.00 C ATOM 1100 C ASP A 70 114.142 14.094 0.526 1.00 0.00 C ATOM 1101 O ASP A 70 114.423 12.912 0.634 1.00 0.00 O ATOM 1102 CB ASP A 70 115.813 14.658 2.297 1.00 0.00 C ATOM 1103 CG ASP A 70 116.988 14.735 1.321 1.00 0.00 C ATOM 1104 OD1 ASP A 70 116.835 14.274 0.202 1.00 0.00 O ATOM 1105 OD2 ASP A 70 118.022 15.254 1.709 1.00 0.00 O ATOM 0 H ASP A 70 113.712 15.280 3.562 1.00 0.00 H new ATOM 0 HA ASP A 70 114.718 16.078 1.108 1.00 0.00 H new ATOM 0 HB2 ASP A 70 116.007 15.285 3.167 1.00 0.00 H new ATOM 0 HB3 ASP A 70 115.694 13.637 2.660 1.00 0.00 H new ATOM 1110 N THR A 71 113.509 14.555 -0.516 1.00 0.00 N ATOM 1111 CA THR A 71 113.104 13.642 -1.616 1.00 0.00 C ATOM 1112 C THR A 71 114.358 13.123 -2.316 1.00 0.00 C ATOM 1113 O THR A 71 114.408 12.000 -2.778 1.00 0.00 O ATOM 1114 CB THR A 71 112.246 14.410 -2.626 1.00 0.00 C ATOM 1115 OG1 THR A 71 112.967 14.556 -3.841 1.00 0.00 O ATOM 1116 CG2 THR A 71 111.903 15.794 -2.070 1.00 0.00 C ATOM 0 H THR A 71 113.254 15.533 -0.652 1.00 0.00 H new ATOM 0 HA THR A 71 112.531 12.808 -1.210 1.00 0.00 H new ATOM 0 HB THR A 71 111.324 13.858 -2.809 1.00 0.00 H new ATOM 0 HG1 THR A 71 113.220 15.495 -3.960 1.00 0.00 H new ATOM 0 HG21 THR A 71 111.293 16.335 -2.793 1.00 0.00 H new ATOM 0 HG22 THR A 71 111.349 15.685 -1.137 1.00 0.00 H new ATOM 0 HG23 THR A 71 112.822 16.349 -1.883 1.00 0.00 H new ATOM 1124 N ALA A 72 115.375 13.937 -2.395 1.00 0.00 N ATOM 1125 CA ALA A 72 116.631 13.499 -3.063 1.00 0.00 C ATOM 1126 C ALA A 72 117.191 12.281 -2.329 1.00 0.00 C ATOM 1127 O ALA A 72 117.826 11.431 -2.917 1.00 0.00 O ATOM 1128 CB ALA A 72 117.655 14.635 -3.022 1.00 0.00 C ATOM 0 H ALA A 72 115.389 14.887 -2.025 1.00 0.00 H new ATOM 0 HA ALA A 72 116.423 13.239 -4.101 1.00 0.00 H new ATOM 0 HB1 ALA A 72 118.575 14.314 -3.511 1.00 0.00 H new ATOM 0 HB2 ALA A 72 117.253 15.506 -3.540 1.00 0.00 H new ATOM 0 HB3 ALA A 72 117.868 14.896 -1.985 1.00 0.00 H new ATOM 1134 N GLU A 73 116.957 12.192 -1.048 1.00 0.00 N ATOM 1135 CA GLU A 73 117.472 11.029 -0.272 1.00 0.00 C ATOM 1136 C GLU A 73 116.631 9.791 -0.589 1.00 0.00 C ATOM 1137 O GLU A 73 117.136 8.686 -0.679 1.00 0.00 O ATOM 1138 CB GLU A 73 117.378 11.336 1.225 1.00 0.00 C ATOM 1139 CG GLU A 73 118.627 12.099 1.671 1.00 0.00 C ATOM 1140 CD GLU A 73 119.809 11.133 1.765 1.00 0.00 C ATOM 1141 OE1 GLU A 73 119.621 10.046 2.286 1.00 0.00 O ATOM 1142 OE2 GLU A 73 120.883 11.497 1.314 1.00 0.00 O ATOM 0 H GLU A 73 116.430 12.876 -0.505 1.00 0.00 H new ATOM 0 HA GLU A 73 118.511 10.842 -0.543 1.00 0.00 H new ATOM 0 HB2 GLU A 73 116.486 11.927 1.430 1.00 0.00 H new ATOM 0 HB3 GLU A 73 117.284 10.410 1.791 1.00 0.00 H new ATOM 0 HG2 GLU A 73 118.851 12.897 0.963 1.00 0.00 H new ATOM 0 HG3 GLU A 73 118.452 12.571 2.638 1.00 0.00 H new ATOM 1149 N VAL A 74 115.348 9.965 -0.760 1.00 0.00 N ATOM 1150 CA VAL A 74 114.471 8.800 -1.068 1.00 0.00 C ATOM 1151 C VAL A 74 114.868 8.209 -2.424 1.00 0.00 C ATOM 1152 O VAL A 74 115.335 7.084 -2.518 1.00 0.00 O ATOM 1153 CB VAL A 74 113.018 9.274 -1.107 1.00 0.00 C ATOM 1154 CG1 VAL A 74 112.080 8.065 -1.138 1.00 0.00 C ATOM 1155 CG2 VAL A 74 112.725 10.114 0.141 1.00 0.00 C ATOM 0 H VAL A 74 114.870 10.864 -0.700 1.00 0.00 H new ATOM 0 HA VAL A 74 114.583 8.032 -0.302 1.00 0.00 H new ATOM 0 HB VAL A 74 112.858 9.876 -2.001 1.00 0.00 H new ATOM 0 HG11 VAL A 74 111.046 8.408 -1.166 1.00 0.00 H new ATOM 0 HG12 VAL A 74 112.288 7.466 -2.025 1.00 0.00 H new ATOM 0 HG13 VAL A 74 112.238 7.459 -0.246 1.00 0.00 H new ATOM 0 HG21 VAL A 74 111.690 10.454 0.116 1.00 0.00 H new ATOM 0 HG22 VAL A 74 112.887 9.509 1.033 1.00 0.00 H new ATOM 0 HG23 VAL A 74 113.390 10.978 0.163 1.00 0.00 H new ATOM 1165 N ILE A 75 114.708 8.958 -3.479 1.00 0.00 N ATOM 1166 CA ILE A 75 115.103 8.432 -4.811 1.00 0.00 C ATOM 1167 C ILE A 75 116.536 7.928 -4.707 1.00 0.00 C ATOM 1168 O ILE A 75 116.966 7.088 -5.461 1.00 0.00 O ATOM 1169 CB ILE A 75 115.033 9.543 -5.863 1.00 0.00 C ATOM 1170 CG1 ILE A 75 115.691 10.816 -5.311 1.00 0.00 C ATOM 1171 CG2 ILE A 75 113.571 9.828 -6.221 1.00 0.00 C ATOM 1172 CD1 ILE A 75 116.902 11.182 -6.172 1.00 0.00 C ATOM 0 H ILE A 75 114.324 9.903 -3.476 1.00 0.00 H new ATOM 0 HA ILE A 75 114.428 7.630 -5.109 1.00 0.00 H new ATOM 0 HB ILE A 75 115.563 9.223 -6.760 1.00 0.00 H new ATOM 0 HG12 ILE A 75 114.973 11.636 -5.307 1.00 0.00 H new ATOM 0 HG13 ILE A 75 116.001 10.659 -4.278 1.00 0.00 H new ATOM 0 HG21 ILE A 75 113.527 10.619 -6.970 1.00 0.00 H new ATOM 0 HG22 ILE A 75 113.111 8.924 -6.621 1.00 0.00 H new ATOM 0 HG23 ILE A 75 113.033 10.144 -5.327 1.00 0.00 H new ATOM 0 HD11 ILE A 75 117.368 12.086 -5.779 1.00 0.00 H new ATOM 0 HD12 ILE A 75 117.623 10.364 -6.153 1.00 0.00 H new ATOM 0 HD13 ILE A 75 116.579 11.357 -7.198 1.00 0.00 H new ATOM 1184 N GLU A 76 117.278 8.441 -3.770 1.00 0.00 N ATOM 1185 CA GLU A 76 118.687 7.996 -3.610 1.00 0.00 C ATOM 1186 C GLU A 76 118.718 6.491 -3.360 1.00 0.00 C ATOM 1187 O GLU A 76 119.521 5.780 -3.929 1.00 0.00 O ATOM 1188 CB GLU A 76 119.328 8.721 -2.425 1.00 0.00 C ATOM 1189 CG GLU A 76 120.797 9.013 -2.736 1.00 0.00 C ATOM 1190 CD GLU A 76 121.395 9.871 -1.619 1.00 0.00 C ATOM 1191 OE1 GLU A 76 120.738 10.813 -1.207 1.00 0.00 O ATOM 1192 OE2 GLU A 76 122.499 9.572 -1.195 1.00 0.00 O ATOM 0 H GLU A 76 116.969 9.151 -3.106 1.00 0.00 H new ATOM 0 HA GLU A 76 119.243 8.229 -4.518 1.00 0.00 H new ATOM 0 HB2 GLU A 76 118.796 9.651 -2.224 1.00 0.00 H new ATOM 0 HB3 GLU A 76 119.251 8.109 -1.526 1.00 0.00 H new ATOM 0 HG2 GLU A 76 121.352 8.080 -2.829 1.00 0.00 H new ATOM 0 HG3 GLU A 76 120.881 9.531 -3.691 1.00 0.00 H new ATOM 1199 N PHE A 77 117.858 5.990 -2.511 1.00 0.00 N ATOM 1200 CA PHE A 77 117.878 4.529 -2.251 1.00 0.00 C ATOM 1201 C PHE A 77 117.320 3.784 -3.465 1.00 0.00 C ATOM 1202 O PHE A 77 118.005 2.975 -4.056 1.00 0.00 O ATOM 1203 CB PHE A 77 117.055 4.213 -1.000 1.00 0.00 C ATOM 1204 CG PHE A 77 115.765 3.528 -1.379 1.00 0.00 C ATOM 1205 CD1 PHE A 77 115.729 2.137 -1.531 1.00 0.00 C ATOM 1206 CD2 PHE A 77 114.606 4.285 -1.571 1.00 0.00 C ATOM 1207 CE1 PHE A 77 114.530 1.505 -1.875 1.00 0.00 C ATOM 1208 CE2 PHE A 77 113.409 3.655 -1.917 1.00 0.00 C ATOM 1209 CZ PHE A 77 113.370 2.265 -2.068 1.00 0.00 C ATOM 0 H PHE A 77 117.156 6.522 -1.997 1.00 0.00 H new ATOM 0 HA PHE A 77 118.904 4.203 -2.081 1.00 0.00 H new ATOM 0 HB2 PHE A 77 117.630 3.574 -0.330 1.00 0.00 H new ATOM 0 HB3 PHE A 77 116.840 5.133 -0.456 1.00 0.00 H new ATOM 0 HD1 PHE A 77 116.625 1.553 -1.383 1.00 0.00 H new ATOM 0 HD2 PHE A 77 114.636 5.358 -1.452 1.00 0.00 H new ATOM 0 HE1 PHE A 77 114.499 0.432 -1.992 1.00 0.00 H new ATOM 0 HE2 PHE A 77 112.514 4.240 -2.068 1.00 0.00 H new ATOM 0 HZ PHE A 77 112.444 1.777 -2.334 1.00 0.00 H new ATOM 1219 N PHE A 78 116.095 4.037 -3.866 1.00 0.00 N ATOM 1220 CA PHE A 78 115.577 3.301 -5.053 1.00 0.00 C ATOM 1221 C PHE A 78 116.491 3.565 -6.251 1.00 0.00 C ATOM 1222 O PHE A 78 116.889 2.655 -6.948 1.00 0.00 O ATOM 1223 CB PHE A 78 114.155 3.753 -5.388 1.00 0.00 C ATOM 1224 CG PHE A 78 113.576 2.853 -6.466 1.00 0.00 C ATOM 1225 CD1 PHE A 78 113.809 1.465 -6.445 1.00 0.00 C ATOM 1226 CD2 PHE A 78 112.806 3.408 -7.494 1.00 0.00 C ATOM 1227 CE1 PHE A 78 113.272 0.648 -7.447 1.00 0.00 C ATOM 1228 CE2 PHE A 78 112.269 2.588 -8.494 1.00 0.00 C ATOM 1229 CZ PHE A 78 112.503 1.209 -8.471 1.00 0.00 C ATOM 0 H PHE A 78 115.452 4.701 -3.435 1.00 0.00 H new ATOM 0 HA PHE A 78 115.560 2.235 -4.826 1.00 0.00 H new ATOM 0 HB2 PHE A 78 113.531 3.716 -4.495 1.00 0.00 H new ATOM 0 HB3 PHE A 78 114.162 4.788 -5.729 1.00 0.00 H new ATOM 0 HD1 PHE A 78 114.403 1.030 -5.655 1.00 0.00 H new ATOM 0 HD2 PHE A 78 112.625 4.473 -7.516 1.00 0.00 H new ATOM 0 HE1 PHE A 78 113.452 -0.417 -7.429 1.00 0.00 H new ATOM 0 HE2 PHE A 78 111.673 3.021 -9.284 1.00 0.00 H new ATOM 0 HZ PHE A 78 112.090 0.578 -9.244 1.00 0.00 H new ATOM 1239 N ASN A 79 116.831 4.802 -6.493 1.00 0.00 N ATOM 1240 CA ASN A 79 117.723 5.116 -7.648 1.00 0.00 C ATOM 1241 C ASN A 79 118.960 4.229 -7.582 1.00 0.00 C ATOM 1242 O ASN A 79 119.282 3.522 -8.516 1.00 0.00 O ATOM 1243 CB ASN A 79 118.166 6.580 -7.582 1.00 0.00 C ATOM 1244 CG ASN A 79 119.101 6.882 -8.753 1.00 0.00 C ATOM 1245 OD1 ASN A 79 119.458 5.996 -9.505 1.00 0.00 O ATOM 1246 ND2 ASN A 79 119.517 8.105 -8.942 1.00 0.00 N ATOM 0 H ASN A 79 116.531 5.607 -5.943 1.00 0.00 H new ATOM 0 HA ASN A 79 117.179 4.939 -8.576 1.00 0.00 H new ATOM 0 HB2 ASN A 79 117.296 7.236 -7.618 1.00 0.00 H new ATOM 0 HB3 ASN A 79 118.674 6.775 -6.637 1.00 0.00 H new ATOM 0 HD21 ASN A 79 120.141 8.317 -9.720 1.00 0.00 H new ATOM 0 HD22 ASN A 79 119.218 8.849 -8.311 1.00 0.00 H new ATOM 1253 N LYS A 80 119.654 4.257 -6.482 1.00 0.00 N ATOM 1254 CA LYS A 80 120.867 3.412 -6.355 1.00 0.00 C ATOM 1255 C LYS A 80 120.471 1.947 -6.519 1.00 0.00 C ATOM 1256 O LYS A 