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 56 MET CE :methyl -174:sc= -5.27! (180deg=-5.27!) USER MOD Set 1.2: A 97 MET CE :methyl -176:sc= -0.795 (180deg=-0.811) USER MOD Set 2.1: A 21 GLN : amide:sc= 0.769 K(o=2,f=-4.9!) USER MOD Set 2.2: A 25 TYR OH : rot 71:sc= 1.27 USER MOD Set 3.1: A 12 THR OG1 : rot -178:sc= 0 USER MOD Set 3.2: A 31 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 8 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 13 SER OG : rot 11:sc= 0.23 USER MOD Single : A 19 THR OG1 : rot 78:sc= -4.65! USER MOD Single : A 26 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 27 ASN : amide:sc= -1.31! K(o=-1.3!,f=-0.18) USER MOD Single : A 28 LYS NZ :NH3+ -159:sc= 1.42 (180deg=0.404) USER MOD Single : A 29 LYS NZ :NH3+ -152:sc= -0.0899 (180deg=-0.579) USER MOD Single : A 32 GLN : amide:sc= -9.69! C(o=-9.7!,f=-12!) USER MOD Single : A 34 THR OG1 : rot 180:sc= 0 USER MOD Single : A 38 CYS SG : rot 57:sc= -0.998! USER MOD Single : A 45 SER OG : rot 137:sc= -5.23! USER MOD Single : A 49 SER OG : rot 111:sc= -5.46! USER MOD Single : A 50 SER OG : rot 180:sc= -0.311 USER MOD Single : A 53 LYS NZ :NH3+ 170:sc= -11.6! (180deg=-11.9!) USER MOD Single : A 54 GLN : amide:sc= -1.44! K(o=-1.4!,f=-0.047) USER MOD Single : A 55 LYS NZ :NH3+ -156:sc= -0.126 (180deg=-0.784) USER MOD Single : A 62 SER OG : rot 180:sc= -0.495 USER MOD Single : A 63 SER OG : rot -69:sc= -10.3! USER MOD Single : A 67 LYS NZ :NH3+ -164:sc= -5.57! (180deg=-7.36!) USER MOD Single : A 71 THR OG1 : rot -100:sc= -6.24! USER MOD Single : A 79 ASN : amide:sc= -6.36! C(o=-6.4!,f=-9.8!) 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 55:sc= -1.91! USER MOD Single : A 93 LYS NZ :NH3+ 146:sc= -12.8! (180deg=-13.5!) USER MOD Single : A 96 THR OG1 : rot -113:sc= -0.633! USER MOD Single : A 98 LYS NZ :NH3+ -163:sc= 0.0627 (180deg=0.037) USER MOD Single : A 99 TYR OH : rot -60:sc= -1.21 USER MOD Single : A 104 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 106 GLN : amide:sc= -0.985 K(o=-0.98,f=-0.013) USER MOD Single : A 111 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 122 LYS NZ :NH3+ 177:sc= 0 (180deg=-0.00848) USER MOD Single : A 123 SER OG : rot 180:sc= 0.1 USER MOD Single : A 126 ASN : amide:sc= -0.0973 K(o=-0.097,f=-0.99) USER MOD Single : A 132 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 133 SER OG : rot 180:sc= -0.0953 USER MOD Single : A 141 SER OG : rot 69:sc= 1.06 USER MOD ----------------------------------------------------------------- ATOM 105 N VAL A 7 113.597 3.788 -14.321 1.00 0.00 N ATOM 106 CA VAL A 7 113.781 4.988 -13.461 1.00 0.00 C ATOM 107 C VAL A 7 115.266 5.300 -13.295 1.00 0.00 C ATOM 108 O VAL A 7 115.686 6.434 -13.405 1.00 0.00 O ATOM 109 CB VAL A 7 113.179 4.713 -12.083 1.00 0.00 C ATOM 110 CG1 VAL A 7 111.814 4.044 -12.243 1.00 0.00 C ATOM 111 CG2 VAL A 7 114.110 3.785 -11.301 1.00 0.00 C ATOM 0 HA VAL A 7 113.286 5.838 -13.931 1.00 0.00 H new ATOM 0 HB VAL A 7 113.060 5.653 -11.545 1.00 0.00 H new ATOM 0 HG11 VAL A 7 111.387 3.849 -11.259 1.00 0.00 H new ATOM 0 HG12 VAL A 7 111.150 4.702 -12.803 1.00 0.00 H new ATOM 0 HG13 VAL A 7 111.931 3.103 -12.781 1.00 0.00 H new ATOM 0 HG21 VAL A 7 113.684 3.587 -10.318 1.00 0.00 H new ATOM 0 HG22 VAL A 7 114.226 2.846 -11.842 1.00 0.00 H new ATOM 0 HG23 VAL A 7 115.084 4.260 -11.185 1.00 0.00 H new ATOM 121 N LYS A 8 116.063 4.311 -13.000 1.00 0.00 N ATOM 122 CA LYS A 8 117.511 4.576 -12.793 1.00 0.00 C ATOM 123 C LYS A 8 117.647 5.613 -11.677 1.00 0.00 C ATOM 124 O LYS A 8 118.734 5.980 -11.277 1.00 0.00 O ATOM 125 CB LYS A 8 118.129 5.121 -14.081 1.00 0.00 C ATOM 126 CG LYS A 8 117.566 4.355 -15.280 1.00 0.00 C ATOM 127 CD LYS A 8 118.250 4.838 -16.561 1.00 0.00 C ATOM 128 CE LYS A 8 117.462 6.009 -17.151 1.00 0.00 C ATOM 129 NZ LYS A 8 118.118 6.465 -18.409 1.00 0.00 N ATOM 0 H LYS A 8 115.776 3.338 -12.894 1.00 0.00 H new ATOM 0 HA LYS A 8 118.028 3.656 -12.522 1.00 0.00 H new ATOM 0 HB2 LYS A 8 117.911 6.184 -14.180 1.00 0.00 H new ATOM 0 HB3 LYS A 8 119.214 5.020 -14.048 1.00 0.00 H new ATOM 0 HG2 LYS A 8 117.728 3.285 -15.150 1.00 0.00 H new ATOM 0 HG3 LYS A 8 116.489 4.508 -15.350 1.00 0.00 H new ATOM 0 HD2 LYS A 8 119.273 5.146 -16.345 1.00 0.00 H new ATOM 0 HD3 LYS A 8 118.308 4.024 -17.284 1.00 0.00 H new ATOM 0 HE2 LYS A 8 116.435 5.705 -17.353 1.00 0.00 H new ATOM 0 HE3 LYS A 8 117.417 6.829 -16.434 1.00 0.00 H new ATOM 0 HZ1 LYS A 8 117.583 7.261 -18.811 1.00 0.00 H new ATOM 0 HZ2 LYS A 8 119.090 6.771 -18.202 1.00 0.00 H new ATOM 0 HZ3 LYS A 8 118.139 5.682 -19.093 1.00 0.00 H new ATOM 143 N GLY A 9 116.535 6.084 -11.173 1.00 0.00 N ATOM 144 CA GLY A 9 116.566 7.096 -10.082 1.00 0.00 C ATOM 145 C GLY A 9 115.633 8.254 -10.432 1.00 0.00 C ATOM 146 O GLY A 9 116.048 9.249 -10.993 1.00 0.00 O ATOM 0 H GLY A 9 115.601 5.807 -11.475 1.00 0.00 H new ATOM 0 HA2 GLY A 9 116.259 6.640 -9.140 1.00 0.00 H new ATOM 0 HA3 GLY A 9 117.582 7.464 -9.942 1.00 0.00 H new ATOM 150 N ALA A 10 114.374 8.130 -10.102 1.00 0.00 N ATOM 151 CA ALA A 10 113.403 9.220 -10.412 1.00 0.00 C ATOM 152 C ALA A 10 112.002 8.621 -10.531 1.00 0.00 C ATOM 153 O ALA A 10 111.198 9.044 -11.337 1.00 0.00 O ATOM 154 CB ALA A 10 113.782 9.890 -11.736 1.00 0.00 C ATOM 0 H ALA A 10 113.976 7.318 -9.630 1.00 0.00 H new ATOM 0 HA ALA A 10 113.423 9.963 -9.615 1.00 0.00 H new ATOM 0 HB1 ALA A 10 113.070 10.685 -11.958 1.00 0.00 H new ATOM 0 HB2 ALA A 10 114.784 10.312 -11.657 1.00 0.00 H new ATOM 0 HB3 ALA A 10 113.762 9.151 -12.537 1.00 0.00 H new ATOM 160 N LEU A 11 111.709 7.631 -9.736 1.00 0.00 N ATOM 161 CA LEU A 11 110.368 6.992 -9.801 1.00 0.00 C ATOM 162 C LEU A 11 109.280 8.036 -9.546 1.00 0.00 C ATOM 163 O LEU A 11 109.552 9.213 -9.420 1.00 0.00 O ATOM 164 CB LEU A 11 110.285 5.883 -8.748 1.00 0.00 C ATOM 165 CG LEU A 11 110.053 6.483 -7.356 1.00 0.00 C ATOM 166 CD1 LEU A 11 110.308 5.407 -6.302 1.00 0.00 C ATOM 167 CD2 LEU A 11 111.014 7.648 -7.109 1.00 0.00 C ATOM 0 H LEU A 11 112.344 7.236 -9.042 1.00 0.00 H new ATOM 0 HA LEU A 11 110.218 6.564 -10.792 1.00 0.00 H new ATOM 0 HB2 LEU A 11 109.474 5.198 -8.995 1.00 0.00 H new ATOM 0 HB3 LEU A 11 111.206 5.300 -8.751 1.00 0.00 H new ATOM 0 HG LEU A 11 109.027 6.846 -7.295 1.00 0.00 H new ATOM 0 HD11 LEU A 11 110.145 5.825 -5.309 1.00 0.00 H new ATOM 0 HD12 LEU A 11 109.625 4.573 -6.461 1.00 0.00 H new ATOM 0 HD13 LEU A 11 111.336 5.054 -6.383 1.00 0.00 H new ATOM 0 HD21 LEU A 11 110.836 8.062 -6.117 1.00 0.00 H new ATOM 0 HD22 LEU A 11 112.042 7.292 -7.174 1.00 0.00 H new ATOM 0 HD23 LEU A 11 110.849 8.421 -7.860 1.00 0.00 H new ATOM 179 N THR A 12 108.050 7.614 -9.476 1.00 0.00 N ATOM 180 CA THR A 12 106.944 8.583 -9.233 1.00 0.00 C ATOM 181 C THR A 12 107.358 9.578 -8.145 1.00 0.00 C ATOM 182 O THR A 12 108.368 9.415 -7.490 1.00 0.00 O ATOM 183 CB THR A 12 105.693 7.825 -8.781 1.00 0.00 C ATOM 184 OG1 THR A 12 106.048 6.890 -7.771 1.00 0.00 O ATOM 185 CG2 THR A 12 105.083 7.085 -9.972 1.00 0.00 C ATOM 0 H THR A 12 107.761 6.641 -9.576 1.00 0.00 H new ATOM 0 HA THR A 12 106.730 9.125 -10.154 1.00 0.00 H new ATOM 0 HB THR A 12 104.964 8.531 -8.384 1.00 0.00 H new ATOM 0 HG1 THR A 12 105.254 6.382 -7.502 1.00 0.00 H new ATOM 0 HG21 THR A 12 104.193 6.546 -9.648 1.00 0.00 H new ATOM 0 HG22 THR A 12 104.811 7.803 -10.746 1.00 0.00 H new ATOM 0 HG23 THR A 12 105.810 6.378 -10.372 1.00 0.00 H new ATOM 193 N SER A 13 106.580 10.608 -7.949 1.00 0.00 N ATOM 194 CA SER A 13 106.914 11.621 -6.905 1.00 0.00 C ATOM 195 C SER A 13 106.975 10.946 -5.531 1.00 0.00 C ATOM 196 O SER A 13 107.046 11.600 -4.511 1.00 0.00 O ATOM 197 CB SER A 13 105.839 12.708 -6.889 1.00 0.00 C ATOM 198 OG SER A 13 105.848 13.359 -5.626 1.00 0.00 O ATOM 0 H SER A 13 105.723 10.793 -8.470 1.00 0.00 H new ATOM 0 HA SER A 13 107.882 12.067 -7.132 1.00 0.00 H new ATOM 0 HB2 SER A 13 106.024 13.430 -7.684 1.00 0.00 H new ATOM 0 HB3 SER A 13 104.859 12.269 -7.078 1.00 0.00 H new ATOM 0 HG SER A 13 106.641 13.083 -5.121 1.00 0.00 H new ATOM 204 N GLY A 14 106.932 9.644 -5.498 1.00 0.00 N ATOM 205 CA GLY A 14 106.971 8.923 -4.194 1.00 0.00 C ATOM 206 C GLY A 14 108.069 9.501 -3.296 1.00 0.00 C ATOM 207 O GLY A 14 107.965 9.482 -2.086 1.00 0.00 O ATOM 0 H GLY A 14 106.871 9.045 -6.321 1.00 0.00 H new ATOM 0 HA2 GLY A 14 106.005 9.006 -3.697 1.00 0.00 H new ATOM 0 HA3 GLY A 14 107.152 7.862 -4.363 1.00 0.00 H new ATOM 211 N ARG A 15 109.127 9.997 -3.870 1.00 0.00 N ATOM 212 CA ARG A 15 110.230 10.553 -3.034 1.00 0.00 C ATOM 213 C ARG A 15 109.726 11.717 -2.172 1.00 0.00 C ATOM 214 O ARG A 15 109.776 11.667 -0.959 1.00 0.00 O ATOM 215 CB ARG A 15 111.358 11.048 -3.943 1.00 0.00 C ATOM 216 CG ARG A 15 110.768 11.539 -5.267 1.00 0.00 C ATOM 217 CD ARG A 15 111.580 12.725 -5.795 1.00 0.00 C ATOM 218 NE ARG A 15 110.859 13.994 -5.493 1.00 0.00 N ATOM 219 CZ ARG A 15 111.288 15.122 -5.989 1.00 0.00 C ATOM 220 NH1 ARG A 15 112.351 15.140 -6.747 1.00 0.00 N ATOM 221 NH2 ARG A 15 110.656 16.233 -5.727 1.00 0.00 N ATOM 0 H ARG A 15 109.278 10.043 -4.878 1.00 0.00 H new ATOM 0 HA ARG A 15 110.598 9.765 -2.377 1.00 0.00 H new ATOM 0 HB2 ARG A 15 111.905 11.855 -3.455 1.00 0.00 H new ATOM 0 HB3 ARG A 15 112.071 10.244 -4.126 1.00 0.00 H new ATOM 0 HG2 ARG A 15 110.772 10.731 -5.998 1.00 0.00 H new ATOM 0 HG3 ARG A 15 109.729 11.834 -5.124 1.00 0.00 H new ATOM 0 HD2 ARG A 15 112.568 12.737 -5.335 1.00 0.00 H new ATOM 0 HD3 ARG A 15 111.731 12.627 -6.870 1.00 0.00 H new ATOM 0 HE ARG A 15 110.030 13.981 -4.899 1.00 0.00 H new ATOM 0 HH11 ARG A 15 112.846 14.272 -6.952 1.00 0.00 H new ATOM 0 HH12 ARG A 15 112.686 16.022 -7.135 1.00 0.00 H new ATOM 0 HH21 ARG A 15 109.826 16.220 -5.134 1.00 0.00 H new ATOM 0 HH22 ARG A 15 110.992 17.114 -6.115 1.00 0.00 H new ATOM 235 N GLU A 16 109.264 12.775 -2.783 1.00 0.00 N ATOM 236 CA GLU A 16 108.788 13.948 -1.988 1.00 0.00 C ATOM 237 C GLU A 16 107.347 13.736 -1.517 1.00 0.00 C ATOM 238 O GLU A 16 106.958 14.193 -0.462 1.00 0.00 O ATOM 239 CB GLU A 16 108.860 15.213 -2.857 1.00 0.00 C ATOM 240 CG GLU A 16 107.481 15.528 -3.446 1.00 0.00 C ATOM 241 CD GLU A 16 107.619 16.616 -4.512 1.00 0.00 C ATOM 242 OE1 GLU A 16 108.009 16.286 -5.620 1.00 0.00 O ATOM 243 OE2 GLU A 16 107.331 17.761 -4.202 1.00 0.00 O ATOM 0 H GLU A 16 109.195 12.879 -3.795 1.00 0.00 H new ATOM 0 HA GLU A 16 109.427 14.059 -1.112 1.00 0.00 H new ATOM 0 HB2 GLU A 16 109.209 16.055 -2.259 1.00 0.00 H new ATOM 0 HB3 GLU A 16 109.583 15.071 -3.660 1.00 0.00 H new ATOM 0 HG2 GLU A 16 107.046 14.629 -3.883 1.00 0.00 H new ATOM 0 HG3 GLU A 16 106.804 15.859 -2.658 1.00 0.00 H new ATOM 250 N GLU A 17 106.545 13.078 -2.302 1.00 0.00 N ATOM 251 CA GLU A 17 105.123 12.874 -1.911 1.00 0.00 C ATOM 252 C GLU A 17 104.994 11.817 -0.810 1.00 0.00 C ATOM 253 O GLU A 17 104.344 12.036 0.191 1.00 0.00 O ATOM 254 CB GLU A 17 104.326 12.422 -3.136 1.00 0.00 C ATOM 255 CG GLU A 17 102.920 12.000 -2.705 1.00 0.00 C ATOM 256 CD GLU A 17 101.942 12.227 -3.859 1.00 0.00 C ATOM 257 OE1 GLU A 17 102.039 13.262 -4.498 1.00 0.00 O ATOM 258 OE2 GLU A 17 101.112 11.362 -4.084 1.00 0.00 O ATOM 0 H GLU A 17 106.812 12.672 -3.199 1.00 0.00 H new ATOM 0 HA GLU A 17 104.734 13.817 -1.528 1.00 0.00 H new ATOM 0 HB2 GLU A 17 104.267 13.232 -3.863 1.00 0.00 H new ATOM 0 HB3 GLU A 17 104.832 11.590 -3.626 1.00 0.00 H new ATOM 0 HG2 GLU A 17 102.918 10.950 -2.414 1.00 0.00 H new ATOM 0 HG3 GLU A 17 102.608 12.574 -1.832 1.00 0.00 H new ATOM 265 N LEU A 18 105.570 10.663 -0.994 1.00 0.00 N ATOM 266 CA LEU A 18 105.423 9.599 0.040 1.00 0.00 C ATOM 267 C LEU A 18 106.329 9.852 1.252 1.00 0.00 C ATOM 268 O LEU A 18 105.970 9.517 2.362 1.00 0.00 O ATOM 269 CB LEU A 18 105.749 8.234 -0.577 1.00 0.00 C ATOM 270 CG LEU A 18 104.476 7.381 -0.629 1.00 0.00 C ATOM 271 CD1 LEU A 18 103.932 7.180 0.790 1.00 0.00 C ATOM 272 CD2 LEU A 18 103.421 8.091 -1.483 1.00 0.00 C ATOM 0 H LEU A 18 106.132 10.410 -1.807 1.00 0.00 H new ATOM 0 HA LEU A 18 104.391 9.613 0.390 1.00 0.00 H new ATOM 0 HB2 LEU A 18 106.154 8.364 -1.581 1.00 0.00 H new ATOM 0 HB3 LEU A 18 106.514 7.729 0.013 1.00 0.00 H new ATOM 0 HG LEU A 18 104.709 6.411 -1.068 1.00 0.00 H new ATOM 0 HD11 LEU A 18 103.027 6.573 0.750 1.00 0.00 H new ATOM 0 HD12 LEU A 18 104.681 6.674 1.399 1.00 0.00 H new ATOM 0 HD13 LEU A 18 103.700 8.149 1.231 1.00 0.00 H new ATOM 0 HD21 LEU A 18 102.516 7.485 -1.521 1.00 0.00 H new ATOM 0 HD22 LEU A 18 103.190 9.062 -1.044 1.00 0.00 H new ATOM 0 HD23 LEU A 18 103.805 8.232 -2.493 1.00 0.00 H new ATOM 284 N THR A 19 107.492 10.428 1.081 1.00 0.00 N ATOM 285 CA THR A 19 108.356 10.656 2.276 1.00 0.00 C ATOM 286 C THR A 19 107.742 11.766 3.123 1.00 0.00 C ATOM 287 O THR A 19 107.472 11.586 4.292 1.00 0.00 O ATOM 288 CB THR A 19 109.765 11.060 1.837 1.00 0.00 C ATOM 289 OG1 THR A 19 110.204 10.174 0.818 1.00 0.00 O ATOM 290 CG2 THR A 19 110.727 10.987 3.032 1.00 0.00 C ATOM 0 H THR A 19 107.873 10.743 0.189 1.00 0.00 H new ATOM 0 HA THR A 19 108.422 9.737 2.859 1.00 0.00 H new ATOM 0 HB THR A 19 109.749 12.082 1.458 1.00 0.00 H new ATOM 0 HG1 THR A 19 109.790 10.425 -0.034 1.00 0.00 H new ATOM 0 HG21 THR A 19 111.728 11.276 2.712 1.00 0.00 H new ATOM 0 HG22 THR A 19 110.387 11.665 3.815 1.00 0.00 H new ATOM 0 HG23 THR A 19 110.750 9.968 3.419 1.00 0.00 H new ATOM 298 N ARG A 20 107.502 12.905 2.536 1.00 0.00 N ATOM 299 CA ARG A 20 106.887 14.025 3.295 1.00 0.00 C ATOM 300 C ARG A 20 105.602 13.545 3.973 1.00 0.00 C ATOM 301 O ARG A 20 105.209 14.043 5.010 1.00 0.00 O ATOM 302 CB ARG A 20 106.540 15.154 2.329 1.00 0.00 C ATOM 303 CG ARG A 20 107.822 15.832 1.865 1.00 0.00 C ATOM 304 CD ARG A 20 107.511 16.791 0.714 1.00 0.00 C ATOM 305 NE ARG A 20 107.068 18.102 1.268 1.00 0.00 N ATOM 306 CZ ARG A 20 106.318 18.894 0.550 1.00 0.00 C ATOM 307 NH1 ARG A 20 105.956 18.537 -0.651 1.00 0.00 N ATOM 308 NH2 ARG A 20 105.932 20.042 1.035 1.00 0.00 N ATOM 0 H ARG A 20 107.707 13.108 1.558 1.00 0.00 H new ATOM 0 HA ARG A 20 107.590 14.377 4.049 1.00 0.00 H new ATOM 0 HB2 ARG A 20 105.993 14.760 1.472 1.00 0.00 H new ATOM 0 HB3 ARG A 20 105.888 15.878 2.817 1.00 0.00 H new ATOM 0 HG2 ARG A 20 108.277 16.377 2.692 1.00 0.00 H new ATOM 0 HG3 ARG A 20 108.545 15.083 1.542 1.00 0.00 H new ATOM 0 HD2 ARG A 20 108.395 16.927 0.091 1.00 0.00 H new ATOM 0 HD3 ARG A 20 106.733 16.371 0.077 1.00 0.00 H new ATOM 0 HE ARG A 20 107.351 18.380 2.208 1.00 0.00 H new ATOM 0 HH11 ARG A 20 106.259 17.639 -1.029 1.00 0.00 H new ATOM 0 HH12 ARG A 20 105.370 19.155 -1.212 1.00 0.00 H new ATOM 0 HH21 ARG A 20 106.216 20.320 1.974 1.00 0.00 H new ATOM 0 HH22 ARG A 20 105.346 20.661 0.475 1.00 0.00 H new ATOM 322 N GLN A 21 104.932 12.596 3.379 1.00 0.00 N ATOM 323 CA GLN A 21 103.656 12.096 3.964 1.00 0.00 C ATOM 324 C GLN A 21 103.920 11.136 5.129 1.00 0.00 C ATOM 325 O GLN A 21 103.050 10.897 5.941 1.00 0.00 O ATOM 326 CB GLN A 21 102.852 11.372 2.886 1.00 0.00 C ATOM 327 CG GLN A 21 102.395 12.380 1.830 1.00 0.00 C ATOM 328 CD GLN A 21 101.085 13.030 2.277 1.00 0.00 C ATOM 329 OE1 GLN A 21 100.424 12.540 3.171 1.00 0.00 O ATOM 330 NE2 GLN A 21 100.679 14.121 1.689 1.00 0.00 N ATOM 0 H GLN A 21 105.215 12.143 2.510 1.00 0.00 H new ATOM 0 HA GLN A 21 103.095 12.951 4.342 1.00 0.00 H new ATOM 0 HB2 GLN A 21 103.460 10.595 2.424 1.00 0.00 H new ATOM 0 HB3 GLN A 21 101.988 10.878 3.331 1.00 0.00 H new ATOM 0 HG2 GLN A 21 103.160 13.142 1.685 1.00 0.00 H new ATOM 0 HG3 GLN A 21 102.257 11.880 0.871 1.00 0.00 H new ATOM 0 HE21 GLN A 21 101.234 14.533 0.938 1.00 0.00 H new ATOM 0 HE22 GLN A 21 99.807 14.563 1.980 1.00 0.00 H new ATOM 339 N VAL A 22 105.091 10.566 5.221 1.00 0.00 N ATOM 340 CA VAL A 22 105.345 9.616 6.345 1.00 0.00 C ATOM 341 C VAL A 22 104.851 10.244 7.649 1.00 0.00 C ATOM 342 O VAL A 22 104.392 9.559 8.542 1.00 0.00 O ATOM 343 CB VAL A 22 106.842 9.304 6.461 1.00 0.00 C ATOM 344 CG1 VAL A 22 107.394 8.907 5.093 1.00 0.00 C ATOM 345 CG2 VAL A 22 107.591 10.536 6.977 1.00 0.00 C ATOM 0 H VAL A 22 105.871 10.712 4.580 1.00 0.00 H new ATOM 0 HA VAL A 22 104.812 8.685 6.151 1.00 0.00 H new ATOM 0 HB VAL A 22 106.981 8.479 7.160 1.00 0.00 H new ATOM 0 HG11 VAL A 22 108.458 8.686 5.180 1.00 0.00 H new ATOM 0 HG12 VAL A 22 106.868 8.023 4.731 1.00 0.00 H new ATOM 0 HG13 VAL A 22 107.250 9.728 4.390 1.00 0.00 H new ATOM 0 HG21 VAL A 22 108.654 10.308 7.057 1.00 0.00 H new ATOM 0 HG22 VAL A 22 107.449 11.365 6.284 1.00 0.00 H new ATOM 0 HG23 VAL A 22 107.204 10.813 7.958 1.00 0.00 H new ATOM 355 N GLY A 23 104.921 11.542 7.765 1.00 0.00 N ATOM 356 CA GLY A 23 104.431 12.197 9.010 1.00 0.00 C ATOM 357 C GLY A 23 102.980 11.776 9.237 1.00 0.00 C ATOM 358 O GLY A 23 102.427 11.948 10.305 1.00 0.00 O ATOM 0 H GLY A 23 105.294 12.174 7.056 1.00 0.00 H new ATOM 0 HA2 GLY A 23 105.048 11.905 9.860 1.00 0.00 H new ATOM 0 HA3 GLY A 23 104.502 13.281 8.921 1.00 0.00 H new ATOM 362 N ARG A 24 102.367 11.216 8.230 1.00 0.00 N ATOM 363 CA ARG A 24 100.955 10.766 8.361 1.00 0.00 C ATOM 364 C ARG A 24 100.910 9.240 8.270 1.00 0.00 C ATOM 365 O ARG A 24 100.213 8.584 9.019 1.00 0.00 O ATOM 366 CB ARG A 24 100.119 11.371 7.231 1.00 0.00 C ATOM 367 CG ARG A 24 99.652 12.770 7.635 1.00 0.00 C ATOM 368 CD ARG A 24 98.306 12.671 8.356 1.00 0.00 C ATOM 369 NE ARG A 24 98.079 13.907 9.156 1.00 0.00 N ATOM 370 CZ ARG A 24 97.660 14.996 8.571 1.00 0.00 C ATOM 371 NH1 ARG A 24 97.441 15.002 7.284 1.00 0.00 N ATOM 372 NH2 ARG A 24 97.460 16.078 9.272 1.00 0.00 N ATOM 0 H ARG A 24 102.788 11.050 7.316 1.00 0.00 H new ATOM 0 HA ARG A 24 100.551 11.091 9.320 1.00 0.00 H new ATOM 0 HB2 ARG A 24 100.709 11.423 6.316 1.00 0.00 H new ATOM 0 HB3 ARG A 24 99.259 10.736 7.020 1.00 0.00 H new ATOM 0 HG2 ARG A 24 100.391 13.238 8.285 1.00 0.00 H new ATOM 0 HG3 ARG A 24 99.558 13.403 6.752 1.00 0.00 H new ATOM 0 HD2 ARG A 24 97.502 12.541 7.632 1.00 0.00 H new ATOM 0 HD3 ARG A 24 98.293 11.796 9.007 1.00 0.00 H new ATOM 0 HE ARG A 24 98.251 13.902 10.161 1.00 0.00 H new ATOM 0 HH11 ARG A 24 97.597 14.156 6.736 1.00 0.00 H new ATOM 0 HH12 ARG A 24 97.114 15.853 6.826 1.00 0.00 H new ATOM 0 HH21 ARG A 24 97.631 16.073 10.278 1.00 0.00 H new ATOM 0 HH22 ARG A 24 97.133 16.929 8.815 1.00 0.00 H new ATOM 386 N TYR A 25 101.653 8.668 7.360 1.00 0.00 N ATOM 387 CA TYR A 25 101.657 7.184 7.226 1.00 0.00 C ATOM 388 C TYR A 25 102.832 6.607 8.015 1.00 0.00 C ATOM 389 O TYR A 25 102.774 5.498 8.508 1.00 0.00 O ATOM 390 CB TYR A 25 101.803 6.791 5.753 1.00 0.00 C ATOM 391 CG TYR A 25 101.057 7.770 4.877 1.00 0.00 C ATOM 392 CD1 TYR A 25 99.939 8.450 5.375 1.00 0.00 C ATOM 393 CD2 TYR A 25 101.484 7.994 3.562 1.00 0.00 C ATOM 394 CE1 TYR A 25 99.250 9.355 4.560 1.00 0.00 C ATOM 395 CE2 TYR A 25 100.795 8.898 2.748 1.00 0.00 C ATOM 396 CZ TYR A 25 99.678 9.580 3.246 1.00 0.00 C ATOM 397 OH TYR A 25 98.998 10.472 2.442 1.00 0.00 O ATOM 0 H TYR A 25 102.256 9.165 6.705 1.00 0.00 H new ATOM 0 HA TYR A 25 100.718 6.790 7.614 1.00 0.00 H new ATOM 0 HB2 TYR A 25 102.857 6.774 5.476 1.00 0.00 H new ATOM 0 HB3 TYR A 25 101.416 5.784 5.597 1.00 0.00 H new ATOM 0 HD1 TYR A 25 99.608 8.276 6.388 1.00 0.00 H new ATOM 0 HD2 TYR A 25 102.345 7.468 3.177 1.00 0.00 H new ATOM 0 HE1 TYR A 25 98.388 9.880 4.945 1.00 0.00 H new ATOM 0 HE2 TYR A 25 101.125 9.071 1.734 1.00 0.00 H new ATOM 0 HH TYR A 25 99.168 11.386 2.751 1.00 0.00 H new ATOM 407 N LYS A 26 103.904 7.344 8.135 1.00 0.00 N ATOM 408 CA LYS A 26 105.078 6.821 8.886 1.00 0.00 C ATOM 409 C LYS A 26 105.564 5.535 8.216 1.00 0.00 C ATOM 410 O LYS A 26 106.542 4.940 8.624 1.00 0.00 O ATOM 411 CB LYS A 26 104.670 6.523 10.331 1.00 0.00 C ATOM 412 CG LYS A 26 103.817 7.674 10.868 1.00 0.00 C ATOM 413 CD LYS A 26 103.536 7.449 12.355 1.00 0.00 C ATOM 414 CE LYS A 26 102.607 8.550 12.872 1.00 0.00 C ATOM 415 NZ LYS A 26 102.849 8.760 14.327 1.00 0.00 N ATOM 0 H LYS A 26 104.016 8.281 7.747 1.00 0.00 H new ATOM 0 HA LYS A 26 105.877 7.562 8.885 1.00 0.00 H new ATOM 0 HB2 LYS A 26 104.110 5.589 10.377 1.00 0.00 H new ATOM 0 HB3 LYS A 26 105.557 6.393 10.951 1.00 0.00 H new ATOM 0 HG2 LYS A 26 104.335 8.622 10.724 1.00 0.00 H new ATOM 0 HG3 LYS A 26 102.880 7.735 10.315 1.00 0.00 H new ATOM 0 HD2 LYS A 26 103.078 6.472 12.505 1.00 0.00 H new ATOM 0 HD3 LYS A 26 104.470 7.453 12.917 1.00 0.00 H new ATOM 0 HE2 LYS A 26 102.784 9.476 12.325 1.00 0.00 H new ATOM 0 HE3 LYS A 26 101.567 8.273 12.702 1.00 0.00 H new ATOM 0 HZ1 LYS A 26 102.218 9.508 14.679 1.00 0.00 H new ATOM 0 HZ2 LYS A 26 102.659 7.876 14.842 1.00 0.00 H new ATOM 0 HZ3 LYS A 26 103.839 9.042 14.477 1.00 0.00 H new ATOM 429 N ASN A 27 104.886 5.103 7.188 1.00 0.00 N ATOM 430 CA ASN A 27 105.303 3.857 6.487 1.00 0.00 C ATOM 431 C ASN A 27 106.418 4.185 5.493 1.00 0.00 C ATOM 432 O ASN A 27 106.480 5.268 4.950 1.00 0.00 O ATOM 433 CB ASN A 27 104.107 3.268 5.737 1.00 0.00 C ATOM 434 CG ASN A 27 103.276 2.410 6.694 1.00 0.00 C ATOM 435 OD1 ASN A 27 102.063 2.418 6.638 1.00 0.00 O ATOM 436 ND2 ASN A 27 103.883 1.664 7.576 1.00 0.00 N ATOM 0 H ASN A 27 104.060 5.561 6.803 1.00 0.00 H new ATOM 