80 121.236 1.137 -7.001 1.00 0.00 O ATOM 1257 CB LYS A 80 121.494 3.624 -4.976 1.00 0.00 C ATOM 1258 CG LYS A 80 122.375 4.877 -5.002 1.00 0.00 C ATOM 1259 CD LYS A 80 123.760 4.526 -5.556 1.00 0.00 C ATOM 1260 CE LYS A 80 124.419 3.475 -4.662 1.00 0.00 C ATOM 1261 NZ LYS A 80 125.872 3.778 -4.526 1.00 0.00 N ATOM 0 H LYS A 80 119.433 4.828 -5.666 1.00 0.00 H new ATOM 0 HA LYS A 80 121.590 3.685 -7.123 1.00 0.00 H new ATOM 0 HB2 LYS A 80 120.714 3.731 -4.223 1.00 0.00 H new ATOM 0 HB3 LYS A 80 122.089 2.754 -4.698 1.00 0.00 H new ATOM 0 HG2 LYS A 80 121.911 5.646 -5.619 1.00 0.00 H new ATOM 0 HG3 LYS A 80 122.469 5.288 -3.997 1.00 0.00 H new ATOM 0 HD2 LYS A 80 123.670 4.147 -6.574 1.00 0.00 H new ATOM 0 HD3 LYS A 80 124.382 5.420 -5.602 1.00 0.00 H new ATOM 0 HE2 LYS A 80 123.945 3.468 -3.681 1.00 0.00 H new ATOM 0 HE3 LYS A 80 124.282 2.482 -5.089 1.00 0.00 H new ATOM 0 HZ1 LYS A 80 126.320 3.063 -3.918 1.00 0.00 H new ATOM 0 HZ2 LYS A 80 126.319 3.763 -5.465 1.00 0.00 H new ATOM 0 HZ3 LYS A 80 125.992 4.719 -4.100 1.00 0.00 H new ATOM 1275 N LEU A 81 119.278 1.598 -6.118 1.00 0.00 N ATOM 1276 CA LEU A 81 118.843 0.181 -6.252 1.00 0.00 C ATOM 1277 C LEU A 81 118.656 -0.170 -7.736 1.00 0.00 C ATOM 1278 O LEU A 81 119.216 -1.123 -8.228 1.00 0.00 O ATOM 1279 CB LEU A 81 117.509 -0.030 -5.515 1.00 0.00 C ATOM 1280 CG LEU A 81 117.662 0.141 -3.987 1.00 0.00 C ATOM 1281 CD1 LEU A 81 116.957 -1.017 -3.277 1.00 0.00 C ATOM 1282 CD2 LEU A 81 119.139 0.159 -3.564 1.00 0.00 C ATOM 0 H LEU A 81 118.591 2.229 -5.706 1.00 0.00 H new ATOM 0 HA LEU A 81 119.607 -0.463 -5.816 1.00 0.00 H new ATOM 0 HB2 LEU A 81 116.772 0.681 -5.888 1.00 0.00 H new ATOM 0 HB3 LEU A 81 117.128 -1.028 -5.732 1.00 0.00 H new ATOM 0 HG LEU A 81 117.214 1.095 -3.709 1.00 0.00 H new ATOM 0 HD11 LEU A 81 117.062 -0.901 -2.198 1.00 0.00 H new ATOM 0 HD12 LEU A 81 115.899 -1.016 -3.541 1.00 0.00 H new ATOM 0 HD13 LEU A 81 117.407 -1.961 -3.586 1.00 0.00 H new ATOM 0 HD21 LEU A 81 119.206 0.281 -2.483 1.00 0.00 H new ATOM 0 HD22 LEU A 81 119.612 -0.779 -3.854 1.00 0.00 H new ATOM 0 HD23 LEU A 81 119.648 0.988 -4.055 1.00 0.00 H new ATOM 1294 N VAL A 82 117.863 0.577 -8.453 1.00 0.00 N ATOM 1295 CA VAL A 82 117.635 0.249 -9.891 1.00 0.00 C ATOM 1296 C VAL A 82 118.930 0.356 -10.708 1.00 0.00 C ATOM 1297 O VAL A 82 119.215 -0.483 -11.531 1.00 0.00 O ATOM 1298 CB VAL A 82 116.594 1.208 -10.457 1.00 0.00 C ATOM 1299 CG1 VAL A 82 115.240 0.922 -9.798 1.00 0.00 C ATOM 1300 CG2 VAL A 82 117.019 2.648 -10.158 1.00 0.00 C ATOM 0 H VAL A 82 117.364 1.397 -8.109 1.00 0.00 H new ATOM 0 HA VAL A 82 117.284 -0.781 -9.958 1.00 0.00 H new ATOM 0 HB VAL A 82 116.511 1.073 -11.535 1.00 0.00 H new ATOM 0 HG11 VAL A 82 114.490 1.604 -10.198 1.00 0.00 H new ATOM 0 HG12 VAL A 82 114.944 -0.106 -10.007 1.00 0.00 H new ATOM 0 HG13 VAL A 82 115.323 1.064 -8.720 1.00 0.00 H new ATOM 0 HG21 VAL A 82 116.277 3.337 -10.561 1.00 0.00 H new ATOM 0 HG22 VAL A 82 117.096 2.788 -9.080 1.00 0.00 H new ATOM 0 HG23 VAL A 82 117.986 2.845 -10.620 1.00 0.00 H new ATOM 1310 N THR A 83 119.703 1.384 -10.524 1.00 0.00 N ATOM 1311 CA THR A 83 120.948 1.514 -11.336 1.00 0.00 C ATOM 1312 C THR A 83 122.070 0.628 -10.775 1.00 0.00 C ATOM 1313 O THR A 83 122.768 -0.040 -11.512 1.00 0.00 O ATOM 1314 CB THR A 83 121.399 2.975 -11.338 1.00 0.00 C ATOM 1315 OG1 THR A 83 122.198 3.220 -12.487 1.00 0.00 O ATOM 1316 CG2 THR A 83 122.214 3.259 -10.080 1.00 0.00 C ATOM 0 H THR A 83 119.533 2.135 -9.855 1.00 0.00 H new ATOM 0 HA THR A 83 120.734 1.187 -12.354 1.00 0.00 H new ATOM 0 HB THR A 83 120.525 3.626 -11.357 1.00 0.00 H new ATOM 0 HG1 THR A 83 122.487 4.157 -12.491 1.00 0.00 H new ATOM 0 HG21 THR A 83 122.535 4.301 -10.082 1.00 0.00 H new ATOM 0 HG22 THR A 83 121.601 3.070 -9.199 1.00 0.00 H new ATOM 0 HG23 THR A 83 123.089 2.610 -10.059 1.00 0.00 H new ATOM 1324 N SER A 84 122.275 0.643 -9.487 1.00 0.00 N ATOM 1325 CA SER A 84 123.380 -0.170 -8.892 1.00 0.00 C ATOM 1326 C SER A 84 123.010 -1.658 -8.801 1.00 0.00 C ATOM 1327 O SER A 84 123.875 -2.507 -8.711 1.00 0.00 O ATOM 1328 CB SER A 84 123.686 0.354 -7.489 1.00 0.00 C ATOM 1329 OG SER A 84 123.390 1.743 -7.432 1.00 0.00 O ATOM 0 H SER A 84 121.726 1.183 -8.818 1.00 0.00 H new ATOM 0 HA SER A 84 124.252 -0.078 -9.540 1.00 0.00 H new ATOM 0 HB2 SER A 84 123.095 -0.186 -6.750 1.00 0.00 H new ATOM 0 HB3 SER A 84 124.735 0.183 -7.245 1.00 0.00 H new ATOM 0 HG SER A 84 122.677 1.899 -6.778 1.00 0.00 H new ATOM 1335 N PHE A 85 121.749 -1.991 -8.788 1.00 0.00 N ATOM 1336 CA PHE A 85 121.371 -3.432 -8.661 1.00 0.00 C ATOM 1337 C PHE A 85 121.741 -4.225 -9.918 1.00 0.00 C ATOM 1338 O PHE A 85 121.404 -5.380 -10.041 1.00 0.00 O ATOM 1339 CB PHE A 85 119.873 -3.572 -8.376 1.00 0.00 C ATOM 1340 CG PHE A 85 119.059 -3.424 -9.645 1.00 0.00 C ATOM 1341 CD1 PHE A 85 119.600 -2.818 -10.789 1.00 0.00 C ATOM 1342 CD2 PHE A 85 117.757 -3.927 -9.678 1.00 0.00 C ATOM 1343 CE1 PHE A 85 118.835 -2.721 -11.958 1.00 0.00 C ATOM 1344 CE2 PHE A 85 116.996 -3.832 -10.848 1.00 0.00 C ATOM 1345 CZ PHE A 85 117.536 -3.231 -11.988 1.00 0.00 C ATOM 0 H PHE A 85 120.969 -1.337 -8.859 1.00 0.00 H new ATOM 0 HA PHE A 85 121.934 -3.845 -7.824 1.00 0.00 H new ATOM 0 HB2 PHE A 85 119.675 -4.544 -7.925 1.00 0.00 H new ATOM 0 HB3 PHE A 85 119.565 -2.817 -7.653 1.00 0.00 H new ATOM 0 HD1 PHE A 85 120.606 -2.426 -10.768 1.00 0.00 H new ATOM 0 HD2 PHE A 85 117.336 -4.391 -8.798 1.00 0.00 H new ATOM 0 HE1 PHE A 85 119.251 -2.251 -12.837 1.00 0.00 H new ATOM 0 HE2 PHE A 85 115.990 -4.224 -10.870 1.00 0.00 H new ATOM 0 HZ PHE A 85 116.949 -3.161 -12.892 1.00 0.00 H new ATOM 1355 N ASP A 86 122.420 -3.637 -10.861 1.00 0.00 N ATOM 1356 CA ASP A 86 122.776 -4.423 -12.073 1.00 0.00 C ATOM 1357 C ASP A 86 124.103 -5.145 -11.832 1.00 0.00 C ATOM 1358 O ASP A 86 124.684 -5.723 -12.730 1.00 0.00 O ATOM 1359 CB ASP A 86 122.884 -3.517 -13.294 1.00 0.00 C ATOM 1360 CG ASP A 86 123.658 -2.248 -12.930 1.00 0.00 C ATOM 1361 OD1 ASP A 86 124.291 -2.243 -11.887 1.00 0.00 O ATOM 1362 OD2 ASP A 86 123.604 -1.304 -13.700 1.00 0.00 O ATOM 0 H ASP A 86 122.738 -2.668 -10.848 1.00 0.00 H new ATOM 0 HA ASP A 86 121.991 -5.154 -12.265 1.00 0.00 H new ATOM 0 HB2 ASP A 86 123.389 -4.042 -14.105 1.00 0.00 H new ATOM 0 HB3 ASP A 86 121.889 -3.256 -13.654 1.00 0.00 H new ATOM 1367 N PHE A 87 124.571 -5.135 -10.614 1.00 0.00 N ATOM 1368 CA PHE A 87 125.842 -5.840 -10.283 1.00 0.00 C ATOM 1369 C PHE A 87 125.605 -6.676 -9.024 1.00 0.00 C ATOM 1370 O PHE A 87 125.385 -7.869 -9.091 1.00 0.00 O ATOM 1371 CB PHE A 87 126.971 -4.817 -10.046 1.00 0.00 C ATOM 1372 CG PHE A 87 127.768 -5.184 -8.808 1.00 0.00 C ATOM 1373 CD1 PHE A 87 128.120 -6.518 -8.562 1.00 0.00 C ATOM 1374 CD2 PHE A 87 128.137 -4.189 -7.889 1.00 0.00 C ATOM 1375 CE1 PHE A 87 128.829 -6.851 -7.409 1.00 0.00 C ATOM 1376 CE2 PHE A 87 128.856 -4.529 -6.738 1.00 0.00 C ATOM 1377 CZ PHE A 87 129.199 -5.863 -6.499 1.00 0.00 C ATOM 0 H PHE A 87 124.123 -4.665 -9.827 1.00 0.00 H new ATOM 0 HA PHE A 87 126.143 -6.485 -11.108 1.00 0.00 H new ATOM 0 HB2 PHE A 87 127.630 -4.786 -10.914 1.00 0.00 H new ATOM 0 HB3 PHE A 87 126.548 -3.819 -9.931 1.00 0.00 H new ATOM 0 HD1 PHE A 87 127.842 -7.288 -9.266 1.00 0.00 H new ATOM 0 HD2 PHE A 87 127.865 -3.160 -8.071 1.00 0.00 H new ATOM 0 HE1 PHE A 87 129.093 -7.881 -7.220 1.00 0.00 H new ATOM 0 HE2 PHE A 87 129.146 -3.762 -6.035 1.00 0.00 H new ATOM 0 HZ PHE A 87 129.751 -6.128 -5.609 1.00 0.00 H new ATOM 1387 N ASP A 88 125.646 -6.059 -7.875 1.00 0.00 N ATOM 1388 CA ASP A 88 125.419 -6.818 -6.615 1.00 0.00 C ATOM 1389 C ASP A 88 123.942 -6.742 -6.246 1.00 0.00 C ATOM 1390 O ASP A 88 123.524 -5.907 -5.469 1.00 0.00 O ATOM 1391 CB ASP A 88 126.245 -6.209 -5.490 1.00 0.00 C ATOM 1392 CG ASP A 88 126.313 -4.693 -5.677 1.00 0.00 C ATOM 1393 OD1 ASP A 88 125.571 -4.183 -6.500 1.00 0.00 O ATOM 1394 OD2 ASP A 88 127.104 -4.067 -4.995 1.00 0.00 O ATOM 0 H ASP A 88 125.827 -5.062 -7.755 1.00 0.00 H new ATOM 0 HA ASP A 88 125.716 -7.857 -6.760 1.00 0.00 H new ATOM 0 HB2 ASP A 88 125.799 -6.448 -4.525 1.00 0.00 H new ATOM 0 HB3 ASP A 88 127.249 -6.632 -5.490 1.00 0.00 H new ATOM 1399 N LEU A 89 123.150 -7.605 -6.803 1.00 0.00 N ATOM 1400 CA LEU A 89 121.700 -7.593 -6.500 1.00 0.00 C ATOM 1401 C LEU A 89 121.499 -7.694 -4.988 1.00 0.00 C ATOM 1402 O LEU A 89 120.822 -6.887 -4.387 1.00 0.00 O ATOM 1403 CB LEU A 89 121.038 -8.784 -7.197 1.00 0.00 C ATOM 1404 CG LEU A 89 121.506 -8.886 -8.666 1.00 0.00 C ATOM 1405 CD1 LEU A 89 122.135 -7.575 -9.144 1.00 0.00 C ATOM 1406 CD2 LEU A 89 122.544 -9.995 -8.817 1.00 0.00 C ATOM 0 H LEU A 89 123.448 -8.325 -7.461 1.00 0.00 H new ATOM 0 HA LEU A 89 121.249 -6.667 -6.858 1.00 0.00 H new ATOM 0 HB2 LEU A 89 121.284 -9.704 -6.667 1.00 0.00 H new ATOM 0 HB3 LEU A 89 119.954 -8.676 -7.162 1.00 0.00 H new ATOM 0 HG LEU A 89 120.625 -9.105 -9.269 1.00 0.00 H new ATOM 0 HD11 LEU A 89 122.453 -7.681 -10.181 1.00 0.00 H new ATOM 0 HD12 LEU A 89 121.402 -6.772 -9.070 1.00 0.00 H new ATOM 0 HD13 LEU A 89 122.998 -7.338 -8.522 1.00 0.00 H new ATOM 0 HD21 LEU A 89 122.864 -10.055 -9.857 1.00 0.00 H new ATOM 0 HD22 LEU A 89 123.404 -9.777 -8.185 1.00 0.00 H new ATOM 0 HD23 LEU A 89 122.106 -10.947 -8.517 1.00 0.00 H new ATOM 1418 N GLU A 90 122.073 -8.686 -4.373 1.00 0.00 N ATOM 1419 CA GLU A 90 121.908 -8.849 -2.899 1.00 0.00 C ATOM 1420 C GLU A 90 122.844 -7.903 -2.129 1.00 0.00 C ATOM 1421 O GLU A 90 122.438 -7.239 -1.195 1.00 0.00 O ATOM 1422 CB GLU A 90 122.238 -10.294 -2.515 1.00 0.00 C ATOM 1423 CG GLU A 90 122.349 -11.140 -3.779 1.00 0.00 C ATOM 1424 CD GLU A 90 123.720 -10.923 -4.423 1.00 0.00 C ATOM 1425 OE1 GLU A 90 124.707 -11.284 -3.803 1.00 0.00 O ATOM 1426 OE2 GLU A 90 123.759 -10.400 -5.524 1.00 0.00 O ATOM 0 H GLU A 90 122.651 -9.394 -4.825 1.00 0.00 H new ATOM 0 HA GLU A 90 120.878 -8.607 -2.639 1.00 0.00 H new ATOM 0 HB2 GLU A 90 123.174 -10.329 -1.957 1.00 0.00 H new ATOM 0 HB3 GLU A 90 121.462 -10.695 -1.862 1.00 0.00 H new ATOM 0 HG2 GLU A 90 122.213 -12.194 -3.537 1.00 0.00 H new ATOM 0 HG3 GLU A 90 121.560 -10.870 -4.480 1.00 0.00 H new ATOM 1433 N ILE A 91 124.100 -7.873 -2.483 1.00 0.00 N ATOM 1434 CA ILE A 91 125.071 -7.013 -1.738 1.00 0.00 C ATOM 1435 C ILE A 91 124.945 -5.537 -2.132 1.00 0.00 C ATOM 1436 O ILE A 91 125.263 -4.655 -1.357 1.00 0.00 O ATOM 1437 CB ILE A 91 126.493 -7.488 -2.050 1.00 0.00 C ATOM 1438 CG1 ILE A 91 126.446 -8.944 -2.519 1.00 0.00 C ATOM 1439 CG2 ILE A 91 127.366 -7.381 -0.798 1.00 0.00 C ATOM 1440 CD1 ILE A 91 127.852 -9.539 -2.501 1.00 0.00 C ATOM 0 H ILE A 91 124.498 -8.406 -3.256 1.00 0.00 H new ATOM 0 HA ILE A 91 124.852 -7.099 -0.674 1.00 0.00 H new ATOM 0 HB ILE A 91 126.919 -6.862 -2.834 1.00 0.00 H new ATOM 0 HG12 ILE A 91 125.788 -9.523 -1.871 1.00 0.00 H new ATOM 0 HG13 ILE A 91 126.031 -8.998 -3.526 1.00 0.00 H new ATOM 0 HG21 ILE A 91 128.376 -7.721 -1.028 1.00 0.00 H new ATOM 0 HG22 ILE A 91 127.399 -6.344 -0.465 1.00 0.00 H new ATOM 0 HG23 ILE A 91 126.946 -8.002 -0.007 1.00 0.00 H new ATOM 0 HD11 ILE A 91 127.813 -10.576 -2.836 1.00 0.00 H new ATOM 0 HD12 ILE A 91 128.498 -8.967 -3.167 1.00 0.00 H new ATOM 0 HD13 ILE A 91 128.251 -9.500 -1.487 1.00 0.00 H new ATOM 1452 N GLY A 92 124.518 -5.254 -3.328 1.00 0.00 N ATOM 1453 CA GLY A 92 124.418 -3.827 -3.759 1.00 0.00 C ATOM 1454 C GLY A 92 123.391 -3.075 -2.908 1.00 0.00 C ATOM 1455 O GLY A 92 123.668 -2.022 -2.366 1.00 0.00 O ATOM 0 H GLY A 92 124.234 -5.942 -4.026 1.00 0.00 H new ATOM 0 HA2 GLY A 92 125.392 -3.346 -3.671 1.00 0.00 H new ATOM 0 HA3 GLY A 92 124.132 -3.779 -4.810 1.00 0.00 H new ATOM 1459 N LYS A 93 122.205 -3.597 -2.801 1.00 0.00 N ATOM 1460 CA LYS A 93 121.147 -2.910 -2.005 1.00 0.00 C ATOM 1461 C LYS A 93 121.388 -3.133 -0.509 1.00 0.00 C ATOM 1462 O LYS A 93 120.826 -2.452 0.328 1.00 0.00 O ATOM 1463 CB LYS A 93 119.769 -3.460 -2.399 1.00 0.00 C ATOM 1464 CG LYS A 93 119.878 -4.317 -3.668 1.00 0.00 C ATOM 1465 CD LYS A 93 119.877 -3.424 -4.915 1.00 0.00 C ATOM 1466 CE LYS A 93 121.234 -2.729 -5.069 1.00 0.00 C ATOM 1467 NZ LYS A 93 121.254 -1.940 -6.332 1.00 0.00 N ATOM 0 H LYS A 93 121.918 -4.476 -3.232 1.00 0.00 H new ATOM 0 HA LYS A 93 121.181 -1.840 -2.212 1.00 0.00 H new ATOM 0 HB2 LYS A 93 119.362 -4.057 -1.583 1.00 0.00 H new ATOM 0 HB3 LYS A 93 119.076 -2.636 -2.567 1.00 0.00 H new ATOM 0 HG2 LYS A 93 120.792 -4.910 -3.637 1.00 0.00 H new ATOM 0 HG3 LYS A 93 119.045 -5.018 -3.714 1.00 0.00 H new ATOM 0 HD2 LYS A 93 119.665 -4.023 -5.800 1.00 0.00 H new ATOM 0 HD3 LYS A 93 119.085 -2.679 -4.837 1.00 0.00 H new ATOM 0 HE2 LYS A 93 121.417 -2.074 -4.217 1.00 0.00 H new ATOM 0 HE3 LYS A 93 122.034 -3.470 -5.079 1.00 0.00 H new ATOM 0 HZ1 LYS A 93 122.005 -2.300 -6.954 1.00 0.00 H new ATOM 0 HZ2 LYS A 93 120.335 -2.028 -6.811 1.00 0.00 H new ATOM 0 HZ3 LYS A 93 121.436 -0.940 -6.114 1.00 0.00 H new ATOM 1481 N GLY A 94 122.207 -4.086 -0.166 1.00 0.00 N ATOM 1482 CA GLY A 94 122.469 -4.361 1.277 1.00 0.00 C ATOM 1483 C GLY A 94 123.275 -3.221 1.921 1.00 0.00 C ATOM 1484 O GLY A 94 122.951 -2.765 3.000 1.00 0.00 O ATOM 0 H GLY A 94 122.707 -4.687 -0.821 1.00 0.00 H new ATOM 0 HA2 GLY A 94 121.523 -4.485 1.804 1.00 0.00 H new ATOM 0 HA3 GLY A 94 123.015 -5.299 1.378 1.00 0.00 H new ATOM 1488 N GLU A 95 124.326 -2.762 1.290 1.00 0.00 N ATOM 1489 CA GLU A 95 125.139 -1.662 1.904 1.00 0.00 C ATOM 1490 C GLU A 95 124.508 -0.303 1.588 1.00 0.00 C ATOM 1491 O GLU A 95 124.419 0.566 2.437 1.00 0.00 O ATOM 1492 CB GLU A 95 126.569 -1.699 1.346 1.00 0.00 C ATOM 1493 CG GLU A 95 127.184 -0.291 1.380 1.00 0.00 C ATOM 1494 CD GLU A 95 126.724 0.496 0.151 1.00 0.00 C ATOM 1495 OE1 GLU A 95 126.575 -0.113 -0.896 1.00 0.00 O ATOM 1496 OE2 GLU A 95 126.528 1.693 0.277 1.00 0.00 O ATOM 0 H GLU A 95 124.656 -3.096 0.385 1.00 0.00 H new ATOM 0 HA GLU A 95 125.164 -1.805 2.984 1.00 0.00 H new ATOM 0 HB2 GLU A 95 127.179 -2.385 1.933 1.00 0.00 H new ATOM 0 HB3 GLU A 95 126.559 -2.076 0.323 1.00 0.00 H new ATOM 0 HG2 GLU A 95 126.883 0.227 2.291 1.00 0.00 H new ATOM 0 HG3 GLU A 95 128.272 -0.358 1.396 1.00 0.00 H new ATOM 1503 N THR A 96 124.085 -0.104 0.373 1.00 0.00 N ATOM 1504 CA THR A 96 123.482 1.205 0.010 1.00 0.00 C ATOM 1505 C THR A 96 122.416 1.589 1.038 1.00 0.00 C ATOM 1506 O THR A 96 122.400 2.692 1.547 1.00 0.00 O ATOM 1507 CB THR A 96 122.852 1.113 -1.377 1.00 0.00 C ATOM 1508 OG1 THR A 96 122.147 -0.112 -1.492 1.00 0.00 O ATOM 1509 CG2 THR A 96 123.953 1.176 -2.434 1.00 0.00 C ATOM 0 H THR A 96 124.131 -0.789 -0.382 1.00 0.00 H new ATOM 0 HA THR A 96 124.260 1.968 0.002 1.00 0.00 H new ATOM 0 HB THR A 96 122.160 1.942 -1.525 1.00 0.00 H new ATOM 0 HG1 THR A 96 122.694 -0.759 -1.985 1.00 0.00 H new ATOM 0 HG21 THR A 96 123.508 1.111 -3.427 1.00 0.00 H new ATOM 0 HG22 THR A 96 124.494 2.117 -2.340 1.00 0.00 H new ATOM 0 HG23 THR A 96 124.643 0.345 -2.290 1.00 0.00 H new ATOM 1517 N MET A 97 121.532 0.685 1.352 1.00 0.00 N ATOM 1518 CA MET A 97 120.464 0.991 2.347 1.00 0.00 C ATOM 1519 C MET A 97 121.102 1.531 3.631 1.00 0.00 C ATOM 1520 O MET A 97 120.478 2.230 4.412 1.00 0.00 O ATOM 1521 CB MET A 97 119.710 -0.302 2.667 1.00 0.00 C ATOM 1522 CG MET A 97 120.650 -1.276 3.383 1.00 0.00 C ATOM 1523 SD MET A 97 120.224 -1.347 5.140 1.00 0.00 S ATOM 1524 CE MET A 97 121.254 -2.772 5.567 1.00 0.00 C ATOM 0 H MET A 97 121.502 -0.257 0.962 1.00 0.00 H new ATOM 0 HA MET A 97 119.780 1.736 1.941 1.00 0.00 H new ATOM 0 HB2 MET A 97 118.846 -0.086 3.295 1.00 0.00 H new ATOM 0 HB3 MET A 97 119.332 -0.752 1.749 1.00 0.00 H new ATOM 0 HG2 MET A 97 120.570 -2.268 2.938 1.00 0.00 H new ATOM 0 HG3 MET A 97 121.685 -0.955 3.262 1.00 0.00 H new ATOM 0 HE1 MET A 97 121.503 -2.736 6.627 1.00 0.00 H new ATOM 0 HE2 MET A 97 120.709 -3.692 5.353 1.00 0.00 H new ATOM 0 HE3 MET A 97 122.171 -2.748 4.978 1.00 0.00 H new ATOM 1534 N LYS A 98 122.342 1.202 3.855 1.00 0.00 N ATOM 1535 CA LYS A 98 123.033 1.666 5.089 1.00 0.00 C ATOM 1536 C LYS A 98 123.414 3.143 4.979 1.00 0.00 C ATOM 1537 O LYS A 98 123.264 3.893 5.921 1.00 0.00 O ATOM 1538 CB LYS A 98 124.304 0.836 5.292 1.00 0.00 C ATOM 1539 CG LYS A 98 124.399 0.386 6.753 1.00 0.00 C ATOM 1540 CD LYS A 98 125.742 -0.308 6.989 1.00 0.00 C ATOM 1541 CE LYS A 98 125.579 -1.818 6.802 1.00 0.00 C ATOM 1542 NZ LYS A 98 124.640 -2.080 5.675 1.00 0.00 N ATOM 0 H LYS A 98 122.910 0.628 3.232 1.00 0.00 H new ATOM 0 HA LYS A 98 122.356 1.543 5.935 1.00 0.00 H new ATOM 0 HB2 LYS A 98 124.291 -0.033 4.634 1.00 0.00 H new ATOM 0 HB3 LYS A 98 125.181 1.425 5.025 1.00 0.00 H new ATOM 0 HG2 LYS A 98 124.301 1.246 7.416 1.00 0.00 H new ATOM 0 HG3 LYS A 98 123.580 -0.294 6.989 1.00 0.00 H new ATOM 0 HD2 LYS A 98 126.489 0.076 6.294 1.00 0.00 H new ATOM 0 HD3 LYS A 98 126.102 -0.093 7.995 1.00 0.00 H new ATOM 0 HE2 LYS A 98 126.546 -2.277 6.597 1.00 0.00 H new ATOM 0 HE3 LYS A 98 125.199 -2.270 7.718 1.00 0.00 H new ATOM 0 HZ1 LYS A 98 124.594 -3.103 5.492 1.00 0.00 H new ATOM 0 HZ2 LYS A 98 123.693 -1.730 5.924 1.00 0.00 H new ATOM 0 HZ3 LYS A 98 124.977 -1.591 4.821 1.00 0.00 H new ATOM 1556 N TYR A 99 123.930 3.575 3.860 1.00 0.00 N ATOM 1557 CA TYR A 99 124.328 5.007 3.765 1.00 0.00 C ATOM 1558 C TYR A 99 123.093 5.907 3.833 1.00 0.00 C ATOM 1559 O TYR A 99 123.171 7.025 4.305 1.00 0.00 O ATOM 1560 CB TYR A 99 125.127 5.266 2.480 1.00 0.00 C ATOM 1561 CG TYR A 99 124.210 5.470 1.303 1.00 0.00 C ATOM 1562 CD1 TYR A 99 123.439 6.632 1.194 1.00 0.00 C ATOM 1563 CD2 TYR A 99 124.147 4.492 0.312 1.00 0.00 C ATOM 1564 CE1 TYR A 99 122.601 6.810 0.087 1.00 0.00 C ATOM 1565 CE2 TYR A 99 123.312 4.667 -0.796 1.00 0.00 C ATOM 1566 CZ TYR A 99 122.537 5.827 -0.910 1.00 