0 HA ASN A 27 105.665 3.132 7.216 1.00 0.00 H new ATOM 0 HB2 ASN A 27 103.494 4.068 5.324 1.00 0.00 H new ATOM 0 HB3 ASN A 27 104.452 2.665 4.897 1.00 0.00 H new ATOM 0 HD21 ASN A 27 103.339 1.088 8.218 1.00 0.00 H new ATOM 0 HD22 ASN A 27 104.902 1.657 7.623 1.00 0.00 H new ATOM 443 N LYS A 28 107.301 3.255 5.256 1.00 0.00 N ATOM 444 CA LYS A 28 108.420 3.504 4.303 1.00 0.00 C ATOM 445 C LYS A 28 108.507 2.330 3.321 1.00 0.00 C ATOM 446 O LYS A 28 108.707 2.497 2.127 1.00 0.00 O ATOM 447 CB LYS A 28 109.729 3.605 5.084 1.00 0.00 C ATOM 448 CG LYS A 28 109.494 4.343 6.409 1.00 0.00 C ATOM 449 CD LYS A 28 109.269 5.832 6.140 1.00 0.00 C ATOM 450 CE LYS A 28 109.658 6.638 7.381 1.00 0.00 C ATOM 451 NZ LYS A 28 109.139 5.954 8.599 1.00 0.00 N ATOM 0 H LYS A 28 107.296 2.329 5.683 1.00 0.00 H new ATOM 0 HA LYS A 28 108.246 4.431 3.757 1.00 0.00 H new ATOM 0 HB2 LYS A 28 110.124 2.608 5.279 1.00 0.00 H new ATOM 0 HB3 LYS A 28 110.476 4.133 4.491 1.00 0.00 H new ATOM 0 HG2 LYS A 28 108.629 3.922 6.922 1.00 0.00 H new ATOM 0 HG3 LYS A 28 110.352 4.209 7.068 1.00 0.00 H new ATOM 0 HD2 LYS A 28 109.863 6.152 5.284 1.00 0.00 H new ATOM 0 HD3 LYS A 28 108.224 6.013 5.888 1.00 0.00 H new ATOM 0 HE2 LYS A 28 110.742 6.736 7.440 1.00 0.00 H new ATOM 0 HE3 LYS A 28 109.250 7.647 7.315 1.00 0.00 H new ATOM 0 HZ1 LYS A 28 109.078 6.637 9.381 1.00 0.00 H new ATOM 0 HZ2 LYS A 28 108.194 5.566 8.403 1.00 0.00 H new ATOM 0 HZ3 LYS A 28 109.782 5.181 8.864 1.00 0.00 H new ATOM 465 N LYS A 29 108.358 1.138 3.828 1.00 0.00 N ATOM 466 CA LYS A 29 108.425 -0.070 2.961 1.00 0.00 C ATOM 467 C LYS A 29 107.160 -0.152 2.108 1.00 0.00 C ATOM 468 O LYS A 29 106.972 -1.065 1.333 1.00 0.00 O ATOM 469 CB LYS A 29 108.516 -1.315 3.845 1.00 0.00 C ATOM 470 CG LYS A 29 107.609 -1.158 5.067 1.00 0.00 C ATOM 471 CD LYS A 29 106.150 -1.062 4.616 1.00 0.00 C ATOM 472 CE LYS A 29 105.236 -1.568 5.734 1.00 0.00 C ATOM 473 NZ LYS A 29 105.391 -3.044 5.871 1.00 0.00 N ATOM 0 H LYS A 29 108.191 0.948 4.816 1.00 0.00 H new ATOM 0 HA LYS A 29 109.300 -0.010 2.313 1.00 0.00 H new ATOM 0 HB2 LYS A 29 108.223 -2.197 3.276 1.00 0.00 H new ATOM 0 HB3 LYS A 29 109.547 -1.469 4.164 1.00 0.00 H new ATOM 0 HG2 LYS A 29 107.737 -2.007 5.739 1.00 0.00 H new ATOM 0 HG3 LYS A 29 107.887 -0.264 5.626 1.00 0.00 H new ATOM 0 HD2 LYS A 29 105.902 -0.030 4.368 1.00 0.00 H new ATOM 0 HD3 LYS A 29 105.998 -1.652 3.712 1.00 0.00 H new ATOM 0 HE2 LYS A 29 105.487 -1.076 6.674 1.00 0.00 H new ATOM 0 HE3 LYS A 29 104.198 -1.319 5.511 1.00 0.00 H new ATOM 0 HZ1 LYS A 29 104.509 -3.453 6.240 1.00 0.00 H new ATOM 0 HZ2 LYS A 29 105.602 -3.459 4.941 1.00 0.00 H new ATOM 0 HZ3 LYS A 29 106.170 -3.252 6.528 1.00 0.00 H new ATOM 487 N PHE A 30 106.286 0.790 2.266 1.00 0.00 N ATOM 488 CA PHE A 30 105.012 0.770 1.492 1.00 0.00 C ATOM 489 C PHE A 30 105.264 1.035 0.000 1.00 0.00 C ATOM 490 O PHE A 30 105.238 0.138 -0.821 1.00 0.00 O ATOM 491 CB PHE A 30 104.167 1.919 2.034 1.00 0.00 C ATOM 492 CG PHE A 30 105.031 3.177 2.156 1.00 0.00 C ATOM 493 CD1 PHE A 30 106.362 3.205 1.674 1.00 0.00 C ATOM 494 CD2 PHE A 30 104.495 4.329 2.742 1.00 0.00 C ATOM 495 CE1 PHE A 30 107.125 4.370 1.781 1.00 0.00 C ATOM 496 CE2 PHE A 30 105.271 5.492 2.851 1.00 0.00 C ATOM 497 CZ PHE A 30 106.584 5.510 2.369 1.00 0.00 C ATOM 0 H PHE A 30 106.394 1.581 2.901 1.00 0.00 H new ATOM 0 HA PHE A 30 104.531 -0.203 1.592 1.00 0.00 H new ATOM 0 HB2 PHE A 30 103.323 2.108 1.371 1.00 0.00 H new ATOM 0 HB3 PHE A 30 103.754 1.653 3.007 1.00 0.00 H new ATOM 0 HD1 PHE A 30 106.789 2.322 1.222 1.00 0.00 H new ATOM 0 HD2 PHE A 30 103.480 4.323 3.112 1.00 0.00 H new ATOM 0 HE1 PHE A 30 108.138 4.386 1.406 1.00 0.00 H new ATOM 0 HE2 PHE A 30 104.853 6.377 3.309 1.00 0.00 H new ATOM 0 HZ PHE A 30 107.178 6.408 2.453 1.00 0.00 H new ATOM 507 N MET A 31 105.549 2.262 -0.336 1.00 0.00 N ATOM 508 CA MET A 31 105.850 2.631 -1.738 1.00 0.00 C ATOM 509 C MET A 31 107.298 2.272 -2.045 1.00 0.00 C ATOM 510 O MET A 31 107.613 1.688 -3.062 1.00 0.00 O ATOM 511 CB MET A 31 105.653 4.138 -1.911 1.00 0.00 C ATOM 512 CG MET A 31 106.374 4.610 -3.174 1.00 0.00 C ATOM 513 SD MET A 31 105.963 3.511 -4.551 1.00 0.00 S ATOM 514 CE MET A 31 104.637 4.519 -5.259 1.00 0.00 C ATOM 0 H MET A 31 105.585 3.040 0.323 1.00 0.00 H new ATOM 0 HA MET A 31 105.186 2.094 -2.416 1.00 0.00 H new ATOM 0 HB2 MET A 31 104.590 4.370 -1.979 1.00 0.00 H new ATOM 0 HB3 MET A 31 106.040 4.667 -1.040 1.00 0.00 H new ATOM 0 HG2 MET A 31 106.082 5.633 -3.412 1.00 0.00 H new ATOM 0 HG3 MET A 31 107.451 4.617 -3.009 1.00 0.00 H new ATOM 0 HE1 MET A 31 104.231 4.020 -6.139 1.00 0.00 H new ATOM 0 HE2 MET A 31 103.847 4.652 -4.520 1.00 0.00 H new ATOM 0 HE3 MET A 31 105.034 5.493 -5.545 1.00 0.00 H new ATOM 524 N GLN A 32 108.187 2.651 -1.166 1.00 0.00 N ATOM 525 CA GLN A 32 109.624 2.375 -1.388 1.00 0.00 C ATOM 526 C GLN A 32 109.917 0.888 -1.152 1.00 0.00 C ATOM 527 O GLN A 32 110.813 0.324 -1.743 1.00 0.00 O ATOM 528 CB GLN A 32 110.443 3.257 -0.446 1.00 0.00 C ATOM 529 CG GLN A 32 110.061 4.722 -0.670 1.00 0.00 C ATOM 530 CD GLN A 32 110.703 5.590 0.414 1.00 0.00 C ATOM 531 OE1 GLN A 32 110.117 6.555 0.862 1.00 0.00 O ATOM 532 NE2 GLN A 32 111.893 5.286 0.856 1.00 0.00 N ATOM 0 H GLN A 32 107.971 3.143 -0.299 1.00 0.00 H new ATOM 0 HA GLN A 32 109.897 2.605 -2.418 1.00 0.00 H new ATOM 0 HB2 GLN A 32 110.257 2.974 0.590 1.00 0.00 H new ATOM 0 HB3 GLN A 32 111.508 3.114 -0.629 1.00 0.00 H new ATOM 0 HG2 GLN A 32 110.393 5.048 -1.656 1.00 0.00 H new ATOM 0 HG3 GLN A 32 108.977 4.834 -0.645 1.00 0.00 H new ATOM 0 HE21 GLN A 32 112.385 4.476 0.480 1.00 0.00 H new ATOM 0 HE22 GLN A 32 112.331 5.859 1.578 1.00 0.00 H new ATOM 541 N GLY A 33 109.177 0.238 -0.296 1.00 0.00 N ATOM 542 CA GLY A 33 109.444 -1.209 -0.062 1.00 0.00 C ATOM 543 C GLY A 33 109.013 -1.987 -1.303 1.00 0.00 C ATOM 544 O GLY A 33 109.706 -2.871 -1.768 1.00 0.00 O ATOM 0 H GLY A 33 108.410 0.639 0.244 1.00 0.00 H new ATOM 0 HA2 GLY A 33 110.503 -1.371 0.138 1.00 0.00 H new ATOM 0 HA3 GLY A 33 108.897 -1.559 0.813 1.00 0.00 H new ATOM 548 N THR A 34 107.876 -1.654 -1.852 1.00 0.00 N ATOM 549 CA THR A 34 107.406 -2.366 -3.071 1.00 0.00 C ATOM 550 C THR A 34 108.265 -1.938 -4.264 1.00 0.00 C ATOM 551 O THR A 34 108.406 -2.664 -5.228 1.00 0.00 O ATOM 552 CB THR A 34 105.939 -2.019 -3.341 1.00 0.00 C ATOM 553 OG1 THR A 34 105.464 -2.797 -4.431 1.00 0.00 O ATOM 554 CG2 THR A 34 105.812 -0.534 -3.680 1.00 0.00 C ATOM 0 H THR A 34 107.255 -0.921 -1.509 1.00 0.00 H new ATOM 0 HA THR A 34 107.495 -3.442 -2.922 1.00 0.00 H new ATOM 0 HB THR A 34 105.347 -2.235 -2.451 1.00 0.00 H new ATOM 0 HG1 THR A 34 104.525 -2.578 -4.605 1.00 0.00 H new ATOM 0 HG21 THR A 34 104.766 -0.293 -3.871 1.00 0.00 H new ATOM 0 HG22 THR A 34 106.175 0.063 -2.843 1.00 0.00 H new ATOM 0 HG23 THR A 34 106.404 -0.312 -4.568 1.00 0.00 H new ATOM 562 N VAL A 35 108.849 -0.769 -4.206 1.00 0.00 N ATOM 563 CA VAL A 35 109.703 -0.311 -5.338 1.00 0.00 C ATOM 564 C VAL A 35 111.043 -1.053 -5.278 1.00 0.00 C ATOM 565 O VAL A 35 111.476 -1.648 -6.244 1.00 0.00 O ATOM 566 CB VAL A 35 109.916 1.208 -5.246 1.00 0.00 C ATOM 567 CG1 VAL A 35 111.155 1.518 -4.408 1.00 0.00 C ATOM 568 CG2 VAL A 35 110.099 1.790 -6.649 1.00 0.00 C ATOM 0 H VAL A 35 108.771 -0.116 -3.427 1.00 0.00 H new ATOM 0 HA VAL A 35 109.216 -0.529 -6.289 1.00 0.00 H new ATOM 0 HB VAL A 35 109.042 1.655 -4.773 1.00 0.00 H new ATOM 0 HG11 VAL A 35 111.295 2.597 -4.351 1.00 0.00 H new ATOM 0 HG12 VAL A 35 111.025 1.115 -3.404 1.00 0.00 H new ATOM 0 HG13 VAL A 35 112.031 1.063 -4.871 1.00 0.00 H new ATOM 0 HG21 VAL A 35 110.250 2.867 -6.579 1.00 0.00 H new ATOM 0 HG22 VAL A 35 110.967 1.332 -7.122 1.00 0.00 H new ATOM 0 HG23 VAL A 35 109.210 1.586 -7.246 1.00 0.00 H new ATOM 578 N ALA A 36 111.695 -1.044 -4.144 1.00 0.00 N ATOM 579 CA ALA A 36 112.986 -1.770 -4.023 1.00 0.00 C ATOM 580 C ALA A 36 112.800 -3.172 -4.598 1.00 0.00 C ATOM 581 O ALA A 36 113.584 -3.640 -5.399 1.00 0.00 O ATOM 582 CB ALA A 36 113.377 -1.867 -2.544 1.00 0.00 C ATOM 0 H ALA A 36 111.386 -0.564 -3.299 1.00 0.00 H new ATOM 0 HA ALA A 36 113.772 -1.243 -4.564 1.00 0.00 H new ATOM 0 HB1 ALA A 36 114.324 -2.399 -2.452 1.00 0.00 H new ATOM 0 HB2 ALA A 36 113.482 -0.865 -2.129 1.00 0.00 H new ATOM 0 HB3 ALA A 36 112.603 -2.406 -1.998 1.00 0.00 H new ATOM 588 N VAL A 37 111.752 -3.838 -4.199 1.00 0.00 N ATOM 589 CA VAL A 37 111.493 -5.204 -4.725 1.00 0.00 C ATOM 590 C VAL A 37 111.420 -5.137 -6.248 1.00 0.00 C ATOM 591 O VAL A 37 111.967 -5.973 -6.946 1.00 0.00 O ATOM 592 CB VAL A 37 110.166 -5.723 -4.168 1.00 0.00 C ATOM 593 CG1 VAL A 37 110.051 -7.223 -4.443 1.00 0.00 C ATOM 594 CG2 VAL A 37 110.106 -5.471 -2.656 1.00 0.00 C ATOM 0 H VAL A 37 111.064 -3.493 -3.530 1.00 0.00 H new ATOM 0 HA VAL A 37 112.294 -5.878 -4.422 1.00 0.00 H new ATOM 0 HB VAL A 37 109.341 -5.200 -4.652 1.00 0.00 H new ATOM 0 HG11 VAL A 37 109.106 -7.594 -4.047 1.00 0.00 H new ATOM 0 HG12 VAL A 37 110.088 -7.400 -5.518 1.00 0.00 H new ATOM 0 HG13 VAL A 37 110.877 -7.746 -3.961 1.00 0.00 H new ATOM 0 HG21 VAL A 37 109.160 -5.842 -2.263 1.00 0.00 H new ATOM 0 HG22 VAL A 37 110.930 -5.990 -2.168 1.00 0.00 H new ATOM 0 HG23 VAL A 37 110.185 -4.401 -2.462 1.00 0.00 H new ATOM 604 N CYS A 38 110.764 -4.136 -6.774 1.00 0.00 N ATOM 605 CA CYS A 38 110.682 -4.015 -8.251 1.00 0.00 C ATOM 606 C CYS A 38 112.100 -4.105 -8.799 1.00 0.00 C ATOM 607 O CYS A 38 112.332 -4.566 -9.897 1.00 0.00 O ATOM 608 CB CYS A 38 110.063 -2.668 -8.633 1.00 0.00 C ATOM 609 SG CYS A 38 108.460 -2.486 -7.813 1.00 0.00 S ATOM 0 H CYS A 38 110.287 -3.405 -6.246 1.00 0.00 H new ATOM 0 HA CYS A 38 110.058 -4.807 -8.664 1.00 0.00 H new ATOM 0 HB2 CYS A 38 110.727 -1.855 -8.341 1.00 0.00 H new ATOM 0 HB3 CYS A 38 109.939 -2.606 -9.714 1.00 0.00 H new ATOM 0 HG CYS A 38 108.614 -2.604 -6.528 1.00 0.00 H new ATOM 615 N ALA A 39 113.059 -3.672 -8.032 1.00 0.00 N ATOM 616 CA ALA A 39 114.463 -3.752 -8.495 1.00 0.00 C ATOM 617 C ALA A 39 114.983 -5.181 -8.301 1.00 0.00 C ATOM 618 O ALA A 39 115.623 -5.748 -9.163 1.00 0.00 O ATOM 619 CB ALA A 39 115.321 -2.783 -7.688 1.00 0.00 C ATOM 0 H ALA A 39 112.928 -3.267 -7.105 1.00 0.00 H new ATOM 0 HA ALA A 39 114.514 -3.487 -9.551 1.00 0.00 H new ATOM 0 HB1 ALA A 39 116.355 -2.842 -8.029 1.00 0.00 H new ATOM 0 HB2 ALA A 39 114.951 -1.767 -7.826 1.00 0.00 H new ATOM 0 HB3 ALA A 39 115.272 -3.047 -6.631 1.00 0.00 H new ATOM 625 N ARG A 40 114.726 -5.753 -7.156 1.00 0.00 N ATOM 626 CA ARG A 40 115.222 -7.129 -6.864 1.00 0.00 C ATOM 627 C ARG A 40 115.083 -8.029 -8.094 1.00 0.00 C ATOM 628 O ARG A 40 115.987 -8.766 -8.426 1.00 0.00 O ATOM 629 CB ARG A 40 114.418 -7.718 -5.699 1.00 0.00 C ATOM 630 CG ARG A 40 114.809 -9.186 -5.482 1.00 0.00 C ATOM 631 CD ARG A 40 113.597 -10.086 -5.733 1.00 0.00 C ATOM 632 NE ARG A 40 114.058 -11.480 -5.987 1.00 0.00 N ATOM 633 CZ ARG A 40 113.186 -12.439 -6.138 1.00 0.00 C ATOM 634 NH1 ARG A 40 111.909 -12.178 -6.063 1.00 0.00 N ATOM 635 NH2 ARG A 40 113.590 -13.659 -6.363 1.00 0.00 N ATOM 0 H ARG A 40 114.189 -5.322 -6.404 1.00 0.00 H new ATOM 0 HA ARG A 40 116.277 -7.074 -6.597 1.00 0.00 H new ATOM 0 HB2 ARG A 40 114.605 -7.145 -4.791 1.00 0.00 H new ATOM 0 HB3 ARG A 40 113.351 -7.644 -5.909 1.00 0.00 H new ATOM 0 HG2 ARG A 40 115.622 -9.459 -6.155 1.00 0.00 H new ATOM 0 HG3 ARG A 40 115.175 -9.328 -4.465 1.00 0.00 H new ATOM 0 HD2 ARG A 40 112.929 -10.064 -4.872 1.00 0.00 H new ATOM 0 HD3 ARG A 40 113.028 -9.718 -6.587 1.00 0.00 H new ATOM 0 HE ARG A 40 115.056 -11.685 -6.043 1.00 0.00 H new ATOM 0 HH11 ARG A 40 111.593 -11.224 -5.886 1.00 0.00 H new ATOM 0 HH12 ARG A 40 111.227 -12.928 -6.181 1.00 0.00 H new ATOM 0 HH21 ARG A 40 114.588 -13.863 -6.421 1.00 0.00 H new ATOM 0 HH22 ARG A 40 112.908 -14.408 -6.481 1.00 0.00 H new ATOM 649 N ILE A 41 113.968 -8.000 -8.766 1.00 0.00 N ATOM 650 CA ILE A 41 113.817 -8.883 -9.963 1.00 0.00 C ATOM 651 C ILE A 41 114.254 -8.158 -11.241 1.00 0.00 C ATOM 652 O ILE A 41 114.512 -8.782 -12.252 1.00 0.00 O ATOM 653 CB ILE A 41 112.361 -9.319 -10.104 1.00 0.00 C ATOM 654 CG1 ILE A 41 111.444 -8.236 -9.536 1.00 0.00 C ATOM 655 CG2 ILE A 41 112.151 -10.624 -9.340 1.00 0.00 C ATOM 656 CD1 ILE A 41 111.798 -6.891 -10.170 1.00 0.00 C ATOM 0 H ILE A 41 113.163 -7.414 -8.546 1.00 0.00 H new ATOM 0 HA ILE A 41 114.454 -9.756 -9.822 1.00 0.00 H new ATOM 0 HB ILE A 41 112.125 -9.471 -11.157 1.00 0.00 H new ATOM 0 HG12 ILE A 41 110.402 -8.483 -9.738 1.00 0.00 H new ATOM 0 HG13 ILE A 41 111.555 -8.181 -8.453 1.00 0.00 H new ATOM 0 HG21 ILE A 41 111.112 -10.940 -9.438 1.00 0.00 H new ATOM 0 HG22 ILE A 41 112.804 -11.394 -9.749 1.00 0.00 H new ATOM 0 HG23 ILE A 41 112.386 -10.471 -8.287 1.00 0.00 H new ATOM 0 HD11 ILE A 41 111.146 -6.116 -9.767 1.00 0.00 H new ATOM 0 HD12 ILE A 41 112.836 -6.645 -9.945 1.00 0.00 H new ATOM 0 HD13 ILE A 41 111.665 -6.952 -11.250 1.00 0.00 H new ATOM 668 N ALA A 42 114.326 -6.856 -11.224 1.00 0.00 N ATOM 669 CA ALA A 42 114.729 -6.128 -12.459 1.00 0.00 C ATOM 670 C ALA A 42 116.254 -5.997 -12.511 1.00 0.00 C ATOM 671 O ALA A 42 116.806 -5.449 -13.444 1.00 0.00 O ATOM 672 CB ALA A 42 114.078 -4.743 -12.467 1.00 0.00 C ATOM 0 H ALA A 42 114.125 -6.268 -10.415 1.00 0.00 H new ATOM 0 HA ALA A 42 114.397 -6.684 -13.335 1.00 0.00 H new ATOM 0 HB1 ALA A 42 114.372 -4.208 -13.370 1.00 0.00 H new ATOM 0 HB2 ALA A 42 112.994 -4.851 -12.445 1.00 0.00 H new ATOM 0 HB3 ALA A 42 114.405 -4.182 -11.591 1.00 0.00 H new ATOM 678 N VAL A 43 116.934 -6.487 -11.508 1.00 0.00 N ATOM 679 CA VAL A 43 118.428 -6.386 -11.486 1.00 0.00 C ATOM 680 C VAL A 43 118.994 -6.424 -12.911 1.00 0.00 C ATOM 681 O VAL A 43 120.018 -5.839 -13.193 1.00 0.00 O ATOM 682 CB VAL A 43 119.002 -7.534 -10.650 1.00 0.00 C ATOM 683 CG1 VAL A 43 117.947 -8.030 -9.666 1.00 0.00 C ATOM 684 CG2 VAL A 43 119.431 -8.690 -11.553 1.00 0.00 C ATOM 0 H VAL A 43 116.521 -6.954 -10.701 1.00 0.00 H new ATOM 0 HA VAL A 43 118.715 -5.435 -11.036 1.00 0.00 H new ATOM 0 HB VAL A 43 119.872 -7.166 -10.106 1.00 0.00 H new ATOM 0 HG11 VAL A 43 118.358 -8.847 -9.073 1.00 0.00 H new ATOM 0 HG12 VAL A 43 117.653 -7.214 -9.006 1.00 0.00 H new ATOM 0 HG13 VAL A 43 117.075 -8.384 -10.216 1.00 0.00 H new ATOM 0 HG21 VAL A 43 119.836 -9.497 -10.943 1.00 0.00 H new ATOM 0 HG22 VAL A 43 118.569 -9.055 -12.111 1.00 0.00 H new ATOM 0 HG23 VAL A 43 120.194 -8.343 -12.250 1.00 0.00 H new ATOM 694 N ALA A 44 118.341 -7.100 -13.810 1.00 0.00 N ATOM 695 CA ALA A 44 118.851 -7.165 -15.209 1.00 0.00 C ATOM 696 C ALA A 44 120.262 -7.759 -15.208 1.00 0.00 C ATOM 697 O ALA A 44 120.769 -8.181 -16.229 1.00 0.00 O ATOM 698 CB ALA A 44 118.891 -5.756 -15.803 1.00 0.00 C ATOM 0 H ALA A 44 117.475 -7.612 -13.639 1.00 0.00 H new ATOM 0 HA ALA A 44 118.192 -7.793 -15.809 1.00 0.00 H new ATOM 0 HB1 ALA A 44 119.264 -5.803 -16.826 1.00 0.00 H new ATOM 0 HB2 ALA A 44 117.887 -5.332 -15.802 1.00 0.00 H new ATOM 0 HB3 ALA A 44 119.551 -5.128 -15.205 1.00 0.00 H new ATOM 704 N SER A 45 120.899 -7.797 -14.070 1.00 0.00 N ATOM 705 CA SER A 45 122.274 -8.363 -14.000 1.00 0.00 C ATOM 706 C SER A 45 122.216 -9.873 -14.190 1.00 0.00 C ATOM 707 O SER A 45 121.446 -10.389 -14.976 1.00 0.00 O ATOM 708 CB SER A 45 122.885 -8.058 -12.636 1.00 0.00 C ATOM 709 OG SER A 45 122.595 -9.124 -11.742 1.00 0.00 O ATOM 0 H SER A 45 120.524 -7.459 -13.183 1.00 0.00 H new ATOM 0 HA SER A 45 122.884 -7.916 -14.785 1.00 0.00 H new ATOM 0 HB2 SER A 45 123.963 -7.929 -12.729 1.00 0.00 H new ATOM 0 HB3 SER A 45 122.484 -7.122 -12.246 1.00 0.00 H new ATOM 0 HG SER A 45 123.396 -9.340 -11.220 1.00 0.00 H new ATOM 715 N ASP A 46 123.029 -10.583 -13.467 1.00 0.00 N ATOM 716 CA ASP A 46 123.036 -12.068 -13.587 1.00 0.00 C ATOM 717 C ASP A 46 123.097 -12.691 -12.191 1.00 0.00 C ATOM 718 O ASP A 46 124.050 -13.359 -11.841 1.00 0.00 O ATOM 719 CB ASP A 46 124.257 -12.509 -14.396 1.00 0.00 C ATOM 720 CG ASP A 46 125.465 -11.655 -14.005 1.00 0.00 C ATOM 721 OD1 ASP A 46 126.076 -11.956 -12.994 1.00 0.00 O ATOM 722 OD2 ASP A 46 125.757 -10.713 -14.724 1.00 0.00 O ATOM 0 H ASP A 46 123.693 -10.200 -12.794 1.00 0.00 H new ATOM 0 HA ASP A 46 122.128 -12.396 -14.093 1.00 0.00 H new ATOM 0 HB2 ASP A 46 124.468 -13.562 -14.211 1.00 0.00 H new ATOM 0 HB3 ASP A 46 124.056 -12.407 -15.462 1.00 0.00 H new ATOM 727 N GLY A 47 122.088 -12.479 -11.388 1.00 0.00 N ATOM 728 CA GLY A 47 122.099 -13.062 -10.017 1.00 0.00 C ATOM 729 C GLY A 47 120.714 -12.925 -9.381 1.00 0.00 C ATOM 730 O GLY A 47 120.080 -13.902 -9.036 1.00 0.00 O ATOM 0 H GLY A 47 121.261 -11.930 -11.622 1.00 0.00 H new ATOM 0 HA2 GLY A 47 122.386 -14.113 -10.062 1.00 0.00 H new ATOM 0 HA3 GLY A 47 122.843 -12.554 -9.403 1.00 0.00 H new ATOM 734 N VAL A 48 120.243 -11.720 -9.220 1.00 0.00 N ATOM 735 CA VAL A 48 118.902 -11.515 -8.605 1.00 0.00 C ATOM 736 C VAL A 48 118.971 -11.807 -7.105 1.00 0.00 C ATOM 737 O VAL A 48 119.783 -12.588 -6.650 1.00 0.00 O ATOM 738 CB VAL A 48 117.884 -12.448 -9.263 1.00 0.00 C ATOM 739 CG1 VAL A 48 116.484 -11.841 -9.141 1.00 0.00 C ATOM 740 CG2 VAL A 48 118.235 -12.627 -10.743 1.00 0.00 C ATOM 0 H VAL A 48 120.731 -10.865 -9.489 1.00 0.00 H new ATOM 0 HA VAL A 48 118.593 -10.481 -8.757 1.00 0.00 H new ATOM 0 HB VAL A 48 117.906 -13.418 -8.765 1.00 0.00 H new ATOM 0 HG11 VAL A 48 115.757 -12.505 -9.610 1.00 0.00 H new ATOM 0 HG12 VAL A 48 116.233 -11.714 -8.088 1.00 0.00 H new ATOM 0 HG13 VAL A 48 116.463 -10.871 -9.639 1.00 0.00 H new ATOM 0 HG21 VAL A 48 117.509 -13.292 -11.211 1.00 0.00 H new ATOM 0 HG22 VAL A 48 118.214 -11.658 -11.242 1.00 0.00 H new ATOM 0 HG23 VAL A 48 119.232 -13.059 -10.831 1.00 0.00 H new ATOM 750 N SER A 49 118.124 -11.179 -6.335 1.00 0.00 N ATOM 751 CA SER A 49 118.137 -11.412 -4.863 1.00 0.00 C ATOM 752 C SER A 49 116.749 -11.859 -4.401 1.00 0.00 C ATOM 753 O SER A 49 116.119 -12.696 -5.016 1.00 0.00 O ATOM 754 CB SER A 49 118.516 -10.115 -4.147 1.00 0.00 C ATOM 755 OG SER A 49 119.479 -9.414 -4.922 1.00 0.00 O ATOM 0 H SER A 49 117.423 -10.514 -6.662 1.00 0.00 H new ATOM 0 HA SER A 49 118.865 -12.188 -4.626 1.00 0.00 H new ATOM 0 HB2 SER A 49 117.631 -9.496 -3.999 1.00 0.00 H new ATOM 0 HB3 SER A 49 118.919 -10.336 -3.159 1.00 0.00 H new ATOM 0 HG SER A 49 119.075 -8.600 -5.288 1.00 0.00 H new ATOM 761 N SER A 50 116.273 -11.307 -3.318 1.00 0.00 N ATOM 762 CA SER A 50 114.932 -11.691 -2.798 1.00 0.00 C ATOM 763 C SER A 50 114.900 -11.417 -1.297 1.00 0.00 C ATOM 764 O SER A 50 114.350 -10.433 -0.845 1.00 0.00 O ATOM 765 CB SER A 50 114.684 -13.179 -3.050 1.00 0.00 C ATOM 766 OG SER A 50 113.848 -13.696 -2.023 1.00 0.00 O ATOM 0 H SER A 50 116.761 -10.600 -2.767 1.00 0.00 H new ATOM 0 HA SER A 50 114.158 -11.114 -3.304 1.00 0.00 H new ATOM 0 HB2 SER A 50 114.214 -13.322 -4.023 1.00 0.00 H new ATOM 0 HB3 SER A 50 115.631 -13.719 -3.071 1.00 0.00 H new ATOM 0 HG SER A 50 113.686 -14.649 -2.182 1.00 0.00 H new ATOM 772 N GLU A 51 115.500 -12.276 -0.521 1.00 0.00 N ATOM 773 CA GLU A 51 115.520 -12.061 0.950 1.00 0.00 C ATOM 774 C GLU A 51 116.457 -10.894 1.274 1.00 0.00 C ATOM 775 O GLU A 51 116.303 -10.222 2.273 1.00 0.00 O ATOM 776 CB GLU A 51 116.022 -13.328 1.646 1.00 0.00 C ATOM 777 CG GLU A 51 116.312 -13.022 3.117 1.00 0.00 C ATOM 778 CD GLU A 51 116.100 -14.286 3.952 1.00 0.00 C ATOM 779 OE1 GLU A 51 114.961 -14.700 4.087 1.00 0.00 O ATOM 780 OE2 GLU A 51 117.082 -14.819 4.443 1.00 0.00 O ATOM 0 H GLU A 51 115.977 -13.118 -0.843 1.00 0.00 H new ATOM 0 HA GLU A 51 114.514 -11.832 1.301 1.00 0.00 H new ATOM 0 HB2 GLU A 51 115.275 -14.118 1.568 1.00 0.00 H new ATOM 0 HB3 GLU A 51 116.924 -13.692 1.155 1.00 0.00 H new ATOM 0 HG2 GLU A 51 117.336 -12.666 3.230 1.00 0.00 H new ATOM 0 HG3 GLU A 51 115.657 -12.226 3.470 1.00 0.00 H new ATOM 787 N GLU A 52 117.432 -10.650 0.441 1.00 0.00 N ATOM 788 CA GLU A 52 118.375 -9.527 0.714 1.00 0.00 C ATOM 789 C GLU A 52 117.663 -8.191 0.491 1.00 0.00 C ATOM 790 O GLU A 52 117.669 -7.327 1.346 1.00 0.00 O ATOM 791 CB GLU A 52 119.571 -9.627 -0.235 1.00 0.00 C ATOM 792 CG GLU A 52 120.867 -9.352 0.533 1.00 0.00 C ATOM 793 CD GLU A 52 120.687 -8.116 1.416 1.00 0.00 C ATOM 794 OE1 GLU A 52 120.676 -7.023 0.876 1.00 0.00 O ATOM 795 OE2 GLU A 52 120.564 -8.285 2.618 1.00 0.00 O ATOM 0 H GLU A 52 117.616 -11.177 -0.413 1.00 0.00 H new ATOM 0 HA GLU A 52 118.719 -9.587 1.747 1.00 0.00 H new ATOM 0 HB2 GLU A 52 119.608 -10.619 -0.685 1.00 0.00 H new ATOM 0 HB3 GLU A 52 119.461 -8.911 -1.050 1.00 0.00 H new ATOM 0 HG2 GLU A 52 121.128 -10.215 1.146 1.00 0.00 H new ATOM 0 HG3 GLU A 52 121.689 -9.196 -0.165 1.00 0.00 H new ATOM 802 N LYS A 53 117.040 -8.014 -0.644 1.00 0.00 N ATOM 803 CA LYS A 53 116.327 -6.729 -0.896 1.00 0.00 C ATOM 804 C LYS A 53 115.233 -6.570 0.154 1.00 0.00 C ATOM 805 O LYS A 53 114.982 -5.489 0.648 1.00 0.00 O ATOM 806 CB LYS A 53 115.699 -6.737 -2.296 1.00 0.00 C ATOM 807 CG LYS A 53 114.967 -5.414 -2.539 1.00 0.00 C ATOM 808 CD LYS A 53 115.967 -4.353 -3.005 1.00 0.00 C ATOM 809 CE LYS A 53 116.306 -4.575 -4.481 1.00 0.00 C ATOM 810 