0.00 C ATOM 1567 OH TYR A 99 121.712 6.003 -2.001 1.00 0.00 O ATOM 0 H TYR A 99 124.090 3.012 3.025 1.00 0.00 H new ATOM 0 HA TYR A 99 124.972 5.245 4.612 1.00 0.00 H new ATOM 0 HB2 TYR A 99 125.757 6.146 2.611 1.00 0.00 H new ATOM 0 HB3 TYR A 99 125.792 4.424 2.285 1.00 0.00 H new ATOM 0 HD1 TYR A 99 123.490 7.390 1.962 1.00 0.00 H new ATOM 0 HD2 TYR A 99 124.745 3.597 0.400 1.00 0.00 H new ATOM 0 HE1 TYR A 99 122.003 7.705 0.001 1.00 0.00 H new ATOM 0 HE2 TYR A 99 123.265 3.908 -1.563 1.00 0.00 H new ATOM 0 HH TYR A 99 121.331 5.140 -2.266 1.00 0.00 H new ATOM 1577 N ILE A 100 121.947 5.444 3.397 1.00 0.00 N ATOM 1578 CA ILE A 100 120.739 6.316 3.486 1.00 0.00 C ATOM 1579 C ILE A 100 120.380 6.497 4.959 1.00 0.00 C ATOM 1580 O ILE A 100 120.226 7.602 5.439 1.00 0.00 O ATOM 1581 CB ILE A 100 119.555 5.686 2.750 1.00 0.00 C ATOM 1582 CG1 ILE A 100 119.839 5.663 1.247 1.00 0.00 C ATOM 1583 CG2 ILE A 100 118.299 6.522 3.010 1.00 0.00 C ATOM 1584 CD1 ILE A 100 120.785 4.508 0.928 1.00 0.00 C ATOM 0 H ILE A 100 121.798 4.520 2.992 1.00 0.00 H new ATOM 0 HA ILE A 100 120.958 7.277 3.021 1.00 0.00 H new ATOM 0 HB ILE A 100 119.405 4.668 3.108 1.00 0.00 H new ATOM 0 HG12 ILE A 100 118.908 5.549 0.691 1.00 0.00 H new ATOM 0 HG13 ILE A 100 120.283 6.608 0.935 1.00 0.00 H new ATOM 0 HG21 ILE A 100 117.452 6.078 2.488 1.00 0.00 H new ATOM 0 HG22 ILE A 100 118.093 6.547 4.080 1.00 0.00 H new ATOM 0 HG23 ILE A 100 118.457 7.538 2.647 1.00 0.00 H new ATOM 0 HD11 ILE A 100 120.989 4.490 -0.143 1.00 0.00 H new ATOM 0 HD12 ILE A 100 121.719 4.642 1.473 1.00 0.00 H new ATOM 0 HD13 ILE A 100 120.323 3.567 1.226 1.00 0.00 H new ATOM 1596 N LEU A 101 120.256 5.419 5.687 1.00 0.00 N ATOM 1597 CA LEU A 101 119.921 5.544 7.134 1.00 0.00 C ATOM 1598 C LEU A 101 121.135 6.091 7.876 1.00 0.00 C ATOM 1599 O LEU A 101 121.066 7.106 8.540 1.00 0.00 O ATOM 1600 CB LEU A 101 119.560 4.167 7.694 1.00 0.00 C ATOM 1601 CG LEU A 101 118.151 4.212 8.279 1.00 0.00 C ATOM 1602 CD1 LEU A 101 117.677 2.788 8.583 1.00 0.00 C ATOM 1603 CD2 LEU A 101 118.160 5.043 9.565 1.00 0.00 C ATOM 0 H LEU A 101 120.371 4.465 5.345 1.00 0.00 H new ATOM 0 HA LEU A 101 119.074 6.218 7.261 1.00 0.00 H new ATOM 0 HB2 LEU A 101 119.615 3.416 6.906 1.00 0.00 H new ATOM 0 HB3 LEU A 101 120.276 3.876 8.463 1.00 0.00 H new ATOM 0 HG LEU A 101 117.471 4.669 7.560 1.00 0.00 H new ATOM 0 HD11 LEU A 101 116.671 2.821 9.001 1.00 0.00 H new ATOM 0 HD12 LEU A 101 117.669 2.203 7.663 1.00 0.00 H new ATOM 0 HD13 LEU A 101 118.353 2.325 9.302 1.00 0.00 H new ATOM 0 HD21 LEU A 101 117.154 5.076 9.984 1.00 0.00 H new ATOM 0 HD22 LEU A 101 118.839 4.589 10.287 1.00 0.00 H new ATOM 0 HD23 LEU A 101 118.493 6.056 9.341 1.00 0.00 H new ATOM 1615 N ALA A 102 122.252 5.433 7.758 1.00 0.00 N ATOM 1616 CA ALA A 102 123.469 5.927 8.446 1.00 0.00 C ATOM 1617 C ALA A 102 123.670 7.395 8.079 1.00 0.00 C ATOM 1618 O ALA A 102 123.244 8.285 8.788 1.00 0.00 O ATOM 1619 CB ALA A 102 124.683 5.113 7.994 1.00 0.00 C ATOM 0 H ALA A 102 122.373 4.577 7.216 1.00 0.00 H new ATOM 0 HA ALA A 102 123.356 5.823 9.525 1.00 0.00 H new ATOM 0 HB1 ALA A 102 125.576 5.479 8.501 1.00 0.00 H new ATOM 0 HB2 ALA A 102 124.529 4.063 8.242 1.00 0.00 H new ATOM 0 HB3 ALA A 102 124.810 5.217 6.916 1.00 0.00 H new ATOM 1625 N LEU A 103 124.305 7.654 6.968 1.00 0.00 N ATOM 1626 CA LEU A 103 124.530 9.063 6.543 1.00 0.00 C ATOM 1627 C LEU A 103 125.264 9.827 7.648 1.00 0.00 C ATOM 1628 O LEU A 103 125.927 10.811 7.388 1.00 0.00 O ATOM 1629 CB LEU A 103 123.184 9.734 6.258 1.00 0.00 C ATOM 1630 CG LEU A 103 123.399 11.227 6.002 1.00 0.00 C ATOM 1631 CD1 LEU A 103 124.410 11.411 4.869 1.00 0.00 C ATOM 1632 CD2 LEU A 103 122.069 11.870 5.605 1.00 0.00 C ATOM 0 H LEU A 103 124.679 6.947 6.335 1.00 0.00 H new ATOM 0 HA LEU A 103 125.137 9.073 5.638 1.00 0.00 H new ATOM 0 HB2 LEU A 103 122.711 9.271 5.392 1.00 0.00 H new ATOM 0 HB3 LEU A 103 122.510 9.593 7.103 1.00 0.00 H new ATOM 0 HG LEU A 103 123.778 11.700 6.908 1.00 0.00 H new ATOM 0 HD11 LEU A 103 124.563 12.475 4.687 1.00 0.00 H new ATOM 0 HD12 LEU A 103 125.358 10.951 5.149 1.00 0.00 H new ATOM 0 HD13 LEU A 103 124.031 10.939 3.963 1.00 0.00 H new ATOM 0 HD21 LEU A 103 122.220 12.934 5.422 1.00 0.00 H new ATOM 0 HD22 LEU A 103 121.692 11.396 4.699 1.00 0.00 H new ATOM 0 HD23 LEU A 103 121.347 11.739 6.411 1.00 0.00 H new ATOM 1644 N LYS A 104 125.160 9.381 8.875 1.00 0.00 N ATOM 1645 CA LYS A 104 125.867 10.082 9.988 1.00 0.00 C ATOM 1646 C LYS A 104 127.123 10.739 9.418 1.00 0.00 C ATOM 1647 O LYS A 104 127.475 11.850 9.761 1.00 0.00 O ATOM 1648 CB LYS A 104 126.264 9.056 11.054 1.00 0.00 C ATOM 1649 CG LYS A 104 126.310 9.701 12.439 1.00 0.00 C ATOM 1650 CD LYS A 104 125.444 8.895 13.412 1.00 0.00 C ATOM 1651 CE LYS A 104 123.997 8.868 12.913 1.00 0.00 C ATOM 1652 NZ LYS A 104 123.071 9.067 14.064 1.00 0.00 N ATOM 0 H LYS A 104 124.617 8.563 9.153 1.00 0.00 H new ATOM 0 HA LYS A 104 125.221 10.836 10.437 1.00 0.00 H new ATOM 0 HB2 LYS A 104 125.551 8.232 11.055 1.00 0.00 H new ATOM 0 HB3 LYS A 104 127.239 8.633 10.813 1.00 0.00 H new ATOM 0 HG2 LYS A 104 127.338 9.740 12.799 1.00 0.00 H new ATOM 0 HG3 LYS A 104 125.952 10.729 12.384 1.00 0.00 H new ATOM 0 HD2 LYS A 104 125.828 7.879 13.499 1.00 0.00 H new ATOM 0 HD3 LYS A 104 125.488 9.339 14.407 1.00 0.00 H new ATOM 0 HE2 LYS A 104 123.843 9.650 12.169 1.00 0.00 H new ATOM 0 HE3 LYS A 104 123.787 7.917 12.424 1.00 0.00 H new ATOM 0 HZ1 LYS A 104 122.088 9.049 13.726 1.00 0.00 H new ATOM 0 HZ2 LYS A 104 123.212 8.306 14.759 1.00 0.00 H new ATOM 0 HZ3 LYS A 104 123.266 9.985 14.512 1.00 0.00 H new ATOM 1666 N ASP A 105 127.785 10.053 8.526 1.00 0.00 N ATOM 1667 CA ASP A 105 129.007 10.616 7.892 1.00 0.00 C ATOM 1668 C ASP A 105 128.810 10.599 6.374 1.00 0.00 C ATOM 1669 O ASP A 105 128.302 11.539 5.797 1.00 0.00 O ATOM 1670 CB ASP A 105 130.221 9.764 8.266 1.00 0.00 C ATOM 1671 CG ASP A 105 130.672 10.113 9.686 1.00 0.00 C ATOM 1672 OD1 ASP A 105 129.874 10.674 10.419 1.00 0.00 O ATOM 1673 OD2 ASP A 105 131.808 9.814 10.016 1.00 0.00 O ATOM 0 H ASP A 105 127.528 9.119 8.208 1.00 0.00 H new ATOM 0 HA ASP A 105 129.176 11.636 8.238 1.00 0.00 H new ATOM 0 HB2 ASP A 105 129.969 8.705 8.203 1.00 0.00 H new ATOM 0 HB3 ASP A 105 131.034 9.941 7.561 1.00 0.00 H new ATOM 1678 N GLN A 106 129.188 9.526 5.730 1.00 0.00 N ATOM 1679 CA GLN A 106 129.007 9.428 4.250 1.00 0.00 C ATOM 1680 C GLN A 106 129.975 8.385 3.680 1.00 0.00 C ATOM 1681 O GLN A 106 129.562 7.369 3.153 1.00 0.00 O ATOM 1682 CB GLN A 106 129.268 10.791 3.594 1.00 0.00 C ATOM 1683 CG GLN A 106 127.936 11.467 3.252 1.00 0.00 C ATOM 1684 CD GLN A 106 128.087 12.984 3.371 1.00 0.00 C ATOM 1685 OE1 GLN A 106 128.674 13.617 2.515 1.00 0.00 O ATOM 1686 NE2 GLN A 106 127.580 13.599 4.403 1.00 0.00 N ATOM 0 H GLN A 106 129.616 8.710 6.167 1.00 0.00 H new ATOM 0 HA GLN A 106 127.982 9.125 4.037 1.00 0.00 H new ATOM 0 HB2 GLN A 106 129.845 11.424 4.268 1.00 0.00 H new ATOM 0 HB3 GLN A 106 129.863 10.662 2.690 1.00 0.00 H new ATOM 0 HG2 GLN A 106 127.630 11.200 2.241 1.00 0.00 H new ATOM 0 HG3 GLN A 106 127.154 11.115 3.925 1.00 0.00 H new ATOM 0 HE21 GLN A 106 127.087 13.068 5.122 1.00 0.00 H new ATOM 0 HE22 GLN A 106 127.676 14.611 4.492 1.00 0.00 H new ATOM 1695 N PRO A 107 131.255 8.634 3.780 1.00 0.00 N ATOM 1696 CA PRO A 107 132.299 7.702 3.259 1.00 0.00 C ATOM 1697 C PRO A 107 132.353 6.378 4.028 1.00 0.00 C ATOM 1698 O PRO A 107 132.920 5.411 3.563 1.00 0.00 O ATOM 1699 CB PRO A 107 133.608 8.472 3.450 1.00 0.00 C ATOM 1700 CG PRO A 107 133.327 9.458 4.534 1.00 0.00 C ATOM 1701 CD PRO A 107 131.854 9.829 4.397 1.00 0.00 C ATOM 0 HA PRO A 107 132.096 7.423 2.225 1.00 0.00 H new ATOM 0 HB2 PRO A 107 134.422 7.802 3.728 1.00 0.00 H new ATOM 0 HB3 PRO A 107 133.908 8.973 2.530 1.00 0.00 H new ATOM 0 HG2 PRO A 107 133.531 9.028 5.515 1.00 0.00 H new ATOM 0 HG3 PRO A 107 133.962 10.339 4.434 1.00 0.00 H new ATOM 0 HD2 PRO A 107 131.404 10.049 5.365 1.00 0.00 H new ATOM 0 HD3 PRO A 107 131.719 10.713 3.774 1.00 0.00 H new ATOM 1709 N GLU A 108 131.780 6.320 5.201 1.00 0.00 N ATOM 1710 CA GLU A 108 131.828 5.045 5.973 1.00 0.00 C ATOM 1711 C GLU A 108 130.867 4.030 5.345 1.00 0.00 C ATOM 1712 O GLU A 108 131.240 2.911 5.037 1.00 0.00 O ATOM 1713 CB GLU A 108 131.469 5.315 7.443 1.00 0.00 C ATOM 1714 CG GLU A 108 129.953 5.272 7.650 1.00 0.00 C ATOM 1715 CD GLU A 108 129.293 6.380 6.828 1.00 0.00 C ATOM 1716 OE1 GLU A 108 129.990 7.307 6.453 1.00 0.00 O ATOM 1717 OE2 GLU A 108 128.101 6.280 6.584 1.00 0.00 O ATOM 0 H GLU A 108 131.287 7.090 5.653 1.00 0.00 H new ATOM 0 HA GLU A 108 132.835 4.630 5.940 1.00 0.00 H new ATOM 0 HB2 GLU A 108 131.949 4.573 8.081 1.00 0.00 H new ATOM 0 HB3 GLU A 108 131.854 6.290 7.743 1.00 0.00 H new ATOM 0 HG2 GLU A 108 129.562 4.300 