NZ LYS A 53 116.791 -3.298 -5.076 1.00 0.00 N ATOM 0 H LYS A 53 116.994 -8.697 -1.400 1.00 0.00 H new ATOM 0 HA LYS A 53 117.032 -5.900 -0.837 1.00 0.00 H new ATOM 0 HB2 LYS A 53 116.472 -6.881 -3.051 1.00 0.00 H new ATOM 0 HB3 LYS A 53 115.004 -7.571 -2.389 1.00 0.00 H new ATOM 0 HG2 LYS A 53 114.189 -5.550 -3.290 1.00 0.00 H new ATOM 0 HG3 LYS A 53 114.473 -5.086 -1.624 1.00 0.00 H new ATOM 0 HD2 LYS A 53 115.547 -3.357 -2.864 1.00 0.00 H new ATOM 0 HD3 LYS A 53 116.874 -4.405 -2.402 1.00 0.00 H new ATOM 0 HE2 LYS A 53 117.069 -5.347 -4.578 1.00 0.00 H new ATOM 0 HE3 LYS A 53 115.426 -4.928 -5.018 1.00 0.00 H new ATOM 0 HZ1 LYS A 53 117.179 -3.482 -6.023 1.00 0.00 H new ATOM 0 HZ2 LYS A 53 116.000 -2.627 -5.151 1.00 0.00 H new ATOM 0 HZ3 LYS A 53 117.533 -2.892 -4.470 1.00 0.00 H new ATOM 824 N GLN A 54 114.587 -7.646 0.504 1.00 0.00 N ATOM 825 CA GLN A 54 113.514 -7.572 1.526 1.00 0.00 C ATOM 826 C GLN A 54 114.085 -6.943 2.802 1.00 0.00 C ATOM 827 O GLN A 54 113.504 -6.040 3.377 1.00 0.00 O ATOM 828 CB GLN A 54 112.988 -8.990 1.793 1.00 0.00 C ATOM 829 CG GLN A 54 113.418 -9.470 3.181 1.00 0.00 C ATOM 830 CD GLN A 54 112.852 -10.868 3.435 1.00 0.00 C ATOM 831 OE1 GLN A 54 113.253 -11.539 4.365 1.00 0.00 O ATOM 832 NE2 GLN A 54 111.930 -11.340 2.641 1.00 0.00 N ATOM 0 H GLN A 54 114.759 -8.576 0.123 1.00 0.00 H new ATOM 0 HA GLN A 54 112.687 -6.954 1.177 1.00 0.00 H new ATOM 0 HB2 GLN A 54 111.901 -9.001 1.719 1.00 0.00 H new ATOM 0 HB3 GLN A 54 113.366 -9.673 1.032 1.00 0.00 H new ATOM 0 HG2 GLN A 54 114.506 -9.488 3.250 1.00 0.00 H new ATOM 0 HG3 GLN A 54 113.061 -8.778 3.944 1.00 0.00 H new ATOM 0 HE21 GLN A 54 111.593 -10.777 1.860 1.00 0.00 H new ATOM 0 HE22 GLN A 54 111.547 -12.272 2.802 1.00 0.00 H new ATOM 841 N LYS A 55 115.229 -7.397 3.241 1.00 0.00 N ATOM 842 CA LYS A 55 115.832 -6.805 4.466 1.00 0.00 C ATOM 843 C LYS A 55 115.906 -5.289 4.276 1.00 0.00 C ATOM 844 O LYS A 55 115.467 -4.528 5.115 1.00 0.00 O ATOM 845 CB LYS A 55 117.237 -7.378 4.683 1.00 0.00 C ATOM 846 CG LYS A 55 117.204 -8.402 5.821 1.00 0.00 C ATOM 847 CD LYS A 55 116.343 -9.598 5.411 1.00 0.00 C ATOM 848 CE LYS A 55 116.439 -10.686 6.482 1.00 0.00 C ATOM 849 NZ LYS A 55 117.840 -11.188 6.556 1.00 0.00 N ATOM 0 H LYS A 55 115.767 -8.147 2.807 1.00 0.00 H new ATOM 0 HA LYS A 55 115.225 -7.043 5.340 1.00 0.00 H new ATOM 0 HB2 LYS A 55 117.594 -7.849 3.767 1.00 0.00 H new ATOM 0 HB3 LYS A 55 117.935 -6.576 4.922 1.00 0.00 H new ATOM 0 HG2 LYS A 55 118.216 -8.733 6.055 1.00 0.00 H new ATOM 0 HG3 LYS A 55 116.801 -7.944 6.724 1.00 0.00 H new ATOM 0 HD2 LYS A 55 115.306 -9.287 5.285 1.00 0.00 H new ATOM 0 HD3 LYS A 55 116.678 -9.988 4.450 1.00 0.00 H new ATOM 0 HE2 LYS A 55 116.133 -10.287 7.449 1.00 0.00 H new ATOM 0 HE3 LYS A 55 115.760 -11.505 6.245 1.00 0.00 H new ATOM 0 HZ1 LYS A 55 117.843 -12.151 6.949 1.00 0.00 H new ATOM 0 HZ2 LYS A 55 118.255 -11.201 5.602 1.00 0.00 H new ATOM 0 HZ3 LYS A 55 118.401 -10.562 7.169 1.00 0.00 H new ATOM 863 N MET A 56 116.448 -4.843 3.173 1.00 0.00 N ATOM 864 CA MET A 56 116.534 -3.380 2.933 1.00 0.00 C ATOM 865 C MET A 56 115.151 -2.752 3.117 1.00 0.00 C ATOM 866 O MET A 56 115.019 -1.687 3.686 1.00 0.00 O ATOM 867 CB MET A 56 117.018 -3.133 1.507 1.00 0.00 C ATOM 868 CG MET A 56 118.528 -3.341 1.447 1.00 0.00 C ATOM 869 SD MET A 56 118.908 -5.098 1.648 1.00 0.00 S ATOM 870 CE MET A 56 119.361 -5.033 3.401 1.00 0.00 C ATOM 0 H MET A 56 116.833 -5.430 2.433 1.00 0.00 H new ATOM 0 HA MET A 56 117.233 -2.933 3.640 1.00 0.00 H new ATOM 0 HB2 MET A 56 116.518 -3.813 0.817 1.00 0.00 H new ATOM 0 HB3 MET A 56 116.766 -2.120 1.195 1.00 0.00 H new ATOM 0 HG2 MET A 56 118.917 -2.981 0.494 1.00 0.00 H new ATOM 0 HG3 MET A 56 119.016 -2.761 2.230 1.00 0.00 H new ATOM 0 HE1 MET A 56 119.738 -6.006 3.716 1.00 0.00 H new ATOM 0 HE2 MET A 56 120.134 -4.279 3.549 1.00 0.00 H new ATOM 0 HE3 MET A 56 118.484 -4.775 3.994 1.00 0.00 H new ATOM 880 N ILE A 57 114.112 -3.401 2.657 1.00 0.00 N ATOM 881 CA ILE A 57 112.755 -2.816 2.840 1.00 0.00 C ATOM 882 C ILE A 57 112.601 -2.445 4.314 1.00 0.00 C ATOM 883 O ILE A 57 112.017 -1.438 4.657 1.00 0.00 O ATOM 884 CB ILE A 57 111.683 -3.831 2.433 1.00 0.00 C ATOM 885 CG1 ILE A 57 111.943 -4.297 0.998 1.00 0.00 C ATOM 886 CG2 ILE A 57 110.304 -3.171 2.509 1.00 0.00 C ATOM 887 CD1 ILE A 57 110.902 -5.346 0.605 1.00 0.00 C ATOM 0 H ILE A 57 114.145 -4.297 2.170 1.00 0.00 H new ATOM 0 HA ILE A 57 112.635 -1.932 2.214 1.00 0.00 H new ATOM 0 HB ILE A 57 111.717 -4.687 3.107 1.00 0.00 H new ATOM 0 HG12 ILE A 57 111.896 -3.449 0.315 1.00 0.00 H new ATOM 0 HG13 ILE A 57 112.946 -4.716 0.917 1.00 0.00 H new ATOM 0 HG21 ILE A 57 109.539 -3.892 2.220 1.00 0.00 H new ATOM 0 HG22 ILE A 57 110.118 -2.834 3.529 1.00 0.00 H new ATOM 0 HG23 ILE A 57 110.272 -2.317 1.833 1.00 0.00 H new ATOM 0 HD11 ILE A 57 111.087 -5.678 -0.417 1.00 0.00 H new ATOM 0 HD12 ILE A 57 110.971 -6.198 1.281 1.00 0.00 H new ATOM 0 HD13 ILE A 57 109.905 -4.911 0.670 1.00 0.00 H new ATOM 899 N GLY A 58 113.157 -3.237 5.189 1.00 0.00 N ATOM 900 CA GLY A 58 113.081 -2.903 6.639 1.00 0.00 C ATOM 901 C GLY A 58 113.836 -1.588 6.858 1.00 0.00 C ATOM 902 O GLY A 58 113.383 -0.693 7.554 1.00 0.00 O ATOM 0 H GLY A 58 113.658 -4.097 4.964 1.00 0.00 H new ATOM 0 HA2 GLY A 58 112.042 -2.804 6.954 1.00 0.00 H new ATOM 0 HA3 GLY A 58 113.521 -3.700 7.238 1.00 0.00 H new ATOM 906 N PHE A 59 114.979 -1.456 6.236 1.00 0.00 N ATOM 907 CA PHE A 59 115.761 -0.198 6.371 1.00 0.00 C ATOM 908 C PHE A 59 114.851 0.955 5.967 1.00 0.00 C ATOM 909 O PHE A 59 114.852 2.008 6.570 1.00 0.00 O ATOM 910 CB PHE A 59 116.986 -0.267 5.449 1.00 0.00 C ATOM 911 CG PHE A 59 117.115 0.999 4.633 1.00 0.00 C ATOM 912 CD1 PHE A 59 117.683 2.144 5.201 1.00 0.00 C ATOM 913 CD2 PHE A 59 116.682 1.020 3.301 1.00 0.00 C ATOM 914 CE1 PHE A 59 117.814 3.310 4.439 1.00 0.00 C ATOM 915 CE2 PHE A 59 116.815 2.185 2.539 1.00 0.00 C ATOM 916 CZ PHE A 59 117.381 3.330 3.107 1.00 0.00 C ATOM 0 H PHE A 59 115.402 -2.168 5.640 1.00 0.00 H new ATOM 0 HA PHE A 59 116.108 -0.055 7.394 1.00 0.00 H new ATOM 0 HB2 PHE A 59 117.887 -0.415 6.044 1.00 0.00 H new ATOM 0 HB3 PHE A 59 116.899 -1.126 4.784 1.00 0.00 H new ATOM 0 HD1 PHE A 59 118.020 2.128 6.227 1.00 0.00 H new ATOM 0 HD2 PHE A 59 116.245 0.135 2.862 1.00 0.00 H new ATOM 0 HE1 PHE A 59 118.249 4.195 4.878 1.00 0.00 H new ATOM 0 HE2 PHE A 59 116.481 2.200 1.512 1.00 0.00 H new ATOM 0 HZ PHE A 59 117.484 4.230 2.519 1.00 0.00 H new ATOM 926 N LEU A 60 114.048 0.743 4.964 1.00 0.00 N ATOM 927 CA LEU A 60 113.101 1.799 4.528 1.00 0.00 C ATOM 928 C LEU A 60 112.293 2.237 5.743 1.00 0.00 C ATOM 929 O LEU A 60 112.130 3.412 6.004 1.00 0.00 O ATOM 930 CB LEU A 60 112.162 1.213 3.470 1.00 0.00 C ATOM 931 CG LEU A 60 112.266 1.968 2.136 1.00 0.00 C ATOM 932 CD1 LEU A 60 113.713 2.404 1.859 1.00 0.00 C ATOM 933 CD2 LEU A 60 111.818 1.022 1.023 1.00 0.00 C ATOM 0 H LEU A 60 114.008 -0.122 4.425 1.00 0.00 H new ATOM 0 HA LEU A 60 113.634 2.650 4.105 1.00 0.00 H new ATOM 0 HB2 LEU A 60 112.402 0.162 3.313 1.00 0.00 H new ATOM 0 HB3 LEU A 60 111.135 1.254 3.832 1.00 0.00 H new ATOM 0 HG LEU A 60 111.640 2.859 2.180 1.00 0.00 H new ATOM 0 HD11 LEU A 60 113.757 2.936 0.909 1.00 0.00 H new ATOM 0 HD12 LEU A 60 114.054 3.061 2.659 1.00 0.00 H new ATOM 0 HD13 LEU A 60 114.355 1.525 1.813 1.00 0.00 H new ATOM 0 HD21 LEU A 60 111.882 1.534 0.063 1.00 0.00 H new ATOM 0 HD22 LEU A 60 112.464 0.144 1.010 1.00 0.00 H new ATOM 0 HD23 LEU A 60 110.788 0.712 1.201 1.00 0.00 H new ATOM 945 N ARG A 61 111.793 1.295 6.494 1.00 0.00 N ATOM 946 CA ARG A 61 111.003 1.651 7.700 1.00 0.00 C ATOM 947 C ARG A 61 111.791 2.676 8.507 1.00 0.00 C ATOM 948 O ARG A 61 111.235 3.585 9.092 1.00 0.00 O ATOM 949 CB ARG A 61 110.771 0.398 8.547 1.00 0.00 C ATOM 950 CG ARG A 61 110.303 -0.747 7.645 1.00 0.00 C ATOM 951 CD ARG A 61 110.216 -2.037 8.462 1.00 0.00 C ATOM 952 NE ARG A 61 109.161 -1.895 9.505 1.00 0.00 N ATOM 953 CZ ARG A 61 108.957 -2.856 10.363 1.00 0.00 C ATOM 954 NH1 ARG A 61 109.679 -3.942 10.309 1.00 0.00 N ATOM 955 NH2 ARG A 61 108.033 -2.732 11.276 1.00 0.00 N ATOM 0 H ARG A 61 111.899 0.295 6.323 1.00 0.00 H new ATOM 0 HA ARG A 61 110.038 2.066 7.409 1.00 0.00 H new ATOM 0 HB2 ARG A 61 111.690 0.118 9.061 1.00 0.00 H new ATOM 0 HB3 ARG A 61 110.024 0.598 9.316 1.00 0.00 H new ATOM 0 HG2 ARG A 61 109.330 -0.510 7.214 1.00 0.00 H new ATOM 0 HG3 ARG A 61 110.996 -0.876 6.814 1.00 0.00 H new ATOM 0 HD2 ARG A 61 109.986 -2.879 7.809 1.00 0.00 H new ATOM 0 HD3 ARG A 61 111.178 -2.250 8.929 1.00 0.00 H new ATOM 0 HE ARG A 61 108.598 -1.046 9.548 1.00 0.00 H new ATOM 0 HH11 ARG A 61 110.402 -4.039 9.596 1.00 0.00 H new ATOM 0 HH12 ARG A 61 109.520 -4.694 10.980 1.00 0.00 H new ATOM 0 HH21 ARG A 61 107.469 -1.883 11.319 1.00 0.00 H new ATOM 0 HH22 ARG A 61 107.874 -3.484 11.946 1.00 0.00 H new ATOM 969 N SER A 62 113.089 2.541 8.537 1.00 0.00 N ATOM 970 CA SER A 62 113.918 3.516 9.300 1.00 0.00 C ATOM 971 C SER A 62 114.768 4.352 8.333 1.00 0.00 C ATOM 972 O SER A 62 115.604 5.125 8.748 1.00 0.00 O ATOM 973 CB SER A 62 114.832 2.760 10.264 1.00 0.00 C ATOM 974 OG SER A 62 115.272 1.556 9.647 1.00 0.00 O ATOM 0 H SER A 62 113.610 1.800 8.068 1.00 0.00 H new ATOM 0 HA SER A 62 113.263 4.181 9.863 1.00 0.00 H new ATOM 0 HB2 SER A 62 115.688 3.379 10.532 1.00 0.00 H new ATOM 0 HB3 SER A 62 114.299 2.535 11.188 1.00 0.00 H new ATOM 0 HG SER A 62 115.860 1.069 10.262 1.00 0.00 H new ATOM 980 N SER A 63 114.566 4.197 7.049 1.00 0.00 N ATOM 981 CA SER A 63 115.371 4.978 6.058 1.00 0.00 C ATOM 982 C SER A 63 115.444 6.447 6.472 1.00 0.00 C ATOM 983 O SER A 63 114.900 6.848 7.480 1.00 0.00 O ATOM 984 CB SER A 63 114.730 4.884 4.678 1.00 0.00 C ATOM 985 OG SER A 63 115.259 3.760 3.993 1.00 0.00 O ATOM 0 H SER A 63 113.878 3.563 6.643 1.00 0.00 H new ATOM 0 HA SER A 63 116.377 4.560 6.027 1.00 0.00 H new ATOM 0 HB2 SER A 63 113.648 4.791 4.772 1.00 0.00 H new ATOM 0 HB3 SER A 63 114.924 5.795 4.111 1.00 0.00 H new ATOM 0 HG SER A 63 116.200 3.924 3.774 1.00 0.00 H new ATOM 991 N GLU A 64 116.112 7.254 5.692 1.00 0.00 N ATOM 992 CA GLU A 64 116.221 8.699 6.028 1.00 0.00 C ATOM 993 C GLU A 64 114.823 9.312 6.049 1.00 0.00 C ATOM 994 O GLU A 64 114.613 10.388 6.572 1.00 0.00 O ATOM 995 CB GLU A 64 117.076 9.406 4.973 1.00 0.00 C ATOM 996 CG GLU A 64 117.339 10.853 5.407 1.00 0.00 C ATOM 997 CD GLU A 64 118.845 11.081 5.555 1.00 0.00 C ATOM 998 OE1 GLU A 64 119.503 10.217 6.110 1.00 0.00 O ATOM 999 OE2 GLU A 64 119.314 12.117 5.112 1.00 0.00 O ATOM 0 H GLU A 64 116.587 6.972 4.835 1.00 0.00 H new ATOM 0 HA GLU A 64 116.688 8.816 7.006 1.00 0.00 H new ATOM 0 HB2 GLU A 64 118.020 8.878 4.843 1.00 0.00 H new ATOM 0 HB3 GLU A 64 116.567 9.392 4.009 1.00 0.00 H new ATOM 0 HG2 GLU A 64 116.927 11.544 4.671 1.00 0.00 H new ATOM 0 HG3 GLU A 64 116.836 11.057 6.352 1.00 0.00 H new ATOM 1006 N GLU A 65 113.862 8.630 5.487 1.00 0.00 N ATOM 1007 CA GLU A 65 112.475 9.169 5.477 1.00 0.00 C ATOM 1008 C GLU A 65 112.156 9.754 6.853 1.00 0.00 C ATOM 1009 O GLU A 65 111.225 10.517 7.014 1.00 0.00 O ATOM 1010 CB GLU A 65 111.491 8.039 5.159 1.00 0.00 C ATOM 1011 CG GLU A 65 111.324 7.899 3.640 1.00 0.00 C ATOM 1012 CD GLU A 65 111.433 6.425 3.245 1.00 0.00 C ATOM 1013 OE1 GLU A 65 112.545 5.927 3.194 1.00 0.00 O ATOM 1014 OE2 GLU A 65 110.403 5.820 2.999 1.00 0.00 O ATOM 0 H GLU A 65 113.979 7.723 5.035 1.00 0.00 H new ATOM 0 HA GLU A 65 112.387 9.947 4.719 1.00 0.00 H new ATOM 0 HB2 GLU A 65 111.853 7.101 5.581 1.00 0.00 H new ATOM 0 HB3 GLU A 65 110.526 8.245 5.622 1.00 0.00 H new ATOM 0 HG2 GLU A 65 110.357 8.298 3.332 1.00 0.00 H new ATOM 0 HG3 GLU A 65 112.088 8.481 3.125 1.00 0.00 H new ATOM 1021 N LEU A 66 112.929 9.408 7.848 1.00 0.00 N ATOM 1022 CA LEU A 66 112.671 9.956 9.212 1.00 0.00 C ATOM 1023 C LEU A 66 112.505 11.471 9.105 1.00 0.00 C ATOM 1024 O LEU A 66 111.804 12.091 9.881 1.00 0.00 O ATOM 1025 CB LEU A 66 113.854 9.650 10.138 1.00 0.00 C ATOM 1026 CG LEU A 66 114.274 8.182 9.997 1.00 0.00 C ATOM 1027 CD1 LEU A 66 115.796 8.098 9.843 1.00 0.00 C ATOM 1028 CD2 LEU A 66 113.853 7.406 11.248 1.00 0.00 C ATOM 0 H LEU A 66 113.724 8.773 7.776 1.00 0.00 H new ATOM 0 HA LEU A 66 111.770 9.498 9.621 1.00 0.00 H new ATOM 0 HB2 LEU A 66 114.694 10.301 9.894 1.00 0.00 H new ATOM 0 HB3 LEU A 66 113.579 9.859 11.172 1.00 0.00 H new ATOM 0 HG LEU A 66 113.791 7.752 9.119 1.00 0.00 H new ATOM 0 HD11 LEU A 66 116.095 7.054 9.743 1.00 0.00 H new ATOM 0 HD12 LEU A 66 116.103 8.650 8.955 1.00 0.00 H new ATOM 0 HD13 LEU A 66 116.275 8.530 10.722 1.00 0.00 H new ATOM 0 HD21 LEU A 66 114.152 6.363 11.147 1.00 0.00 H new ATOM 0 HD22 LEU A 66 114.336 7.839 12.124 1.00 0.00 H new ATOM 0 HD23 LEU A 66 112.771 7.464 11.365 1.00 0.00 H new ATOM 1040 N LYS A 67 113.155 12.067 8.146 1.00 0.00 N ATOM 1041 CA LYS A 67 113.056 13.542 7.969 1.00 0.00 C ATOM 1042 C LYS A 67 111.677 13.906 7.418 1.00 0.00 C ATOM 1043 O LYS A 67 111.021 14.790 7.927 1.00 0.00 O ATOM 1044 CB LYS A 67 114.133 14.002 6.988 1.00 0.00 C ATOM 1045 CG LYS A 67 114.250 12.983 5.849 1.00 0.00 C ATOM 1046 CD LYS A 67 114.051 13.687 4.511 1.00 0.00 C ATOM 1047 CE LYS A 67 113.877 12.640 3.410 1.00 0.00 C ATOM 1048 NZ LYS A 67 115.142 11.868 3.251 1.00 0.00 N ATOM 0 H LYS A 67 113.755 11.592 7.472 1.00 0.00 H new ATOM 0 HA LYS A 67 113.198 14.034 8.931 1.00 0.00 H new ATOM 0 HB2 LYS A 67 113.881 14.984 6.588 1.00 0.00 H new ATOM 0 HB3 LYS A 67 115.089 14.102 7.501 1.00 0.00 H new ATOM 0 HG2 LYS A 67 115.228 12.502 5.877 1.00 0.00 H new ATOM 0 HG3 LYS A 67 113.505 12.197 5.972 1.00 0.00 H new ATOM 0 HD2 LYS A 67 113.175 14.335 4.554 1.00 0.00 H new ATOM 0 HD3 LYS A 67 114.908 14.324 4.291 1.00 0.00 H new ATOM 0 HE2 LYS A 67 113.057 11.967 3.660 1.00 0.00 H new ATOM 0 HE3 LYS A 67 113.615 13.126 2.470 1.00 0.00 H new ATOM 0 HZ1 LYS A 67 115.125 11.356 2.346 1.00 0.00 H new ATOM 0 HZ2 LYS A 67 115.951 12.521 3.264 1.00 0.00 H new ATOM 0 HZ3 LYS A 67 115.234 11.188 4.032 1.00 0.00 H new ATOM 1062 N VAL A 68 111.234 13.234 6.381 1.00 0.00 N ATOM 1063 CA VAL A 68 109.893 13.543 5.802 1.00 0.00 C ATOM 1064 C VAL A 68 110.015 14.723 4.831 1.00 0.00 C ATOM 1065 O VAL A 68 109.217 15.635 4.870 1.00 0.00 O ATOM 1066 CB VAL A 68 108.925 13.908 6.944 1.00 0.00 C ATOM 1067 CG1 VAL A 68 107.476 13.865 6.453 1.00 0.00 C ATOM 1068 CG2 VAL A 68 109.095 12.912 8.098 1.00 0.00 C ATOM 0 H VAL A 68 111.745 12.486 5.913 1.00 0.00 H new ATOM 0 HA VAL A 68 109.513 12.675 5.264 1.00 0.00 H new ATOM 0 HB VAL A 68 109.154 14.917 7.286 1.00 0.00 H new ATOM 0 HG11 VAL A 68 106.806 14.125 7.273 1.00 0.00 H new ATOM 0 HG12 VAL A 68 107.347 14.577 5.638 1.00 0.00 H new ATOM 0 HG13 VAL A 68 107.242 12.861 6.098 1.00 0.00 H new ATOM 0 HG21 VAL A 68 108.410 13.171 8.906 1.00 0.00 H new ATOM 0 HG22 VAL A 68 108.875 11.905 7.744 1.00 0.00 H new ATOM 0 HG23 VAL A 68 110.121 12.952 8.465 1.00 0.00 H new ATOM 1078 N PHE A 69 110.999 14.720 3.953 1.00 0.00 N ATOM 1079 CA PHE A 69 111.134 15.870 3.003 1.00 0.00 C ATOM 1080 C PHE A 69 112.217 15.625 1.937 1.00 0.00 C ATOM 1081 O PHE A 69 111.932 15.614 0.757 1.00 0.00 O ATOM 1082 CB PHE A 69 111.509 17.133 3.782 1.00 0.00 C ATOM 1083 CG PHE A 69 110.321 17.633 4.567 1.00 0.00 C ATOM 1084 CD1 PHE A 69 109.248 18.242 3.907 1.00 0.00 C ATOM 1085 CD2 PHE A 69 110.294 17.485 5.959 1.00 0.00 C ATOM 1086 CE1 PHE A 69 108.148 18.705 4.640 1.00 0.00 C ATOM 1087 CE2 PHE A 69 109.194 17.947 6.692 1.00 0.00 C ATOM 1088 CZ PHE A 69 108.121 18.558 6.032 1.00 0.00 C ATOM 0 H PHE A 69 111.699 13.985 3.857 1.00 0.00 H new ATOM 0 HA PHE A 69 110.174 15.984 2.499 1.00 0.00 H new ATOM 0 HB2 PHE A 69 112.337 16.920 4.458 1.00 0.00 H new ATOM 0 HB3 PHE A 69 111.851 17.906 3.093 1.00 0.00 H new ATOM 0 HD1 PHE A 69 109.268 18.355 2.833 1.00 0.00 H new ATOM 0 HD2 PHE A 69 111.122 17.014 6.468 1.00 0.00 H new ATOM 0 HE1 PHE A 69 107.320 19.176 4.131 1.00 0.00 H new ATOM 0 HE2 PHE A 69 109.173 17.832 7.766 1.00 0.00 H new ATOM 0 HZ PHE A 69 107.273 18.916 6.597 1.00 0.00 H new ATOM 1098 N ASP A 70 113.459 15.483 2.328 1.00 0.00 N ATOM 1099 CA ASP A 70 114.539 15.305 1.307 1.00 0.00 C ATOM 1100 C ASP A 70 114.136 14.250 0.277 1.00 0.00 C ATOM 1101 O ASP A 70 114.476 13.085 0.383 1.00 0.00 O ATOM 1102 CB ASP A 70 115.850 14.889 1.979 1.00 0.00 C ATOM 1103 CG ASP A 70 116.216 15.907 3.062 1.00 0.00 C ATOM 1104 OD1 ASP A 70 115.754 17.032 2.970 1.00 0.00 O ATOM 1105 OD2 ASP A 70 116.952 15.544 3.964 1.00 0.00 O ATOM 0 H ASP A 70 113.771 15.482 3.299 1.00 0.00 H new ATOM 0 HA ASP A 70 114.685 16.259 0.801 1.00 0.00 H new ATOM 0 HB2 ASP A 70 115.747 13.897 2.418 1.00 0.00 H new ATOM 0 HB3 ASP A 70 116.647 14.828 1.238 1.00 0.00 H new ATOM 1110 N THR A 71 113.429 14.666 -0.736 1.00 0.00 N ATOM 1111 CA THR A 71 113.010 13.717 -1.800 1.00 0.00 C ATOM 1112 C THR A 71 114.256 13.188 -2.504 1.00 0.00 C ATOM 1113 O THR A 71 114.320 12.043 -2.906 1.00 0.00 O ATOM 1114 CB THR A 71 112.129 14.448 -2.816 1.00 0.00 C ATOM 1115 OG1 THR A 71 112.807 14.519 -4.062 1.00 0.00 O ATOM 1116 CG2 THR A 71 111.830 15.865 -2.321 1.00 0.00 C ATOM 0 H THR A 71 113.122 15.629 -0.872 1.00 0.00 H new ATOM 0 HA THR A 71 112.449 12.892 -1.361 1.00 0.00 H new ATOM 0 HB THR A 71 111.192 13.904 -2.936 1.00 0.00 H new ATOM 0 HG1 THR A 71 113.209 15.407 -4.166 1.00 0.00 H new ATOM 0 HG21 THR A 71 111.203 16.380 -3.049 1.00 0.00 H new ATOM 0 HG22 THR A 71 111.309 15.814 -1.365 1.00 0.00 H new ATOM 0 HG23 THR A 71 112.765 16.412 -2.197 1.00 0.00 H new ATOM 1124 N ALA A 72 115.252 14.018 -2.654 1.00 0.00 N ATOM 1125 CA ALA A 72 116.499 13.571 -3.329 1.00 0.00 C ATOM 1126 C ALA A 72 117.096 12.400 -2.552 1.00 0.00 C ATOM 1127 O ALA A 72 117.782 11.564 -3.102 1.00 0.00 O ATOM 1128 CB ALA A 72 117.503 14.725 -3.366 1.00 0.00 C ATOM 0 H ALA A 72 115.254 14.987 -2.337 1.00 0.00 H new ATOM 0 HA ALA A 72 116.273 13.258 -4.348 1.00 0.00 H new ATOM 0 HB1 ALA A 72 118.417 14.396 -3.861 1.00 0.00 H new ATOM 0 HB2 ALA A 72 117.074 15.563 -3.915 1.00 0.00 H new ATOM 0 HB3 ALA A 72 117.734 15.039 -2.348 1.00 0.00 H new ATOM 1134 N GLU A 73 116.837 12.334 -1.274 1.00 0.00 N ATOM 1135 CA GLU A 73 117.385 11.217 -0.454 1.00 0.00 C ATOM 1136 C GLU A 73 116.581 9.943 -0.724 1.00 0.00 C ATOM 1137 O GLU A 73 117.120 8.852 -0.776 1.00 0.00 O ATOM 1138 CB GLU A 73 117.284 11.578 1.029 1.00 0.00 C ATOM 1139 CG GLU A 73 118.480 12.444 1.427 1.00 0.00 C ATOM 1140 CD GLU A 73 119.726 11.567 1.556 1.00 0.00 C ATOM 1141 OE1 GLU A 73 119.691 10.447 1.072 1.00 0.00 O ATOM 1142 OE2 GLU A 73 120.695 12.029 2.135 1.00 0.00 O ATOM 0 H GLU A 73 116.268 13.008 -0.762 1.00 0.00 H new ATOM 0 HA GLU A 73 118.429 11.050 -0.718 1.00 0.00 H new ATOM 0 HB2 GLU A 73 116.354 12.113 1.221 1.00 0.00 H new ATOM 0 HB3 GLU A 73 117.261 10.672 1.634 1.00 0.00 H new ATOM 0 HG2 GLU A 73 118.645 13.220 0.680 1.00 0.00 H new ATOM 0 HG3 GLU A 73 118.278 12.949 2.372 1.00 0.00 H new ATOM 1149 N VAL A 74 115.293 10.069 -0.900 1.00 0.00 N ATOM 1150 CA VAL A 74 114.461 8.863 -1.167 1.00 0.00 C ATOM 1151 C VAL A 74 114.878 8.264 -2.513 1.00 0.00 C ATOM 1152 O VAL A 74 115.375 7.151 -2.593 1.00 0.00 O ATOM 1153 CB VAL A 74 112.987 9.268 -1.209 1.00 0.00 C ATOM 1154 CG1 VAL A 74 112.107 8.023 -1.082 1.00 0.00 C ATOM 1155 CG2 VAL A 74 112.683 10.223 -0.049 1.00 0.00 C ATOM 0 H VAL A 74 114.783 10.952 -0.870 1.00 0.00 H new ATOM 0 HA VAL A 74 114.605 8.123 -0.380 1.00 0.00 H new ATOM 0 HB VAL A 74 112.779 9.766 -2.156 1.00 0.00 H new ATOM 0 HG11 VAL A 74 111.057 8.315 -1.112 1.00 0.00 H new ATOM 0 HG12 VAL A 74 112.318 7.342 -1.907 1.00 0.00 H new ATOM 0 HG13 VAL A 74 112.318 7.524 -0.136 1.00 0.00 H new ATOM 0 HG21 VAL A 74 111.632 10.511 -0.080 1.00 0.00 H new ATOM 0 HG22 VAL A 74 112.895 9.725 0.897 1.00 0.00 H new ATOM 0 HG23 VAL A 74 113.306 11.113 -0.138 1.00 0.00 H new ATOM 1165 N ILE A 75 114.703 9.000 -3.575 1.00 0.00 N ATOM 1166 CA ILE A 75 115.118 8.475 -4.900 1.00 0.00 C ATOM 1167 C ILE A 75 116.567 8.019 -4.790 1.00 0.00 C ATOM 1168 O ILE A 75 117.026 7.196 -5.542 1.00 0.00 O ATOM 1169 CB ILE A 75 115.007 9.569 -5.965 1.00 0.00 C ATOM 1170 CG1 ILE A 75 115.646 10.862 -5.439 1.00 0.00 C ATOM 1171 CG2 ILE A 75 113.533 9.816 -6.302 1.00 0.00 C ATOM 1172 CD1 ILE A 75 116.827 11.250 -6.331 1.00 0.00 C ATOM 0 H ILE A 75 114.294 9.934 -3.581 1.00 0.00 H new ATOM 0 HA ILE A 75 114.472 7.646 -5.190 1.00 0.00 H new ATOM 0 HB ILE A 75 115.529 9.251 -6.867 1.00 0.00 H new ATOM 0 HG12 ILE A 75 114.909 11.665 -5.425 1.00 0.00 H new ATOM 0 HG13 ILE A 75 115.983 10.721 -4.412 1.00 0.00 H new ATOM 0 HG21 ILE A 75 113.459 10.595 -7.060 1.00 0.00 H new ATOM 0 HG22 ILE A 75 113.088 8.897 -6.682 1.00 0.00 H new ATOM 0 HG23 ILE A 75 113.002 10.132 -5.404 1.00 0.00 H new ATOM 0 HD11 ILE A 75 117.280 12.168 -5.956 1.00 0.00 H new ATOM 0 HD12 ILE A 75 117.568 10.450 -6.322 1.00 0.00 H new ATOM 0 HD13 ILE A 75 116.476 11.408 -7.351 1.00 0.00 H new ATOM 1184 N GLU A 76 117.294 8.558 -3.851 1.00 0.00 N ATOM 1185 CA GLU A 76 118.716 8.152 -3.693 1.00 