7.350 1.00 0.00 H new ATOM 0 HG3 GLU A 108 129.716 5.398 8.706 1.00 0.00 H new ATOM 1724 N ALA A 109 129.639 4.412 5.129 1.00 0.00 N ATOM 1725 CA ALA A 109 128.673 3.472 4.502 1.00 0.00 C ATOM 1726 C ALA A 109 129.173 3.141 3.097 1.00 0.00 C ATOM 1727 O ALA A 109 129.071 2.023 2.629 1.00 0.00 O ATOM 1728 CB ALA A 109 127.297 4.135 4.425 1.00 0.00 C ATOM 0 H ALA A 109 129.265 5.332 5.359 1.00 0.00 H new ATOM 0 HA ALA A 109 128.590 2.559 5.092 1.00 0.00 H new ATOM 0 HB1 ALA A 109 126.587 3.447 3.965 1.00 0.00 H new ATOM 0 HB2 ALA A 109 126.958 4.388 5.430 1.00 0.00 H new ATOM 0 HB3 ALA A 109 127.363 5.043 3.825 1.00 0.00 H new ATOM 1734 N ALA A 110 129.732 4.112 2.431 1.00 0.00 N ATOM 1735 CA ALA A 110 130.265 3.877 1.063 1.00 0.00 C ATOM 1736 C ALA A 110 131.471 2.943 1.154 1.00 0.00 C ATOM 1737 O ALA A 110 131.686 2.109 0.297 1.00 0.00 O ATOM 1738 CB ALA A 110 130.694 5.208 0.443 1.00 0.00 C ATOM 0 H ALA A 110 129.843 5.064 2.779 1.00 0.00 H new ATOM 0 HA ALA A 110 129.493 3.425 0.440 1.00 0.00 H new ATOM 0 HB1 ALA A 110 131.084 5.033 -0.560 1.00 0.00 H new ATOM 0 HB2 ALA A 110 129.835 5.877 0.387 1.00 0.00 H new ATOM 0 HB3 ALA A 110 131.469 5.664 1.060 1.00 0.00 H new ATOM 1744 N GLN A 111 132.255 3.063 2.192 1.00 0.00 N ATOM 1745 CA GLN A 111 133.432 2.165 2.328 1.00 0.00 C ATOM 1746 C GLN A 111 132.952 0.729 2.165 1.00 0.00 C ATOM 1747 O GLN A 111 133.458 -0.021 1.350 1.00 0.00 O ATOM 1748 CB GLN A 111 134.076 2.351 3.702 1.00 0.00 C ATOM 1749 CG GLN A 111 134.847 3.673 3.722 1.00 0.00 C ATOM 1750 CD GLN A 111 136.348 3.394 3.840 1.00 0.00 C ATOM 1751 OE1 GLN A 111 137.038 4.035 4.608 1.00 0.00 O ATOM 1752 NE2 GLN A 111 136.884 2.458 3.107 1.00 0.00 N ATOM 0 H GLN A 111 132.131 3.740 2.945 1.00 0.00 H new ATOM 0 HA GLN A 111 134.177 2.401 1.568 1.00 0.00 H new ATOM 0 HB2 GLN A 111 133.311 2.351 4.478 1.00 0.00 H new ATOM 0 HB3 GLN A 111 134.749 1.521 3.917 1.00 0.00 H new ATOM 0 HG2 GLN A 111 134.643 4.238 2.812 1.00 0.00 H new ATOM 0 HG3 GLN A 111 134.514 4.286 4.559 1.00 0.00 H new ATOM 0 HE21 GLN A 111 136.304 1.920 2.463 1.00 0.00 H new ATOM 0 HE22 GLN A 111 137.883 2.264 3.178 1.00 0.00 H new ATOM 1761 N LEU A 112 131.951 0.342 2.907 1.00 0.00 N ATOM 1762 CA LEU A 112 131.427 -1.035 2.748 1.00 0.00 C ATOM 1763 C LEU A 112 131.114 -1.229 1.270 1.00 0.00 C ATOM 1764 O LEU A 112 131.468 -2.223 0.671 1.00 0.00 O ATOM 1765 CB LEU A 112 130.157 -1.202 3.583 1.00 0.00 C ATOM 1766 CG LEU A 112 130.531 -1.656 4.996 1.00 0.00 C ATOM 1767 CD1 LEU A 112 130.979 -3.118 4.969 1.00 0.00 C ATOM 1768 CD2 LEU A 112 131.675 -0.789 5.527 1.00 0.00 C ATOM 0 H LEU A 112 131.481 0.915 3.608 1.00 0.00 H new ATOM 0 HA LEU A 112 132.154 -1.773 3.086 1.00 0.00 H new ATOM 0 HB2 LEU A 112 129.610 -0.260 3.625 1.00 0.00 H new ATOM 0 HB3 LEU A 112 129.496 -1.933 3.117 1.00 0.00 H new ATOM 0 HG LEU A 112 129.661 -1.555 5.645 1.00 0.00 H new ATOM 0 HD11 LEU A 112 131.244 -3.436 5.977 1.00 0.00 H new ATOM 0 HD12 LEU A 112 130.167 -3.741 4.594 1.00 0.00 H new ATOM 0 HD13 LEU A 112 131.846 -3.221 4.316 1.00 0.00 H new ATOM 0 HD21 LEU A 112 131.940 -1.113 6.533 1.00 0.00 H new ATOM 0 HD22 LEU A 112 132.541 -0.889 4.873 1.00 0.00 H new ATOM 0 HD23 LEU A 112 131.359 0.254 5.553 1.00 0.00 H new ATOM 1780 N ALA A 113 130.482 -0.263 0.665 1.00 0.00 N ATOM 1781 CA ALA A 113 130.180 -0.373 -0.785 1.00 0.00 C ATOM 1782 C ALA A 113 131.466 -0.768 -1.514 1.00 0.00 C ATOM 1783 O ALA A 113 131.440 -1.383 -2.561 1.00 0.00 O ATOM 1784 CB ALA A 113 129.683 0.974 -1.313 1.00 0.00 C ATOM 0 H ALA A 113 130.163 0.596 1.113 1.00 0.00 H new ATOM 0 HA ALA A 113 129.406 -1.123 -0.952 1.00 0.00 H new ATOM 0 HB1 ALA A 113 129.463 0.889 -2.377 1.00 0.00 H new ATOM 0 HB2 ALA A 113 128.779 1.264 -0.777 1.00 0.00 H new ATOM 0 HB3 ALA A 113 130.453 1.731 -1.161 1.00 0.00 H new ATOM 1790 N LEU A 114 132.597 -0.413 -0.958 1.00 0.00 N ATOM 1791 CA LEU A 114 133.896 -0.760 -1.605 1.00 0.00 C ATOM 1792 C LEU A 114 134.097 -2.274 -1.539 1.00 0.00 C ATOM 1793 O LEU A 114 134.261 -2.939 -2.552 1.00 0.00 O ATOM 1794 CB LEU A 114 135.039 -0.059 -0.867 1.00 0.00 C ATOM 1795 CG LEU A 114 136.172 0.246 -1.848 1.00 0.00 C ATOM 1796 CD1 LEU A 114 136.566 -1.034 -2.588 1.00 0.00 C ATOM 1797 CD2 LEU A 114 135.705 1.298 -2.860 1.00 0.00 C ATOM 0 H LEU A 114 132.675 0.103 -0.082 1.00 0.00 H new ATOM 0 HA LEU A 114 133.888 -0.435 -2.645 1.00 0.00 H new ATOM 0 HB2 LEU A 114 134.680 0.864 -0.412 1.00 0.00 H new ATOM 0 HB3 LEU A 114 135.405 -0.691 -0.058 1.00 0.00 H new ATOM 0 HG LEU A 114 137.033 0.628 -1.299 1.00 0.00 H new ATOM 0 HD11 LEU A 114 137.373 -0.816 -3.287 1.00 0.00 H new ATOM 0 HD12 LEU A 114 136.900 -1.782 -1.869 1.00 0.00 H new ATOM 0 HD13 LEU A 114 135.705 -1.417 -3.136 1.00 0.00 H new ATOM 0 HD21 LEU A 114 136.513 1.515 -3.559 1.00 0.00 H new ATOM 0 HD22 LEU A 114 134.843 0.918 -3.409 1.00 0.00 H new ATOM 0 HD23 LEU A 114 135.426 2.211 -2.333 1.00 0.00 H new ATOM 1809 N ARG A 115 134.058 -2.845 -0.365 1.00 0.00 N ATOM 1810 CA ARG A 115 134.218 -4.315 -0.301 1.00 0.00 C ATOM 1811 C ARG A 115 133.174 -4.892 -1.249 1.00 0.00 C ATOM 1812 O ARG A 115 133.462 -5.716 -2.087 1.00 0.00 O ATOM 1813 CB ARG A 115 134.011 -4.825 1.132 1.00 0.00 C ATOM 1814 CG ARG A 115 135.336 -4.741 1.893 1.00 0.00 C ATOM 1815 CD ARG A 115 135.562 -3.305 2.374 1.00 0.00 C ATOM 1816 NE ARG A 115 137.011 -2.971 2.273 1.00 0.00 N ATOM 1817 CZ ARG A 115 137.521 -2.043 3.035 1.00 0.00 C ATOM 1818 NH1 ARG A 115 136.763 -1.408 3.887 1.00 0.00 N ATOM 1819 NH2 ARG A 115 138.790 -1.750 2.946 1.00 0.00 N ATOM 0 H ARG A 115 133.926 -2.368 0.527 1.00 0.00 H new ATOM 0 HA ARG A 115 135.223 -4.621 -0.591 1.00 0.00 H new ATOM 0 HB2 ARG A 115 133.250 -4.229 1.636 1.00 0.00 H new ATOM 0 HB3 ARG A 115 133.652 -5.854 1.116 1.00 0.00 H new ATOM 0 HG2 ARG A 115 135.322 -5.422 2.744 1.00 0.00 H new ATOM 0 HG3 ARG A 115 136.158 -5.053 1.248 1.00 0.00 H new ATOM 0 HD2 ARG A 115 134.975 -2.612 1.772 1.00 0.00 H new ATOM 0 HD3 ARG A 115 135.224 -3.198 3.405 1.00 0.00 H new ATOM 0 HE ARG A 115 137.604 -3.468 1.608 1.00 0.00 H new ATOM 0 HH11 ARG A 115 135.772 -1.637 3.957 1.00 0.00 H new ATOM 0 HH12 ARG A 115 137.162 -0.683 4.483 1.00 0.00 H new ATOM 0 HH21 ARG A 115 139.383 -2.247 2.281 1.00 0.00 H new ATOM 0 HH22 ARG A 115 139.189 -1.024 3.542 1.00 0.00 H new ATOM 1833 N VAL A 116 131.971 -4.406 -1.188 1.00 0.00 N ATOM 1834 CA VAL A 116 130.961 -4.898 -2.146 1.00 0.00 C ATOM 1835 C VAL A 116 131.630 -4.854 -3.517 1.00 0.00 C ATOM 1836 O VAL A 116 131.390 -5.676 -4.372 1.00 0.00 O ATOM 1837 CB VAL A 116 129.735 -3.980 -2.108 1.00 0.00 C ATOM 1838 CG1 VAL A 116 129.224 -3.718 -3.524 1.00 0.00 C ATOM 1839 CG2 VAL A 116 128.623 -4.633 -1.280 1.00 0.00 C ATOM 0 H VAL A 116 131.650 -3.700 -0.526 1.00 0.00 H new ATOM 0 HA VAL A 116 130.623 -5.907 -1.910 1.00 0.00 H new ATOM 0 HB VAL A 116 130.023 -3.033 -1.652 1.00 0.00 H new ATOM 0 HG11 VAL A 116 128.353 -3.064 -3.481 1.00 0.00 H new ATOM 0 HG12 VAL A 116 130.008 -3.240 -4.111 1.00 0.00 H new ATOM 0 HG13 VAL A 116 128.946 -4.663 -3.991 1.00 0.00 H new ATOM 0 HG21 VAL A 116 127.754 -3.976 -1.256 1.00 0.00 H new ATOM 0 HG22 VAL A 116 128.346 -5.586 -1.731 1.00 0.00 H new ATOM 0 HG23 VAL A 116 128.978 -4.802 -0.263 1.00 0.00 H new ATOM 1849 N GLY A 117 132.511 -3.910 -3.712 1.00 0.00 N ATOM 1850 CA GLY A 117 133.232 -3.837 -5.005 1.00 0.00 C ATOM 1851 C GLY A 117 133.805 -5.222 -5.292 1.00 0.00 C ATOM 1852 O GLY A 117 133.647 -5.772 -6.378 1.00 0.00 O ATOM 0 H GLY A 117 132.759 -3.191 -3.032 1.00 0.00 H new ATOM 0 HA2 GLY A 117 132.557 -3.529 -5.803 1.00 0.00 H new ATOM 0 HA3 GLY A 117 134.029 -3.095 -4.958 1.00 0.00 H new ATOM 1856 N ILE A 118 134.457 -5.816 -4.322 1.00 0.00 N ATOM 1857 CA ILE A 118 135.004 -7.172 -4.577 1.00 0.00 C ATOM 1858 C ILE A 118 133.866 -8.038 -5.100 1.00 0.00 C ATOM 1859 O ILE A 118 134.071 -8.930 -5.900 1.00 0.00 O ATOM 1860 CB ILE A 118 135.655 -7.795 -3.322 1.00 0.00 C ATOM 1861 CG1 ILE A 118 134.771 -7.695 -2.068 1.00 0.00 C ATOM 1862 CG2 ILE A 118 136.955 -7.050 -3.037 1.00 0.00 C ATOM 1863 CD1 ILE A 118 133.343 -8.178 -2.340 1.00 0.00 C ATOM 0 H ILE A 118 134.628 -5.430 -3.393 1.00 0.00 H new ATOM 0 HA ILE A 118 135.804 -7.105 -5.315 1.00 0.00 H new ATOM 0 HB ILE A 118 135.814 -8.853 -3.532 1.00 0.00 H new ATOM 0 HG12 ILE A 118 135.209 -8.289 -1.266 1.00 0.00 H new ATOM 0 HG13 ILE A 118 134.746 -6.662 -1.722 1.00 0.00 H new ATOM 0 HG21 ILE A 118 137.432 -7.475 -2.153 1.00 0.00 H new ATOM 0 HG22 ILE A 118 137.624 -7.146 -3.892 1.00 0.00 H new ATOM 0 HG23 ILE A 118 136.739 -5.996 -2.862 1.00 0.00 H new ATOM 0 HD11 ILE A 118 132.750 -8.092 -1.430 1.00 0.00 H new ATOM 0 HD12 ILE A 118 132.895 -7.567 -3.124 1.00 0.00 H new ATOM 0 HD13 ILE A 118 133.366 -9.220 -2.660 1.00 0.00 H new ATOM 1875 N ALA A 119 132.657 -7.769 -4.680 1.00 0.00 N ATOM 