0.00 C ATOM 1186 C GLU A 76 118.787 6.652 -3.426 1.00 0.00 C ATOM 1187 O GLU A 76 119.596 5.952 -4.002 1.00 0.00 O ATOM 1188 CB GLU A 76 119.348 8.902 -2.520 1.00 0.00 C ATOM 1189 CG GLU A 76 120.863 8.981 -2.722 1.00 0.00 C ATOM 1190 CD GLU A 76 121.178 9.977 -3.839 1.00 0.00 C ATOM 1191 OE1 GLU A 76 120.288 10.726 -4.206 1.00 0.00 O ATOM 1192 OE2 GLU A 76 122.304 9.975 -4.308 1.00 0.00 O ATOM 0 H GLU A 76 116.965 9.260 -3.188 1.00 0.00 H new ATOM 0 HA GLU A 76 119.259 8.393 -4.607 1.00 0.00 H new ATOM 0 HB2 GLU A 76 118.927 9.905 -2.447 1.00 0.00 H new ATOM 0 HB3 GLU A 76 119.121 8.392 -1.584 1.00 0.00 H new ATOM 0 HG2 GLU A 76 121.348 9.291 -1.796 1.00 0.00 H new ATOM 0 HG3 GLU A 76 121.259 7.997 -2.975 1.00 0.00 H new ATOM 1199 N PHE A 77 117.955 6.139 -2.555 1.00 0.00 N ATOM 1200 CA PHE A 77 118.015 4.680 -2.280 1.00 0.00 C ATOM 1201 C PHE A 77 117.490 3.910 -3.494 1.00 0.00 C ATOM 1202 O PHE A 77 118.205 3.118 -4.074 1.00 0.00 O ATOM 1203 CB PHE A 77 117.190 4.347 -1.034 1.00 0.00 C ATOM 1204 CG PHE A 77 115.872 3.731 -1.430 1.00 0.00 C ATOM 1205 CD1 PHE A 77 115.799 2.366 -1.734 1.00 0.00 C ATOM 1206 CD2 PHE A 77 114.724 4.524 -1.488 1.00 0.00 C ATOM 1207 CE1 PHE A 77 114.574 1.798 -2.096 1.00 0.00 C ATOM 1208 CE2 PHE A 77 113.500 3.958 -1.851 1.00 0.00 C ATOM 1209 CZ PHE A 77 113.425 2.595 -2.154 1.00 0.00 C ATOM 0 H PHE A 77 117.250 6.660 -2.033 1.00 0.00 H new ATOM 0 HA PHE A 77 119.049 4.387 -2.096 1.00 0.00 H new ATOM 0 HB2 PHE A 77 117.744 3.659 -0.396 1.00 0.00 H new ATOM 0 HB3 PHE A 77 117.016 5.252 -0.452 1.00 0.00 H new ATOM 0 HD1 PHE A 77 116.687 1.753 -1.689 1.00 0.00 H new ATOM 0 HD2 PHE A 77 114.783 5.576 -1.252 1.00 0.00 H new ATOM 0 HE1 PHE A 77 114.514 0.745 -2.331 1.00 0.00 H new ATOM 0 HE2 PHE A 77 112.613 4.572 -1.898 1.00 0.00 H new ATOM 0 HZ PHE A 77 112.478 2.156 -2.433 1.00 0.00 H new ATOM 1219 N PHE A 78 116.261 4.123 -3.906 1.00 0.00 N ATOM 1220 CA PHE A 78 115.776 3.365 -5.093 1.00 0.00 C ATOM 1221 C PHE A 78 116.701 3.646 -6.282 1.00 0.00 C ATOM 1222 O PHE A 78 117.076 2.751 -7.010 1.00 0.00 O ATOM 1223 CB PHE A 78 114.345 3.775 -5.442 1.00 0.00 C ATOM 1224 CG PHE A 78 113.760 2.794 -6.442 1.00 0.00 C ATOM 1225 CD1 PHE A 78 113.945 1.410 -6.278 1.00 0.00 C ATOM 1226 CD2 PHE A 78 113.030 3.270 -7.538 1.00 0.00 C ATOM 1227 CE1 PHE A 78 113.399 0.516 -7.207 1.00 0.00 C ATOM 1228 CE2 PHE A 78 112.485 2.372 -8.464 1.00 0.00 C ATOM 1229 CZ PHE A 78 112.669 0.996 -8.298 1.00 0.00 C ATOM 0 H PHE A 78 115.594 4.769 -3.484 1.00 0.00 H new ATOM 0 HA PHE A 78 115.783 2.300 -4.863 1.00 0.00 H new ATOM 0 HB2 PHE A 78 113.733 3.798 -4.540 1.00 0.00 H new ATOM 0 HB3 PHE A 78 114.337 4.782 -5.859 1.00 0.00 H new ATOM 0 HD1 PHE A 78 114.508 1.036 -5.436 1.00 0.00 H new ATOM 0 HD2 PHE A 78 112.887 4.332 -7.669 1.00 0.00 H new ATOM 0 HE1 PHE A 78 113.542 -0.547 -7.080 1.00 0.00 H new ATOM 0 HE2 PHE A 78 111.922 2.743 -9.308 1.00 0.00 H new ATOM 0 HZ PHE A 78 112.247 0.304 -9.012 1.00 0.00 H new ATOM 1239 N ASN A 79 117.079 4.879 -6.479 1.00 0.00 N ATOM 1240 CA ASN A 79 117.991 5.208 -7.616 1.00 0.00 C ATOM 1241 C ASN A 79 119.207 4.295 -7.556 1.00 0.00 C ATOM 1242 O ASN A 79 119.622 3.725 -8.545 1.00 0.00 O ATOM 1243 CB ASN A 79 118.461 6.662 -7.511 1.00 0.00 C ATOM 1244 CG ASN A 79 119.523 6.932 -8.578 1.00 0.00 C ATOM 1245 OD1 ASN A 79 119.904 6.042 -9.312 1.00 0.00 O ATOM 1246 ND2 ASN A 79 120.021 8.133 -8.697 1.00 0.00 N ATOM 0 H ASN A 79 116.798 5.673 -5.904 1.00 0.00 H new ATOM 0 HA ASN A 79 117.455 5.068 -8.555 1.00 0.00 H new ATOM 0 HB2 ASN A 79 117.617 7.339 -7.643 1.00 0.00 H new ATOM 0 HB3 ASN A 79 118.870 6.853 -6.519 1.00 0.00 H new ATOM 0 HD21 ASN A 79 120.729 8.323 -9.406 1.00 0.00 H new ATOM 0 HD22 ASN A 79 119.702 8.881 -8.081 1.00 0.00 H new ATOM 1253 N LYS A 80 119.784 4.150 -6.401 1.00 0.00 N ATOM 1254 CA LYS A 80 120.970 3.270 -6.278 1.00 0.00 C ATOM 1255 C LYS A 80 120.526 1.820 -6.462 1.00 0.00 C ATOM 1256 O LYS A 80 121.266 0.990 -6.948 1.00 0.00 O ATOM 1257 CB LYS A 80 121.598 3.450 -4.897 1.00 0.00 C ATOM 1258 CG LYS A 80 122.514 4.678 -4.912 1.00 0.00 C ATOM 1259 CD LYS A 80 123.887 4.294 -5.472 1.00 0.00 C ATOM 1260 CE LYS A 80 124.517 3.220 -4.587 1.00 0.00 C ATOM 1261 NZ LYS A 80 125.981 3.473 -4.462 1.00 0.00 N ATOM 0 H LYS A 80 119.485 4.603 -5.537 1.00 0.00 H new ATOM 0 HA LYS A 80 121.708 3.528 -7.038 1.00 0.00 H new ATOM 0 HB2 LYS A 80 120.819 3.572 -4.144 1.00 0.00 H new ATOM 0 HB3 LYS A 80 122.167 2.561 -4.625 1.00 0.00 H new ATOM 0 HG2 LYS A 80 122.071 5.466 -5.520 1.00 0.00 H new ATOM 0 HG3 LYS A 80 122.621 5.076 -3.903 1.00 0.00 H new ATOM 0 HD2 LYS A 80 123.785 3.925 -6.493 1.00 0.00 H new ATOM 0 HD3 LYS A 80 124.533 5.171 -5.513 1.00 0.00 H new ATOM 0 HE2 LYS A 80 124.051 3.226 -3.602 1.00 0.00 H new ATOM 0 HE3 LYS A 80 124.343 2.233 -5.015 1.00 0.00 H new ATOM 0 HZ1 LYS A 80 126.409 2.742 -3.859 1.00 0.00 H new ATOM 0 HZ2 LYS A 80 126.420 3.446 -5.405 1.00 0.00 H new ATOM 0 HZ3 LYS A 80 126.136 4.408 -4.035 1.00 0.00 H new ATOM 1275 N LEU A 81 119.318 1.509 -6.079 1.00 0.00 N ATOM 1276 CA LEU A 81 118.832 0.110 -6.235 1.00 0.00 C ATOM 1277 C LEU A 81 118.623 -0.205 -7.723 1.00 0.00 C ATOM 1278 O LEU A 81 119.152 -1.165 -8.239 1.00 0.00 O ATOM 1279 CB LEU A 81 117.504 -0.066 -5.477 1.00 0.00 C ATOM 1280 CG LEU A 81 117.689 0.166 -3.965 1.00 0.00 C ATOM 1281 CD1 LEU A 81 116.834 -0.840 -3.194 1.00 0.00 C ATOM 1282 CD2 LEU A 81 119.158 -0.009 -3.549 1.00 0.00 C ATOM 0 H LEU A 81 118.650 2.160 -5.667 1.00 0.00 H new ATOM 0 HA LEU A 81 119.574 -0.574 -5.824 1.00 0.00 H new ATOM 0 HB2 LEU A 81 116.765 0.633 -5.867 1.00 0.00 H new ATOM 0 HB3 LEU A 81 117.115 -1.070 -5.648 1.00 0.00 H new ATOM 0 HG LEU A 81 117.383 1.187 -3.737 1.00 0.00 H new ATOM 0 HD11 LEU A 81 116.961 -0.680 -2.123 1.00 0.00 H new ATOM 0 HD12 LEU A 81 115.785 -0.705 -3.459 1.00 0.00 H new ATOM 0 HD13 LEU A 81 117.145 -1.853 -3.449 1.00 0.00 H new ATOM 0 HD21 LEU A 81 119.255 0.161 -2.477 1.00 0.00 H new ATOM 0 HD22 LEU A 81 119.485 -1.021 -3.787 1.00 0.00 H new ATOM 0 HD23 LEU A 81 119.777 0.709 -4.088 1.00 0.00 H new ATOM 1294 N VAL A 82 117.857 0.582 -8.421 1.00 0.00 N ATOM 1295 CA VAL A 82 117.621 0.297 -9.866 1.00 0.00 C ATOM 1296 C VAL A 82 118.932 0.368 -10.660 1.00 0.00 C ATOM 1297 O VAL A 82 119.210 -0.477 -11.480 1.00 0.00 O ATOM 1298 CB VAL A 82 116.634 1.321 -10.424 1.00 0.00 C ATOM 1299 CG1 VAL A 82 115.202 0.900 -10.069 1.00 0.00 C ATOM 1300 CG2 VAL A 82 116.934 2.695 -9.815 1.00 0.00 C ATOM 0 H VAL A 82 117.384 1.409 -8.057 1.00 0.00 H new ATOM 0 HA VAL A 82 117.214 -0.710 -9.961 1.00 0.00 H new ATOM 0 HB VAL A 82 116.734 1.373 -11.508 1.00 0.00 H new ATOM 0 HG11 VAL A 82 114.498 1.631 -10.467 1.00 0.00 H new ATOM 0 HG12 VAL A 82 114.993 -0.078 -10.502 1.00 0.00 H new ATOM 0 HG13 VAL A 82 115.096 0.848 -8.985 1.00 0.00 H new ATOM 0 HG21 VAL A 82 116.232 3.429 -10.210 1.00 0.00 H new ATOM 0 HG22 VAL A 82 116.832 2.643 -8.731 1.00 0.00 H new ATOM 0 HG23 VAL A 82 117.951 2.992 -10.070 1.00 0.00 H new ATOM 1310 N THR A 83 119.729 1.376 -10.454 1.00 0.00 N ATOM 1311 CA THR A 83 120.997 1.480 -11.238 1.00 0.00 C ATOM 1312 C THR A 83 122.089 0.559 -10.666 1.00 0.00 C ATOM 1313 O THR A 83 122.788 -0.109 -11.402 1.00 0.00 O ATOM 1314 CB THR A 83 121.484 2.930 -11.220 1.00 0.00 C ATOM 1315 OG1 THR A 83 122.258 3.181 -12.385 1.00 0.00 O ATOM 1316 CG2 THR A 83 122.338 3.168 -9.979 1.00 0.00 C ATOM 0 H THR A 83 119.564 2.128 -9.785 1.00 0.00 H new ATOM 0 HA THR A 83 120.795 1.165 -12.262 1.00 0.00 H new ATOM 0 HB THR A 83 120.626 3.602 -11.200 1.00 0.00 H new ATOM 0 HG1 THR A 83 122.570 4.110 -12.377 1.00 0.00 H new ATOM 0 HG21 THR A 83 122.684 4.202 -9.968 1.00 0.00 H new ATOM 0 HG22 THR A 83 121.744 2.975 -9.086 1.00 0.00 H new ATOM 0 HG23 THR A 83 123.198 2.498 -9.995 1.00 0.00 H new ATOM 1324 N SER A 84 122.268 0.538 -9.373 1.00 0.00 N ATOM 1325 CA SER A 84 123.346 -0.316 -8.779 1.00 0.00 C ATOM 1326 C SER A 84 122.943 -1.795 -8.738 1.00 0.00 C ATOM 1327 O SER A 84 123.787 -2.665 -8.650 1.00 0.00 O ATOM 1328 CB SER A 84 123.639 0.154 -7.354 1.00 0.00 C ATOM 1329 OG SER A 84 123.423 1.557 -7.266 1.00 0.00 O ATOM 0 H SER A 84 121.718 1.072 -8.701 1.00 0.00 H new ATOM 0 HA SER A 84 124.231 -0.219 -9.408 1.00 0.00 H new ATOM 0 HB2 SER A 84 122.995 -0.369 -6.647 1.00 0.00 H new ATOM 0 HB3 SER A 84 124.668 -0.084 -7.085 1.00 0.00 H new ATOM 0 HG SER A 84 122.516 1.768 -7.570 1.00 0.00 H new ATOM 1335 N PHE A 85 121.676 -2.098 -8.759 1.00 0.00 N ATOM 1336 CA PHE A 85 121.265 -3.531 -8.674 1.00 0.00 C ATOM 1337 C PHE A 85 121.604 -4.297 -9.957 1.00 0.00 C ATOM 1338 O PHE A 85 121.242 -5.442 -10.104 1.00 0.00 O ATOM 1339 CB PHE A 85 119.766 -3.640 -8.373 1.00 0.00 C ATOM 1340 CG PHE A 85 118.942 -3.474 -9.632 1.00 0.00 C ATOM 1341 CD1 PHE A 85 119.468 -2.837 -10.766 1.00 0.00 C ATOM 1342 CD2 PHE A 85 117.646 -3.991 -9.667 1.00 0.00 C ATOM 1343 CE1 PHE A 85 118.694 -2.725 -11.927 1.00 0.00 C ATOM 1344 CE2 PHE A 85 116.873 -3.872 -10.825 1.00 0.00 C ATOM 1345 CZ PHE A 85 117.397 -3.242 -11.957 1.00 0.00 C ATOM 0 H PHE A 85 120.913 -1.425 -8.830 1.00 0.00 H new ATOM 0 HA PHE A 85 121.828 -3.985 -7.858 1.00 0.00 H new ATOM 0 HB2 PHE A 85 119.553 -4.608 -7.920 1.00 0.00 H new ATOM 0 HB3 PHE A 85 119.482 -2.879 -7.646 1.00 0.00 H new ATOM 0 HD1 PHE A 85 120.469 -2.433 -10.743 1.00 0.00 H new ATOM 0 HD2 PHE A 85 117.239 -4.484 -8.797 1.00 0.00 H new ATOM 0 HE1 PHE A 85 119.101 -2.238 -12.801 1.00 0.00 H new ATOM 0 HE2 PHE A 85 115.868 -4.268 -10.845 1.00 0.00 H new ATOM 0 HZ PHE A 85 116.800 -3.155 -12.853 1.00 0.00 H new ATOM 1355 N ASP A 86 122.289 -3.702 -10.892 1.00 0.00 N ATOM 1356 CA ASP A 86 122.617 -4.470 -12.124 1.00 0.00 C ATOM 1357 C ASP A 86 123.940 -5.211 -11.917 1.00 0.00 C ATOM 1358 O ASP A 86 124.501 -5.778 -12.833 1.00 0.00 O ATOM 1359 CB ASP A 86 122.717 -3.546 -13.332 1.00 0.00 C ATOM 1360 CG ASP A 86 123.422 -2.248 -12.934 1.00 0.00 C ATOM 1361 OD1 ASP A 86 124.302 -2.308 -12.092 1.00 0.00 O ATOM 1362 OD2 ASP A 86 123.069 -1.215 -13.479 1.00 0.00 O ATOM 0 H ASP A 86 122.629 -2.741 -10.860 1.00 0.00 H new ATOM 0 HA ASP A 86 121.819 -5.187 -12.316 1.00 0.00 H new ATOM 0 HB2 ASP A 86 123.267 -4.039 -14.134 1.00 0.00 H new ATOM 0 HB3 ASP A 86 121.721 -3.327 -13.717 1.00 0.00 H new ATOM 1367 N PHE A 87 124.423 -5.229 -10.705 1.00 0.00 N ATOM 1368 CA PHE A 87 125.690 -5.953 -10.400 1.00 0.00 C ATOM 1369 C PHE A 87 125.481 -6.735 -9.102 1.00 0.00 C ATOM 1370 O PHE A 87 125.290 -7.935 -9.111 1.00 0.00 O ATOM 1371 CB PHE A 87 