1876 CA ALA A 119 131.522 -8.567 -5.192 1.00 0.00 C ATOM 1877 C ALA A 119 131.317 -8.219 -6.662 1.00 0.00 C ATOM 1878 O ALA A 119 130.890 -9.039 -7.443 1.00 0.00 O ATOM 1879 CB ALA A 119 130.253 -8.274 -4.391 1.00 0.00 C ATOM 0 H ALA A 119 132.415 -7.038 -4.011 1.00 0.00 H new ATOM 0 HA ALA A 119 131.740 -9.630 -5.088 1.00 0.00 H new ATOM 0 HB1 ALA A 119 129.429 -8.871 -4.783 1.00 0.00 H new ATOM 0 HB2 ALA A 119 130.418 -8.526 -3.343 1.00 0.00 H new ATOM 0 HB3 ALA A 119 130.006 -7.216 -4.475 1.00 0.00 H new ATOM 1885 N VAL A 120 131.652 -7.025 -7.075 1.00 0.00 N ATOM 1886 CA VAL A 120 131.486 -6.712 -8.516 1.00 0.00 C ATOM 1887 C VAL A 120 132.166 -7.842 -9.254 1.00 0.00 C ATOM 1888 O VAL A 120 131.659 -8.372 -10.222 1.00 0.00 O ATOM 1889 CB VAL A 120 132.147 -5.379 -8.852 1.00 0.00 C ATOM 1890 CG1 VAL A 120 131.993 -5.098 -10.346 1.00 0.00 C ATOM 1891 CG2 VAL A 120 131.472 -4.269 -8.048 1.00 0.00 C ATOM 0 H VAL A 120 132.023 -6.274 -6.492 1.00 0.00 H new ATOM 0 HA VAL A 120 130.436 -6.623 -8.793 1.00 0.00 H new ATOM 0 HB VAL A 120 133.207 -5.419 -8.601 1.00 0.00 H new ATOM 0 HG11 VAL A 120 132.465 -4.146 -10.588 1.00 0.00 H new ATOM 0 HG12 VAL A 120 132.470 -5.895 -10.917 1.00 0.00 H new ATOM 0 HG13 VAL A 120 130.934 -5.053 -10.601 1.00 0.00 H new ATOM 0 HG21 VAL A 120 131.940 -3.313 -8.283 1.00 0.00 H new ATOM 0 HG22 VAL A 120 130.413 -4.227 -8.303 1.00 0.00 H new ATOM 0 HG23 VAL A 120 131.581 -4.474 -6.983 1.00 0.00 H new ATOM 1901 N ALA A 121 133.281 -8.268 -8.744 1.00 0.00 N ATOM 1902 CA ALA A 121 133.962 -9.434 -9.355 1.00 0.00 C ATOM 1903 C ALA A 121 133.347 -10.687 -8.721 1.00 0.00 C ATOM 1904 O ALA A 121 133.477 -11.788 -9.217 1.00 0.00 O ATOM 1905 CB ALA A 121 135.462 -9.379 -9.054 1.00 0.00 C ATOM 0 H ALA A 121 133.749 -7.861 -7.934 1.00 0.00 H new ATOM 0 HA ALA A 121 133.836 -9.440 -10.438 1.00 0.00 H new ATOM 0 HB1 ALA A 121 135.956 -10.239 -9.506 1.00 0.00 H new ATOM 0 HB2 ALA A 121 135.882 -8.461 -9.466 1.00 0.00 H new ATOM 0 HB3 ALA A 121 135.618 -9.397 -7.975 1.00 0.00 H new ATOM 1911 N LYS A 122 132.680 -10.500 -7.606 1.00 0.00 N ATOM 1912 CA LYS A 122 132.040 -11.641 -6.881 1.00 0.00 C ATOM 1913 C LYS A 122 130.601 -11.266 -6.483 1.00 0.00 C ATOM 1914 O LYS A 122 130.223 -11.380 -5.334 1.00 0.00 O ATOM 1915 CB LYS A 122 132.855 -11.967 -5.625 1.00 0.00 C ATOM 1916 CG LYS A 122 133.784 -13.149 -5.913 1.00 0.00 C ATOM 1917 CD LYS A 122 134.613 -13.465 -4.667 1.00 0.00 C ATOM 1918 CE LYS A 122 135.925 -12.678 -4.710 1.00 0.00 C ATOM 1919 NZ LYS A 122 136.630 -12.958 -5.993 1.00 0.00 N ATOM 0 H LYS A 122 132.551 -9.591 -7.163 1.00 0.00 H new ATOM 0 HA LYS A 122 132.013 -12.514 -7.534 1.00 0.00 H new ATOM 0 HB2 LYS A 122 133.438 -11.098 -5.321 1.00 0.00 H new ATOM 0 HB3 LYS A 122 132.188 -12.208 -4.798 1.00 0.00 H new ATOM 0 HG2 LYS A 122 133.199 -14.022 -6.204 1.00 0.00 H new ATOM 0 HG3 LYS A 122 134.442 -12.912 -6.749 1.00 0.00 H new ATOM 0 HD2 LYS A 122 134.052 -13.207 -3.769 1.00 0.00 H new ATOM 0 HD3 LYS A 122 134.820 -14.534 -4.617 1.00 0.00 H new ATOM 0 HE2 LYS A 122 135.724 -11.611 -4.618 1.00 0.00 H new ATOM 0 HE3 LYS A 122 136.557 -12.957 -3.867 1.00 0.00 H new ATOM 0 HZ1 LYS A 122 137.655 -12.998 -5.824 1.00 0.00 H new ATOM 0 HZ2 LYS A 122 136.306 -13.870 -6.375 1.00 0.00 H new ATOM 0 HZ3 LYS A 122 136.421 -12.202 -6.676 1.00 0.00 H new ATOM 1933 N SER A 123 129.809 -10.787 -7.407 1.00 0.00 N ATOM 1934 CA SER A 123 128.411 -10.374 -7.060 1.00 0.00 C ATOM 1935 C SER A 123 127.805 -11.359 -6.067 1.00 0.00 C ATOM 1936 O SER A 123 126.795 -11.092 -5.448 1.00 0.00 O ATOM 1937 CB SER A 123 127.557 -10.338 -8.328 1.00 0.00 C ATOM 1938 OG SER A 123 128.404 -10.221 -9.463 1.00 0.00 O ATOM 0 H SER A 123 130.067 -10.663 -8.386 1.00 0.00 H new ATOM 0 HA SER A 123 128.436 -9.382 -6.608 1.00 0.00 H new ATOM 0 HB2 SER A 123 126.956 -11.244 -8.401 1.00 0.00 H new ATOM 0 HB3 SER A 123 126.864 -9.498 -8.289 1.00 0.00 H new ATOM 0 HG SER A 123 128.726 -11.109 -9.724 1.00 0.00 H new ATOM 1944 N ASP A 124 128.418 -12.487 -5.900 1.00 0.00 N ATOM 1945 CA ASP A 124 127.885 -13.484 -4.934 1.00 0.00 C ATOM 1946 C ASP A 124 129.016 -14.415 -4.498 1.00 0.00 C ATOM 1947 O ASP A 124 128.915 -15.622 -4.595 1.00 0.00 O ATOM 1948 CB ASP A 124 126.766 -14.289 -5.598 1.00 0.00 C ATOM 1949 CG ASP A 124 127.372 -15.334 -6.538 1.00 0.00 C ATOM 1950 OD1 ASP A 124 128.527 -15.177 -6.899 1.00 0.00 O ATOM 1951 OD2 ASP A 124 126.671 -16.272 -6.880 1.00 0.00 O ATOM 0 H ASP A 124 129.268 -12.767 -6.390 1.00 0.00 H new ATOM 0 HA ASP A 124 127.482 -12.974 -4.059 1.00 0.00 H new ATOM 0 HB2 ASP A 124 126.157 -14.779 -4.838 1.00 0.00 H new ATOM 0 HB3 ASP A 124 126.107 -13.623 -6.155 1.00 0.00 H new ATOM 1956 N GLY A 125 130.100 -13.862 -4.019 1.00 0.00 N ATOM 1957 CA GLY A 125 131.238 -14.718 -3.582 1.00 0.00 C ATOM 1958 C GLY A 125 132.019 -14.028 -2.459 1.00 0.00 C ATOM 1959 O GLY A 125 132.569 -14.677 -1.592 1.00 0.00 O ATOM 0 H GLY A 125 130.244 -12.858 -3.913 1.00 0.00 H new ATOM 0 HA2 GLY A 125 130.865 -15.682 -3.236 1.00 0.00 H new ATOM 0 HA3 GLY A 125 131.899 -14.916 -4.426 1.00 0.00 H new ATOM 1963 N ASN A 126 132.082 -12.721 -2.464 1.00 0.00 N ATOM 1964 CA ASN A 126 132.841 -12.015 -1.391 1.00 0.00 C ATOM 1965 C ASN A 126 131.914 -11.071 -0.615 1.00 0.00 C ATOM 1966 O ASN A 126 130.718 -11.044 -0.826 1.00 0.00 O ATOM 1967 CB ASN A 126 133.997 -11.229 -2.013 1.00 0.00 C ATOM 1968 CG ASN A 126 135.281 -12.058 -1.932 1.00 0.00 C ATOM 1969 OD1 ASN A 126 136.369 -11.524 -2.012 1.00 0.00 O ATOM 1970 ND2 ASN A 126 135.200 -13.352 -1.776 1.00 0.00 N ATOM 0 H ASN A 126 131.644 -12.117 -3.159 1.00 0.00 H new ATOM 0 HA ASN A 126 133.243 -12.752 -0.695 1.00 0.00 H new ATOM 0 HB2 ASN A 126 133.771 -10.990 -3.052 1.00 0.00 H new ATOM 0 HB3 ASN A 126 134.130 -10.282 -1.490 1.00 0.00 H new ATOM 0 HD21 ASN A 126 136.050 -13.913 -1.721 1.00 0.00 H new ATOM 0 HD22 ASN A 126 134.287 -13.801 -1.709 1.00 0.00 H new ATOM 1977 N PHE A 127 132.463 -10.312 0.299 1.00 0.00 N ATOM 1978 CA PHE A 127 131.629 -9.381 1.120 1.00 0.00 C ATOM 1979 C PHE A 127 131.050 -10.145 2.308 1.00 0.00 C ATOM 1980 O PHE A 127 131.095 -11.357 2.357 1.00 0.00 O ATOM 1981 CB PHE A 127 130.482 -8.806 0.287 1.00 0.00 C ATOM 1982 CG PHE A 127 130.127 -7.441 0.830 1.00 0.00 C ATOM 1983 CD1 PHE A 127 130.993 -6.366 0.616 1.00 0.00 C ATOM 1984 CD2 PHE A 127 128.942 -7.251 1.553 1.00 0.00 C ATOM 1985 CE1 PHE A 127 130.678 -5.100 1.122 1.00 0.00 C ATOM 1986 CE2 PHE A 127 128.628 -5.982 2.060 1.00 0.00 C ATOM 1987 CZ PHE A 127 129.497 -4.907 1.843 1.00 0.00 C ATOM 0 H PHE A 127 133.460 -10.297 0.514 1.00 0.00 H new ATOM 0 HA PHE A 127 132.257 -8.560 1.466 1.00 0.00 H new ATOM 0 HB2 PHE A 127 130.776 -8.732 -0.760 1.00 0.00 H new ATOM 0 HB3 PHE A 127 129.616 -9.467 0.329 1.00 0.00 H new ATOM 0 HD1 PHE A 127 131.907 -6.512 0.059 1.00 0.00 H new ATOM 0 HD2 PHE A 127 128.271 -8.081 1.720 1.00 0.00 H new ATOM 0 HE1 PHE A 127 131.349 -4.270 0.955 1.00 0.00 H new ATOM 0 HE2 PHE A 127 127.715 -5.834 2.618 1.00 0.00 H new ATOM 0 HZ PHE A 127 129.255 -3.929 2.232 1.00 0.00 H new ATOM 1997 N ASP A 128 130.505 -9.447 3.266 1.00 0.00 N ATOM 1998 CA ASP A 128 129.924 -10.131 4.445 1.00 0.00 C ATOM 1999 C ASP A 128 131.052 -10.619 5.355 1.00 0.00 C ATOM 2000 O ASP A 128 130.820 -11.281 6.343 1.00 0.00 O ATOM 2001 CB ASP A 128 129.084 -11.317 3.969 1.00 0.00 C ATOM 2002 CG ASP A 128 128.415 -10.966 2.639 1.00 0.00 C ATOM 2003 OD1 ASP A 128 127.443 -10.229 2.664 1.00 0.00 O ATOM 2004 OD2 ASP A 128 128.887 -11.439 1.618 1.00 0.00 O ATOM 0 H ASP A 128 130.439 -8.429 3.279 1.00 0.00 H new ATOM 0 HA ASP A 128 129.291 -9.441 5.003 1.00 0.00 H new ATOM 0 HB2 ASP A 128 129.714 -12.198 3.850 1.00 0.00 H new ATOM 0 HB3 ASP A 128 128.328 -11.564 4.715 1.00 0.00 H new ATOM 2009 N ASP A 129 132.275 -10.290 5.035 1.00 0.00 N ATOM 2010 CA ASP A 129 133.413 -10.737 5.893 1.00 0.00 C ATOM 2011 C ASP A 129 134.124 -9.512 6.464 1.00 0.00 C ATOM 2012 O ASP A 129 134.455 -9.466 7.631 1.00 0.00 O ATOM 2013 CB ASP A 129 134.397 -11.557 5.056 1.00 0.00 C ATOM 2014 CG ASP A 129 135.344 -12.321 5.983 1.00 0.00 C ATOM 2015 OD1 ASP A 129 135.553 -11.860 7.093 1.00 0.00 O ATOM 2016 OD2 ASP A 129 135.844 -13.353 5.567 1.00 0.00 O ATOM 0 H ASP A 129 132.536 -9.734 4.221 1.00 0.00 H new ATOM 0 HA ASP A 129 133.035 -11.354 6.708 1.00 0.00 H new ATOM 0 HB2 ASP A 129 133.855 -12.255 4.418 1.00 0.00 H new ATOM 0 HB3 ASP A 129 134.966 -10.900 4.398 1.00 0.00 H new ATOM 2021 N ASP A 130 134.349 -8.511 5.662 1.00 0.00 N ATOM 2022 CA ASP A 130 135.020 -7.293 6.184 1.00 0.00 C ATOM 2023 C ASP A 130 133.994 -6.500 6.987 1.00 0.00 C ATOM 2024 O ASP A 130 134.332 -5.680 7.815 1.00 0.00 O ATOM 2025 CB ASP A 130 135.533 -6.445 5.020 1.00 0.00 C ATOM 2026 CG ASP A 130 136.896 -5.850 5.380 1.00 0.00 C ATOM 2027 OD1 ASP A 130 137.880 -6.564 5.270 1.00 0.00 O ATOM 2028 OD2 ASP A 130 136.934 -4.692 5.760 1.00 0.00 O ATOM 0 H ASP A 130 134.099 -8.484 4.674 1.00 0.00 H new ATOM 0 HA ASP A 130 135.867 -7.566 6.813 1.00 0.00 H new ATOM 0 HB2 ASP A 130 135.618 -7.056 4.121 1.00 0.00 H new ATOM 0 HB3 ASP A 130 134.824 -5.647 4.798 1.00 0.00 H new ATOM 2033 N GLU A 131 132.737 -6.753 6.747 1.00 0.00 N ATOM 2034 CA GLU A 131 131.672 -6.031 7.489 1.00 0.00 C ATOM 2035 C GLU A 131 131.956 -6.117 8.987 1.00 0.00 C ATOM 2036 O GLU A 131 131.592 -5.250 9.745 1.00 0.00 O ATOM 2037 CB GLU A 131 130.317 -6.673 7.183 1.00 0.00 C ATOM 2038 CG GLU A 131 129.736 -6.074 5.899 1.00 0.00 C ATOM 2039 CD GLU A 131 128.749 -4.960 6.254 1.00 0.00 C ATOM 2040 OE1 GLU A 131 128.814 -4.472 7.370 1.00 0.00 O ATOM 2041 OE2 GLU A 131 127.947 -4.613 5.403 1.00 0.00 O ATOM 0 H GLU A 131 132.403 -7.433 6.064 1.00 0.00 H new ATOM 0 HA GLU A 131 131.653 -4.985 7.183 1.00 0.00 H new ATOM 0 HB2 GLU A 131 130.432 -7.751 7.072 1.00 0.00 H new ATOM 0 HB3 GLU A 131 129.631 -6.509 8.014 1.00 0.00 H new ATOM 0 HG2 GLU A 131 130.537 -5.679 5.275 1.00 0.00 H new ATOM 0 HG3 GLU A 131 129.233 -6.848 5.319 1.00 0.00 H new ATOM 2048 N LYS A 132 132.613 -7.151 9.424 1.00 0.00 N ATOM 2049 CA LYS A 132 132.920 -7.263 10.876 1.00 0.00 C ATOM 2050 C LYS A 132 133.901 -6.153 11.258 1.00 0.00 C ATOM 2051 O LYS A 132 133.656 -5.377 12.162 1.00 0.00 O ATOM 2052 CB LYS A 132 133.532 -8.633 11.155 1.00 0.00 C ATOM 2053 CG LYS A 132 132.784 -9.684 10.330 1.00 0.00 C ATOM 2054 CD LYS A 132 132.562 -10.940 11.171 1.00 0.00 C ATOM 2055 CE LYS A 132 132.160 -12.109 10.267 1.00 0.00 C ATOM 2056 NZ LYS A 132 133.025 -13.285 10.564 1.00 0.00 N ATOM 0 H LYS A 132 132.950 -7.920 8.844 1.00 0.00 H new ATOM 0 HA LYS A 132 132.010 -7.158 11.467 1.00 0.00 H new ATOM 0 HB2 LYS A 132 134.591 -8.633 10.896 1.00 0.00 H new ATOM 0 HB3 LYS A 132 133.463 -8.868 12.217 1.00 0.00 H new ATOM 0 HG2 LYS A 132 131.826 -9.284 9.997 1.00 0.00 H new ATOM 0 HG3 LYS A 132 133.355 -9.931 9.435 1.00 0.00 H new ATOM 0 HD2 LYS A 132 133.472 -11.188 11.717 1.00 0.00 H new ATOM 0 HD3 LYS A 132 131.784 -10.759 11.913 1.00 0.00 H new ATOM 0 HE2 LYS A 132 131.113 -12.364 10.428 1.00 0.00 H new ATOM 0 HE3 LYS A 132 132.261 -11.825 9.220 1.00 0.00 H new ATOM 0 HZ1 LYS A 132 132.753 -14.080 9.951 1.00 0.00 H new ATOM 0 HZ2 LYS A 132 134.020 -13.037 10.389 1.00 0.00 H new ATOM 0 HZ3 LYS A 132 132.907 -13.560 11.560 1.00 0.00 H new ATOM 2070 N SER A 133 135.001 -6.054 10.561 1.00 0.00 N ATOM 2071 CA SER A 133 135.981 -4.976 10.871 1.00 0.00 C ATOM 2072 C SER A 133 135.456 -3.663 10.285 1.00 0.00 C ATOM 2073 O SER A 133 135.583 -2.604 10.876 1.00 0.00 O ATOM 2074 CB SER A 133 137.333 -5.315 10.243 1.00 0.00 C ATOM 2075 OG SER A 133 137.707 -6.634 10.617 1.00 0.00 O ATOM 0 H SER A 133 135.262 -6.672 9.792 1.00 0.00 H new ATOM 0 HA SER A 133 136.107 -4.882 11.950 1.00 0.00 H new ATOM 0 HB2 SER A 133 137.273 -5.236 9.158 1.00 0.00 H new ATOM 0 HB3 SER A 133 138.089 -4.603 10.573 1.00 0.00 H new ATOM 0 HG SER A 133 138.573 -6.855 10.214 1.00 0.00 H new ATOM 2081 N ALA A 134 134.841 -3.731 9.134 1.00 0.00 N ATOM 2082 CA ALA A 134 134.284 -2.500 8.521 1.00 0.00 C ATOM 2083 C ALA A 134 133.234 -1.951 9.473 1.00 0.00 C ATOM 2084 O ALA A 134 133.174 -0.767 9.739 1.00 0.00 O ATOM 2085 CB ALA A 134 133.644 -2.833 7.171 1.00 0.00 C ATOM 0 H ALA A 134 134.703 -4.586 8.596 1.00 0.00 H new ATOM 0 HA ALA A 134 135.070 -1.764 8.352 1.00 0.00 H new ATOM 0 HB1 ALA A 134 133.237 -1.924 6.727 1.00 0.00 H new ATOM 0 HB2 ALA A 134 134.397 -3.256 6.506 1.00 0.00 H new ATOM 0 HB3 ALA A 134 132.841 -3.556 7.317 1.00 0.00 H new ATOM 2091 N VAL A 135 132.422 -2.815 10.017 1.00 0.00 N ATOM 2092 CA VAL A 135 131.400 -2.351 10.982 1.00 0.00 C ATOM 2093 C VAL A 135 132.132 -1.646 12.122 1.00 0.00 C ATOM 2094 O VAL A 135 131.652 -0.686 12.683 1.00 0.00 O ATOM 2095 CB VAL A 135 130.596 -3.545 11.503 1.00 0.00 C ATOM 2096 CG1 VAL A 135 129.886 -3.170 12.804 1.00 0.00 C ATOM 2097 CG2 VAL A 135 129.554 -3.936 10.451 1.00 0.00 C ATOM 0 H VAL A 135 132.426 -3.818 9.833 1.00 0.00 H new ATOM 0 HA VAL A 135 130.699 -1.664 10.509 1.00 0.00 H new ATOM 0 HB VAL A 135 131.269 -4.381 11.694 1.00 0.00 H new ATOM 0 HG11 VAL A 135 129.316 -4.025 13.167 1.00 0.00 H new ATOM 0 HG12 VAL A 135 130.625 -2.882 13.552 1.00 0.00 H new ATOM 0 HG13 VAL A 135 129.210 -2.335 12.622 1.00 0.00 H new ATOM 0 HG21 VAL A 135 128.975 -4.786 10.811 1.00 0.00 H new ATOM 0 HG22 VAL A 135 128.887 -3.093 10.269 1.00 0.00 H new ATOM 0 HG23 VAL A 135 130.058 -4.207 9.523 1.00 0.00 H new ATOM 2107 N ARG A 136 133.311 -2.102 12.453 1.00 0.00 N ATOM 2108 CA ARG A 136 134.084 -1.432 13.535 1.00 0.00 C ATOM 2109 C ARG A 136 134.133 0.065 13.234 1.00 0.00 C ATOM 2110 O ARG A 136 133.803 0.891 14.061 1.00 0.00 O ATOM 2111 CB ARG A 136 135.516 -1.976 13.566 1.00 0.00 C ATOM 2112 CG ARG A 136 136.106 -1.793 14.968 1.00 0.00 C ATOM 2113 CD ARG A 136 135.683 -2.959 15.866 1.00 0.00 C ATOM 2114 NE ARG A 136 136.317 -2.805 17.206 1.00 0.00 N ATOM 2115 CZ ARG A 136 135.785 -3.379 18.250 1.00 0.00 C ATOM 2116 NH1 ARG A 136 134.696 -4.086 18.123 1.00 0.00 N ATOM 2117 NH2 ARG A 136 136.343 -3.246 19.423 1.00 0.00 N ATOM 0 H ARG A 136 133.769 -2.905 12.023 1.00 0.00 H new ATOM 0 HA ARG A 136 133.607 -1.618 14.497 1.00 0.00 H new ATOM 0 HB2 ARG A 136 135.521 -3.031 13.294 1.00 0.00 H new ATOM 0 HB3 ARG A 136 136.130 -1.455 12.831 1.00 0.00 H new ATOM 0 HG2 ARG A 136 137.193 -1.742 14.911 1.00 0.00 H new ATOM 0 HG3 ARG A 136 135.765 -0.850 15.396 1.00 0.00 H new ATOM 0 HD2 ARG A 136 134.598 -2.981 15.965 1.00 0.00 H new ATOM 0 HD3 ARG A 136 135.982 -3.906 15.416 1.00 0.00 H new ATOM 0 HE ARG A 136 137.167 -2.251 17.307 1.00 0.00 H new ATOM 0 HH11 ARG A 136 134.260 -4.190 17.207 1.00 0.00 H new ATOM 0 HH12 ARG A 136 134.281 -4.534 18.940 1.00 0.00 H new ATOM 0 HH21 ARG A 136 137.195 -2.693 19.523 1.00 0.00 H new ATOM 0 HH22 ARG A 136 135.927 -3.695 20.239 1.00 0.00 H new ATOM 2131 N GLU A 137 134.550 0.415 12.047 1.00 0.00 N ATOM 2132 CA GLU A 137 134.632 1.856 11.675 1.00 0.00 C ATOM 2133 C GLU A 137 133.232 2.409 11.382 1.00 0.00 C ATOM 2134 O GLU A 137 132.970 3.579 11.570 1.00 0.00 O ATOM 2135 CB GLU A 137 135.507 2.009 10.429 1.00 0.00 C ATOM 2136 CG GLU A 137 136.623 0.963 10.456 1.00 0.00 C ATOM 2137 CD GLU A 137 137.764 1.408 9.540 1.00 0.00 C ATOM 2138 OE1 GLU A 137 137.920 2.604 9.359 1.00 0.00 O ATOM 2139 OE2 GLU A 137 138.461 0.545 9.033 1.00 0.00 O ATOM 0 H GLU A 137 134.838 -0.237 11.317 1.00 0.00 H new ATOM 0 HA GLU A 137 135.067 2.412 12.505 1.00 0.00 H new ATOM 0 HB2 GLU A 137 134.902 1.888 9.530 1.00 0.00 H new ATOM 0 HB3 GLU A 137 135.934 3.011 10.393 1.00 0.00 H new ATOM 0 HG2 GLU A 137 136.990 0.834 11.474 1.00 0.00 H new ATOM 0 HG3 GLU A 137 136.238 -0.003 10.131 1.00 0.00 H new ATOM 2146 N ILE A 138 132.332 1.585 10.913 1.00 0.00 N ATOM 2147 CA ILE A 138 130.960 2.085 10.604 1.00 0.00 C ATOM 2148 C ILE A 138 130.226 2.405 11.913 1.00 0.00 C ATOM 2149 O ILE A 138 129.750 3.502 12.116 1.00 0.00 O ATOM 2150 CB ILE A 138 130.201 1.012 9.798 1.00 0.00 C ATOM 2151 CG1 ILE A 138 129.559 1.653 8.562 1.00 0.00 C ATOM 2152 CG2 ILE A 138 129.104 0.361 10.651 1.00 0.00 C ATOM 2153 CD1 ILE A 138 130.579 1.723 7.420 1.00 0.00 C ATOM 0 H ILE A 138 132.486 0.593 10.731 1.00 0.00 H new ATOM 0 HA ILE A 138 131.017 2.996 10.009 1.00 0.00 H new ATOM 0 HB ILE A 138 130.914 0.245 9.495 1.00 0.00 H new ATOM 0 HG12 ILE A 138 128.691 1.072 8.250 1.00 0.00 H new ATOM 0 HG13 ILE A 138 129.203 2.654 8.805 1.00 0.00 H new ATOM 0 HG21 ILE A 138 128.583 -0.392 10.060 1.00 0.00 H new ATOM 0 HG22 ILE A 138 129.554 -0.110 11.525 1.00 0.00 H new ATOM 0 HG23 ILE A 138 128.395 1.123 10.975 1.00 0.00 H new ATOM 0 HD11 ILE A 138 130.115 2.180 6.546 1.00 0.00 H new ATOM 0 HD12 ILE A 138 131.434 2.323 7.732 1.00 0.00 H new ATOM 0 HD13 ILE A 138 130.914 0.717 7.169 1.00 0.00 H new ATOM 2165 N ALA A 139 130.139 1.457 12.801 1.00 0.00 N ATOM 2166 CA ALA A 139 129.449 1.698 14.096 1.00 0.00 C ATOM 2167 C ALA A 139 130.078 2.907 14.787 1.00 0.00 C ATOM 2168 O ALA A 139 129.396 3.815 15.218 1.00 0.00 O ATOM 2169 CB ALA A 139 129.612 0.464 14.986 1.00 0.00 C ATOM 0 H ALA A 139 130.520 0.518 12.684 1.00 0.00 H new ATOM 0 HA ALA A 139 128.390 1.889 13.920 1.00 0.00 H new ATOM 0 HB1 ALA A 139 129.109 0.633 15.938 1.00 0.00 H new ATOM 0 HB2 ALA A 139 129.172 -0.402 14.491 1.00 0.00 H new ATOM 0 HB3 ALA A 139 130.672 0.281 15.164 1.00 0.00 H new ATOM 2175 N ARG A 140 131.377 2.924 14.897 1.00 0.00 N ATOM 2176 CA ARG A 140 132.053 4.071 15.561 1.00 0.00 C ATOM 2177 C ARG A 140 131.864 5.331 14.714 1.00 0.00 C ATOM 2178 O ARG A 140 131.435 6.359 15.199 1.00 0.00 O ATOM 2179 CB ARG A 140 133.547 3.769 15.701 1.00 0.00 C ATOM 2180 CG ARG A 140 133.781 2.917 16.950 1.00 0.00 C ATOM 2181 CD ARG A 140 133.935 3.829 18.169 1.00 0.00 C ATOM 2182 NE ARG A 140 135.374 4.168 18.356 1.00 0.00 N ATOM 2183 CZ ARG A 140 136.189 3.290 18.874 1.00 0.00 C ATOM 2184 NH1 ARG A 140 135.744 2.115 19.227 1.00 0.00 N ATOM 2185 NH2 ARG A 140 137.449 3.586 19.038 1.00 0.00 N ATOM 0 H ARG A 140 132.000 2.192 14.555 1.00 0.00 H new ATOM 0 HA ARG A 140 131.620 4.228 16.549 1.00 0.00 H new ATOM 0 HB2 ARG A 140 133.907 3.243 14.817 1.00 0.00 H new ATOM 0 HB3 ARG A 140 134.112 4.699 15.771 1.00 0.00 H new ATOM 0 HG2 ARG A 140 132.946 2.233 17.098 1.00 0.00 H new ATOM 0 HG3 ARG A 140 134.675 2.306 16.824 1.00 0.00 H new ATOM 0 HD2 ARG A 140 133.351 4.739 18.032 1.00 0.00 H new ATOM 0 HD3 ARG A 140 133.548 3.333 19.059 1.00 0.00 H new ATOM 0 HE ARG A 140 135.722 5.086 18.079 1.00 0.00 H new ATOM 0 HH11 ARG A 140 134.759 1.883 19.098 1.00 0.00 H new ATOM 0 HH12 ARG A 140 136.381 1.429 19.632 1.00 0.00 H new ATOM 0 HH21 ARG A 140 137.797 4.504 18.761 1.00 0.00 H new ATOM 0 HH22 ARG A 140 138.086 2.900 19.443 1.00 0.00 H new ATOM 2199 N SER A 141 132.178 5.259 13.449 1.00 0.00 N ATOM 2200 CA SER A 141 132.012 6.453 12.573 1.00 0.00 C ATOM 2201 C SER A 141 130.602 7.015 12.755 1.00 0.00 C ATOM 2202 O SER A 141 130.412 8.205 12.907 1.00 0.00 O ATOM 2203 CB SER A 141 132.217 6.050 11.112 1.00 0.00 C ATOM 2204 OG SER A 141 133.573 5.674 10.915 1.00 0.00 O ATOM 0 H SER A 141 132.542 4.426 12.985 1.00 0.00 H new ATOM 0 HA SER A 141 132.748 7.211 12.843 1.00 0.00 H new ATOM 0 HB2 SER A 141 131.557 5.222 10.855 1.00 0.00 H new ATOM 0 HB3 SER A 141 131.958 6.880 10.454 1.00 0.00 H new ATOM 0 HG SER A 141 133.736 4.804 11.335 1.00 0.00 H new ATOM 2210 N LEU A 142 129.611 6.166 12.747 1.00 0.00 N ATOM 2211 CA LEU A 142 128.217 6.650 12.927 1.00 0.00 C ATOM 2212 C LEU A 142 127.875 6.630 14.420 1.00 0.00 C ATOM 2213 O LEU A 142 127.715 7.663 15.040 1.00 0.00 O ATOM 2214 CB LEU A 142 127.245 5.746 12.161 1.00 0.00 C ATOM 2215 CG LEU A 142 127.846 5.353 10.805 1.00 0.00 C ATOM 2216 CD1 LEU A 142 127.150 4.096 10.298 1.00 0.00 C ATOM 2217 CD2 LEU A 142 127.634 6.478 9.791 1.00 0.00 C ATOM 0 H LEU A 142 129.708 5.158 12.623 1.00 0.00 H new ATOM 0 HA LEU A 142 128.129 7.665 12.540 1.00 0.00 H new ATOM 0 HB2 LEU A 142 127.031 4.851 12.746 1.00 0.00 H new ATOM 0 HB3 LEU A 142 126.297 6.263 12.011 1.00 0.00 H new ATOM 0 HG LEU A 142 128.914 5.173 10.926 1.00 0.00 H new ATOM 0 HD11 LEU A 142 127.572 3.810 9.334 1.00 0.00 H new ATOM 0 HD12 LEU A 142 127.296 3.286 11.013 1.00 0.00 H new ATOM 0 HD13 LEU A 142 126.084 4.291 10.184 1.00 0.00 H new ATOM 0 HD21 LEU A 142 128.064 6.189 8.832 1.00 0.00 H new ATOM 0 HD22 LEU A 142 126.567 6.662 9.669 1.00 0.00 H new ATOM 0 HD23 LEU A 142 128.120 7.386 10.148 1.00 0.00 H new ATOM 2229 N GLY A 143 127.774 5.467 15.010 1.00 0.00 N ATOM 2230 CA GLY A 143 127.459 5.406 16.468 1.00 0.00 C ATOM 2231 C GLY A 143 126.731 4.102 16.816 1.00 0.00 C ATOM 2232 O GLY A 143 125.818 4.095 17.617 1.00 0.00 O ATOM 0 H GLY A 143 127.895 4.565 14.550 1.00 0.00 H new ATOM 0 HA2 GLY A 143 128.380 5.479 17.047 1.00 0.00 H new ATOM 0 HA3 GLY A 143 126.840 6.259 16.746 1.00 0.00 H new ATOM 2236 N PHE A 144 127.124 2.995 16.238 1.00 0.00 N ATOM 2237 CA PHE A 144 126.437 1.708 16.569 1.00 0.00 C ATOM 2238 C PHE A 144 127.346 0.842 17.449 1.00 0.00 C ATOM 2239 O PHE A 144 127.872 1.292 18.448 1.00 0.00 O ATOM 2240 CB PHE A 144 126.101 0.939 15.288 1.00 0.00 C ATOM 2241 CG PHE A 144 125.576 1.881 14.231 1.00 0.00 C ATOM 2242 CD1 PHE A 144 124.895 3.049 14.596 1.00 0.00 C ATOM 2243 CD2 PHE A 144 125.771 1.577 12.880 1.00 0.00 C ATOM 2244 CE1 PHE A 144 124.409 3.910 13.607 1.00 0.00 C ATOM 2245 CE2 PHE A 144 125.286 2.438 11.892 1.00 0.00 C ATOM 2246 CZ PHE A 144 124.604 3.606 12.255 1.00 0.00 C ATOM 0 H PHE A 144 127.882 2.925 15.559 1.00 0.00 H new ATOM 0 HA PHE A 144 125.515 1.937 17.104 1.00 0.00 H new ATOM 0 HB2 PHE A 144 126.990 0.428 14.919 1.00 0.00 H new ATOM 0 HB3 PHE A 144 125.357 0.171 15.502 1.00 0.00 H new ATOM 0 HD1 PHE A 144 124.745 3.284 15.639 1.00 0.00 H new ATOM 0 HD2 PHE A 144 126.297 0.676 12.600 1.00 0.00 H new ATOM 0 HE1 PHE A 144 123.883 4.811 13.887 1.00 0.00 H new ATOM 0 HE2 PHE A 144 125.437 2.203 10.849 1.00 0.00 H new ATOM 0 HZ PHE A 144 124.229 4.272 11.492 1.00 0.00 H new ATOM 2256 N ASP A 145 127.526 -0.402 17.087 1.00 0.00 N ATOM 2257 CA ASP A 145 128.390 -1.305 17.901 1.00 0.00 C ATOM 2258 C ASP A 145 129.664 -1.651 17.116 1.00 0.00 C ATOM 2259 O ASP A 145 129.600 -2.237 16.053 1.00 0.00 O ATOM 2260 CB ASP A 145 127.620 -2.594 18.207 1.00 0.00 C ATOM 2261 CG ASP A 145 127.554 -2.809 19.721 1.00 0.00 C ATOM 2262 OD1 ASP A 145 128.581 -3.122 20.301 1.00 0.00 O ATOM 2263 OD2 ASP A 145 126.477 -2.658 20.275 1.00 0.00 O ATOM 0 H ASP A 145 127.110 -0.831 16.260 1.00 0.00 H new ATOM 0 HA ASP A 145 128.664 -0.805 18.830 1.00 0.00 H new ATOM 0 HB2 ASP A 145 126.613 -2.534 17.794 1.00 0.00 H new ATOM 0 HB3 ASP A 145 128.110 -3.443 17.730 1.00 0.00 H new ATOM 2268 N PRO A 146 130.812 -1.298 17.637 1.00 0.00 N ATOM 2269 CA PRO A 146 132.117 -1.582 16.974 1.00 0.00 C ATOM 2270 C PRO A 146 132.240 -3.036 16.497 1.00 0.00 C ATOM 2271 O PRO A 146 132.380 -3.950 17.286 1.00 0.00 O ATOM 2272 CB PRO A 146 133.153 -1.298 18.063 1.00 0.00 C ATOM 2273 CG PRO A 146 132.500 -0.335 18.996 1.00 0.00 C ATOM 2274 CD PRO A 146 130.993 -0.583 18.912 1.00 0.00 C ATOM 0 HA PRO A 146 132.242 -0.976 16.077 1.00 0.00 H new ATOM 0 HB2 PRO A 146 133.438 -2.214 18.581 1.00 0.00 H new ATOM 0 HB3 PRO A 146 134.063 -0.876 17.638 1.00 0.00 H new ATOM 0 HG2 PRO A 146 132.859 -0.482 20.015 1.00 0.00 H new ATOM 0 HG3 PRO A 146 132.738 0.692 18.719 1.00 0.00 H new ATOM 0 HD2 PRO A 146 130.640 -1.177 19.755 1.00 0.00 H new ATOM 0 HD3 PRO A 146 130.434 0.353 18.926 1.00 0.00 H new ATOM 2282 N ALA A 147 132.198 -3.252 15.210 1.00 0.00 N ATOM 2283 CA ALA A 147 132.323 -4.637 14.669 1.00 0.00 C ATOM 2284 C ALA A 147 131.477 -5.600 15.486 1.00 0.00 C ATOM 2285 O ALA A 147 131.880 -6.062 16.535 1.00 0.00 O ATOM 2286 CB ALA A 147 133.779 -5.095 14.726 1.00 0.00 C ATOM 0 H ALA A 147 132.082 -2.524 14.505 1.00 0.00 H new ATOM 0 HA ALA A 147 131.978 -4.631 13.635 1.00 0.00 H new ATOM 0 HB1 ALA A 147 133.858 -6.107 14.329 1.00 0.00 H new ATOM 0 HB2 ALA A 147 134.396 -4.422 14.130 1.00 0.00 H new ATOM 0 HB3 ALA A 147 134.124 -5.083 15.760 1.00 0.00 H new ATOM 2292 N GLU A 148 130.315 -5.920 15.008 1.00 0.00 N ATOM 2293 CA GLU A 148 129.454 -6.870 15.754 1.00 0.00 C ATOM 2294 C GLU A 148 128.300 -7.330 14.861 1.00 0.00 C ATOM 2295 O GLU A 148 127.303 -7.831 15.343 1.00 0.00 O ATOM 2296 CB GLU A 148 128.893 -6.180 16.999 1.00 0.00 C ATOM 2297 CG GLU A 148 128.709 -7.210 18.115 1.00 0.00 C ATOM 2298 CD GLU A 148 127.960 -6.569 19.285 1.00 0.00 C ATOM 2299 OE1 GLU A 148 126.777 -6.310 19.135 1.00 0.00 O ATOM 2300 OE2 GLU A 148 128.582 -6.347 20.311 1.00 0.00 O ATOM 0 H GLU A 148 129.923 -5.567 14.135 1.00 0.00 H new ATOM 0 HA GLU A 148 130.046 -7.735 16.053 1.00 0.00 H new ATOM 0 HB2 GLU A 148 129.570 -5.391 17.326 1.00 0.00 H new ATOM 0 HB3 GLU A 148 127.939 -5.706 16.766 1.00 0.00 H new ATOM 0 HG2 GLU A 148 128.154 -8.070 17.742 1.00 0.00 H new ATOM 0 HG3 GLU A 148 129.680 -7.577 18.449 1.00 0.00 H new ATOM 2307 N PHE A 149 128.422 -7.179 13.563 1.00 0.00 N ATOM 2308 CA PHE A 149 127.319 -7.619 12.660 1.00 0.00 C ATOM 2309 C PHE A 149 127.869 -8.620 11.645 1.00 0.00 C ATOM 2310 O PHE A 149 127.713 -9.816 11.791 1.00 0.00 O ATOM 2311 CB PHE A 149 126.724 -6.418 11.911 1.00 0.00 C ATOM 2312 CG PHE A 149 126.660 -5.208 12.817 1.00 0.00 C ATOM 2313 CD1 PHE A 149 126.337 -5.352 14.171 1.00 0.00 C ATOM 2314 CD2 PHE A 149 126.929 -3.939 12.297 1.00 0.00 C ATOM 2315 CE1 PHE A 149 126.286 -4.227 15.003 1.00 0.00 C ATOM 2316 CE2 PHE A 149 126.877 -2.814 13.126 1.00 0.00 C ATOM 2317 CZ PHE A 149 126.557 -2.958 14.480 1.00 0.00 C ATOM 0 H PHE A 149 129.233 -6.773 13.096 1.00 0.00 H new ATOM 0 HA PHE A 149 126.537 -8.083 13.261 1.00 0.00 H new ATOM 0 HB2 PHE A 149 127.331 -6.192 11.034 1.00 0.00 H new ATOM 0 HB3 PHE A 149 125.725 -6.664 11.552 1.00 0.00 H new ATOM 0 HD1 PHE A 149 126.127 -6.332 14.574 1.00 0.00 H new ATOM 0 HD2 PHE A 149 127.178 -3.827 11.252 1.00 0.00 H new ATOM 0 HE1 PHE A 149 126.038 -4.339 16.048 1.00 0.00 H new ATOM 0 HE2 PHE A 149 127.084 -1.834 12.721 1.00 0.00 H new ATOM 0 HZ PHE A 149 126.519 -2.090 15.121 1.00 0.00 H new ATOM 2327 N GLY A 150 128.516 -8.141 10.619 1.00 0.00 N ATOM 2328 CA GLY A 150 129.079 -9.064 9.597 1.00 0.00 C ATOM 2329 C GLY A 150 127.939 -9.764 8.854 1.00 0.00 C ATOM 2330 O GLY A 150 127.989 -10.952 8.610 1.00 0.00 O ATOM 0 H GLY A 150 128.679 -7.149 10.445 1.00 0.00 H new ATOM 0 HA2 GLY A 150 129.699 -8.509 8.893 1.00 0.00 H new ATOM 0 HA3 GLY A 150 129.723 -9.803 10.075 1.00 0.00 H new