126.851 -4.952 -10.239 1.00 0.00 C ATOM 1372 CG PHE A 87 127.668 -5.286 -9.004 1.00 0.00 C ATOM 1373 CD1 PHE A 87 128.018 -6.615 -8.725 1.00 0.00 C ATOM 1374 CD2 PHE A 87 128.060 -4.267 -8.122 1.00 0.00 C ATOM 1375 CE1 PHE A 87 128.747 -6.917 -7.575 1.00 0.00 C ATOM 1376 CE2 PHE A 87 128.798 -4.577 -6.974 1.00 0.00 C ATOM 1377 CZ PHE A 87 129.138 -5.903 -6.703 1.00 0.00 C ATOM 0 H PHE A 87 123.990 -4.768 -9.905 1.00 0.00 H new ATOM 0 HA PHE A 87 125.944 -6.632 -11.214 1.00 0.00 H new ATOM 0 HB2 PHE A 87 127.488 -4.979 -11.123 1.00 0.00 H new ATOM 0 HB3 PHE A 87 126.458 -3.938 -10.160 1.00 0.00 H new ATOM 0 HD1 PHE A 87 127.723 -7.404 -9.400 1.00 0.00 H new ATOM 0 HD2 PHE A 87 127.792 -3.242 -8.330 1.00 0.00 H new ATOM 0 HE1 PHE A 87 129.010 -7.942 -7.359 1.00 0.00 H new ATOM 0 HE2 PHE A 87 129.104 -3.791 -6.299 1.00 0.00 H new ATOM 0 HZ PHE A 87 129.705 -6.144 -5.816 1.00 0.00 H new ATOM 1387 N ASP A 88 125.514 -6.060 -7.987 1.00 0.00 N ATOM 1388 CA ASP A 88 125.312 -6.755 -6.688 1.00 0.00 C ATOM 1389 C ASP A 88 123.830 -6.707 -6.326 1.00 0.00 C ATOM 1390 O ASP A 88 123.385 -5.847 -5.592 1.00 0.00 O ATOM 1391 CB ASP A 88 126.118 -6.049 -5.603 1.00 0.00 C ATOM 1392 CG ASP A 88 126.083 -4.540 -5.851 1.00 0.00 C ATOM 1393 OD1 ASP A 88 125.145 -4.086 -6.485 1.00 0.00 O ATOM 1394 OD2 ASP A 88 126.992 -3.864 -5.404 1.00 0.00 O ATOM 0 H ASP A 88 125.673 -5.055 -7.921 1.00 0.00 H new ATOM 0 HA ASP A 88 125.642 -7.791 -6.769 1.00 0.00 H new ATOM 0 HB2 ASP A 88 125.706 -6.278 -4.620 1.00 0.00 H new ATOM 0 HB3 ASP A 88 127.148 -6.406 -5.608 1.00 0.00 H new ATOM 1399 N LEU A 89 123.063 -7.620 -6.842 1.00 0.00 N ATOM 1400 CA LEU A 89 121.610 -7.630 -6.542 1.00 0.00 C ATOM 1401 C LEU A 89 121.403 -7.735 -5.032 1.00 0.00 C ATOM 1402 O LEU A 89 120.726 -6.927 -4.433 1.00 0.00 O ATOM 1403 CB LEU A 89 120.956 -8.828 -7.236 1.00 0.00 C ATOM 1404 CG LEU A 89 121.394 -8.921 -8.715 1.00 0.00 C ATOM 1405 CD1 LEU A 89 122.055 -7.623 -9.186 1.00 0.00 C ATOM 1406 CD2 LEU A 89 122.393 -10.061 -8.901 1.00 0.00 C ATOM 0 H LEU A 89 123.382 -8.364 -7.462 1.00 0.00 H new ATOM 0 HA LEU A 89 121.155 -6.708 -6.905 1.00 0.00 H new ATOM 0 HB2 LEU A 89 121.227 -9.746 -6.715 1.00 0.00 H new ATOM 0 HB3 LEU A 89 119.871 -8.737 -7.180 1.00 0.00 H new ATOM 0 HG LEU A 89 120.496 -9.102 -9.306 1.00 0.00 H new ATOM 0 HD11 LEU A 89 122.351 -7.723 -10.230 1.00 0.00 H new ATOM 0 HD12 LEU A 89 121.349 -6.798 -9.086 1.00 0.00 H new ATOM 0 HD13 LEU A 89 122.936 -7.422 -8.577 1.00 0.00 H new ATOM 0 HD21 LEU A 89 122.693 -10.115 -9.948 1.00 0.00 H new ATOM 0 HD22 LEU A 89 123.271 -9.880 -8.281 1.00 0.00 H new ATOM 0 HD23 LEU A 89 121.929 -11.003 -8.608 1.00 0.00 H new ATOM 1418 N GLU A 90 121.967 -8.734 -4.418 1.00 0.00 N ATOM 1419 CA GLU A 90 121.791 -8.905 -2.948 1.00 0.00 C ATOM 1420 C GLU A 90 122.730 -7.975 -2.158 1.00 0.00 C ATOM 1421 O GLU A 90 122.324 -7.329 -1.210 1.00 0.00 O ATOM 1422 CB GLU A 90 122.094 -10.359 -2.578 1.00 0.00 C ATOM 1423 CG GLU A 90 121.820 -11.261 -3.783 1.00 0.00 C ATOM 1424 CD GLU A 90 121.940 -12.727 -3.361 1.00 0.00 C ATOM 1425 OE1 GLU A 90 122.822 -13.025 -2.572 1.00 0.00 O ATOM 1426 OE2 GLU A 90 121.149 -13.525 -3.835 1.00 0.00 O ATOM 0 H GLU A 90 122.544 -9.443 -4.870 1.00 0.00 H new ATOM 0 HA GLU A 90 120.763 -8.648 -2.691 1.00 0.00 H new ATOM 0 HB2 GLU A 90 123.134 -10.457 -2.266 1.00 0.00 H new ATOM 0 HB3 GLU A 90 121.478 -10.666 -1.733 1.00 0.00 H new ATOM 0 HG2 GLU A 90 120.823 -11.066 -4.178 1.00 0.00 H new ATOM 0 HG3 GLU A 90 122.528 -11.043 -4.583 1.00 0.00 H new ATOM 1433 N ILE A 91 123.987 -7.935 -2.510 1.00 0.00 N ATOM 1434 CA ILE A 91 124.958 -7.089 -1.743 1.00 0.00 C ATOM 1435 C ILE A 91 124.781 -5.593 -2.045 1.00 0.00 C ATOM 1436 O ILE A 91 125.007 -4.755 -1.192 1.00 0.00 O ATOM 1437 CB ILE A 91 126.385 -7.508 -2.112 1.00 0.00 C ATOM 1438 CG1 ILE A 91 126.367 -8.936 -2.668 1.00 0.00 C ATOM 1439 CG2 ILE A 91 127.278 -7.453 -0.871 1.00 0.00 C ATOM 1440 CD1 ILE A 91 127.771 -9.539 -2.599 1.00 0.00 C ATOM 0 H ILE A 91 124.387 -8.450 -3.294 1.00 0.00 H new ATOM 0 HA ILE A 91 124.770 -7.241 -0.680 1.00 0.00 H new ATOM 0 HB ILE A 91 126.778 -6.827 -2.866 1.00 0.00 H new ATOM 0 HG12 ILE A 91 125.670 -9.549 -2.097 1.00 0.00 H new ATOM 0 HG13 ILE A 91 126.015 -8.930 -3.699 1.00 0.00 H new ATOM 0 HG21 ILE A 91 128.292 -7.752 -1.139 1.00 0.00 H new ATOM 0 HG22 ILE A 91 127.291 -6.437 -0.477 1.00 0.00 H new ATOM 0 HG23 ILE A 91 126.888 -8.131 -0.112 1.00 0.00 H new ATOM 0 HD11 ILE A 91 127.751 -10.554 -2.996 1.00 0.00 H new ATOM 0 HD12 ILE A 91 128.457 -8.932 -3.190 1.00 0.00 H new ATOM 0 HD13 ILE A 91 128.107 -9.561 -1.562 1.00 0.00 H new ATOM 1452 N GLY A 92 124.412 -5.243 -3.244 1.00 0.00 N ATOM 1453 CA GLY A 92 124.265 -3.797 -3.580 1.00 0.00 C ATOM 1454 C GLY A 92 123.232 -3.133 -2.667 1.00 0.00 C ATOM 1455 O GLY A 92 123.439 -2.043 -2.173 1.00 0.00 O ATOM 0 H GLY A 92 124.206 -5.891 -4.004 1.00 0.00 H new ATOM 0 HA2 GLY A 92 125.227 -3.294 -3.476 1.00 0.00 H new ATOM 0 HA3 GLY A 92 123.960 -3.689 -4.621 1.00 0.00 H new ATOM 1459 N LYS A 93 122.115 -3.767 -2.457 1.00 0.00 N ATOM 1460 CA LYS A 93 121.060 -3.159 -1.595 1.00 0.00 C ATOM 1461 C LYS A 93 121.426 -3.321 -0.116 1.00 0.00 C ATOM 1462 O LYS A 93 120.967 -2.581 0.730 1.00 0.00 O ATOM 1463 CB LYS A 93 119.708 -3.844 -1.860 1.00 0.00 C ATOM 1464 CG LYS A 93 119.794 -4.753 -3.093 1.00 0.00 C ATOM 1465 CD LYS A 93 119.689 -3.917 -4.374 1.00 0.00 C ATOM 1466 CE LYS A 93 121.043 -3.282 -4.691 1.00 0.00 C ATOM 1467 NZ LYS A 93 121.035 -2.764 -6.084 1.00 0.00 N ATOM 0 H LYS A 93 121.884 -4.682 -2.845 1.00 0.00 H new ATOM 0 HA LYS A 93 120.985 -2.098 -1.833 1.00 0.00 H new ATOM 0 HB2 LYS A 93 119.415 -4.430 -0.989 1.00 0.00 H new ATOM 0 HB3 LYS A 93 118.936 -3.090 -2.011 1.00 0.00 H new ATOM 0 HG2 LYS A 93 120.736 -5.302 -3.084 1.00 0.00 H new ATOM 0 HG3 LYS A 93 118.994 -5.492 -3.066 1.00 0.00 H new ATOM 0 HD2 LYS A 93 119.369 -4.546 -5.204 1.00 0.00 H new ATOM 0 HD3 LYS A 93 118.933 -3.141 -4.252 1.00 0.00 H new ATOM 0 HE2 LYS A 93 121.249 -2.472 -3.992 1.00 0.00 H new ATOM 0 HE3 LYS A 93 121.838 -4.017 -4.570 1.00 0.00 H new ATOM 0 HZ1 LYS A 93 121.614 -1.902 -6.137 1.00 0.00 H new ATOM 0 HZ2 LYS A 93 121.426 -3.484 -6.724 1.00 0.00 H new ATOM 0 HZ3 LYS A 93 120.059 -2.543 -6.367 1.00 0.00 H new ATOM 1481 N GLY A 94 122.225 -4.296 0.208 1.00 0.00 N ATOM 1482 CA GLY A 94 122.584 -4.518 1.638 1.00 0.00 C ATOM 1483 C GLY A 94 123.358 -3.322 2.222 1.00 0.00 C ATOM 1484 O GLY A 94 123.030 -2.833 3.286 1.00 0.00 O ATOM 0 H GLY A 94 122.646 -4.949 -0.453 1.00 0.00 H new ATOM 0 HA2 GLY A 94 121.677 -4.684 2.220 1.00 0.00 H new ATOM 0 HA3 GLY A 94 123.188 -5.421 1.726 1.00 0.00 H new ATOM 1488 N GLU A 95 124.393 -2.858 1.566 1.00 0.00 N ATOM 1489 CA GLU A 95 125.181 -1.713 2.134 1.00 0.00 C ATOM 1490 C GLU A 95 124.553 -0.370 1.746 1.00 0.00 C ATOM 1491 O GLU A 95 124.471 0.545 2.545 1.00 0.00 O ATOM 1492 CB GLU A 95 126.622 -1.772 1.606 1.00 0.00 C ATOM 1493 CG GLU A 95 127.227 -0.360 1.561 1.00 0.00 C ATOM 1494 CD GLU A 95 126.771 0.350 0.285 1.00 0.00 C ATOM 1495 OE1 GLU A 95 126.604 -0.326 -0.717 1.00 0.00 O ATOM 1496 OE2 GLU A 95 126.598 1.556 0.331 1.00 0.00 O ATOM 0 H GLU A 95 124.726 -3.216 0.671 1.00 0.00 H new ATOM 0 HA GLU A 95 125.177 -1.797 3.221 1.00 0.00 H new ATOM 0 HB2 GLU A 95 127.226 -2.414 2.247 1.00 0.00 H new ATOM 0 HB3 GLU A 95 126.634 -2.213 0.609 1.00 0.00 H new ATOM 0 HG2 GLU A 95 126.916 0.209 2.437 1.00 0.00 H new ATOM 0 HG3 GLU A 95 128.315 -0.418 1.589 1.00 0.00 H new ATOM 1503 N THR A 96 124.131 -0.227 0.527 1.00 0.00 N ATOM 1504 CA THR A 96 123.539 1.070 0.107 1.00 0.00 C ATOM 1505 C THR A 96 122.483 1.515 1.123 1.00 0.00 C ATOM 1506 O THR A 96 122.463 2.650 1.561 1.00 0.00 O ATOM 1507 CB THR A 96 122.900 0.915 -1.271 1.00 0.00 C ATOM 1508 OG1 THR A 96 122.226 -0.333 -1.342 1.00 0.00 O ATOM 1509 CG2 THR A 96 123.994 0.972 -2.338 1.00 0.00 C ATOM 0 H THR A 96 124.169 -0.946 -0.195 1.00 0.00 H new ATOM 0 HA THR A 96 124.323 1.825 0.059 1.00 0.00 H new ATOM 0 HB THR A 96 122.184 1.719 -1.439 1.00 0.00 H new ATOM 0 HG1 THR A 96 122.683 -0.916 -1.984 1.00 0.00 H new ATOM 0 HG21 THR A 96 123.545 0.862 -3.325 1.00 0.00 H new ATOM 0 HG22 THR A 96 124.510 1.930 -2.279 1.00 0.00 H new ATOM 0 HG23 THR A 96 124.707 0.165 -2.171 1.00 0.00 H new ATOM 1517 N MET A 97 121.613 0.625 1.502 1.00 0.00 N ATOM 1518 CA MET A 97 120.550 0.974 2.487 1.00 0.00 C ATOM 1519 C MET A 97 121.177 1.583 3.745 1.00 0.00 C ATOM 1520 O MET A 97 120.549 2.340 4.467 1.00 0.00 O ATOM 1521 CB MET A 97 119.811 -0.308 2.870 1.00 0.00 C ATOM 1522 CG MET A 97 120.660 -1.107 3.863 1.00 0.00 C ATOM 1523 SD MET A 97 120.400 -0.464 5.535 1.00 0.00 S ATOM 1524 CE MET A 97 119.860 -2.016 6.293 1.00 0.00 C ATOM 0 H MET A 97 121.591 -0.339 1.170 1.00 0.00 H new ATOM 0 HA MET A 97 119.865 1.698 2.046 1.00 0.00 H new ATOM 0 HB2 MET A 97 118.845 -0.066 3.313 1.00 0.00 H new ATOM 0 HB3 MET A 97 119.613 -0.906 1.981 1.00 0.00 H new ATOM 0 HG2 MET A 97 120.390 -2.162 3.822 1.00 0.00 H new ATOM 0 HG3 MET A 97 121.714 -1.037 3.595 1.00 0.00 H new ATOM 0 HE1 MET A 97 119.574 -1.835 7.329 1.00 0.00 H new ATOM 0 HE2 MET A 97 119.005 -2.411 5.744 1.00 0.00 H new ATOM 0 HE3 MET A 97 120.676 -2.739 6.263 1.00 0.00 H new ATOM 1534 N LYS A 98 122.404 1.246 4.023 1.00 0.00 N ATOM 1535 CA LYS A 98 123.066 1.779 5.246 1.00 0.00 C ATOM 1536 C LYS A 98 123.470 3.238 5.051 1.00 0.00 C ATOM 1537 O LYS A 98 123.342 4.041 5.952 1.00 0.00 O ATOM 1538 CB LYS A 98 124.316 0.952 5.553 1.00 0.00 C ATOM 1539 CG LYS A 98 123.960 -0.177 6.522 1.00 0.00 C ATOM 1540 CD LYS A 98 125.144 -1.138 6.644 1.00 0.00 C ATOM 1541 CE LYS A 98 124.693 -2.418 7.351 1.00 0.00 C ATOM 1542 NZ LYS A 98 125.684 -3.502 7.095 1.00 0.00 N ATOM 0 H LYS A 98 122.979 0.623 3.455 1.00 0.00 H new ATOM 0 HA LYS A 98 122.361 1.715 6.074 1.00 0.00 H new ATOM 0 HB2 LYS A 98 124.726 0.538 4.632 1.00 0.00 H new ATOM 0 HB3 LYS A 98 125.087 1.588 5.987 1.00 0.00 H new ATOM 0 HG2 LYS A 98 123.710 0.234 7.500 1.00 0.00 H new ATOM 0 HG3 LYS A 98 123.079 -0.712 6.166 1.00 0.00 H new ATOM 0 HD2 LYS A 98 125.537 -1.375 5.655 1.00 0.00 H new ATOM 0 HD3 LYS A 98 125.952 -0.667 7.203 1.00 0.00 H new ATOM 0 HE2 LYS A 98 124.600 -2.241 8.423 1.00 0.00 H new ATOM 0 HE3 LYS A 98 123.709 -2.718 6.991 1.00 0.00 H new ATOM 0 HZ1 LYS A 98 125.256 -4.423 7.317 1.00 0.00 H new ATOM 0 HZ2 LYS A 98 125.967 -3.484 6.094 1.00 0.00 H new ATOM 0 HZ3 LYS A 98 126.521 -3.356 7.694 1.00 0.00 H new ATOM 1556 N TYR A 99 123.976 3.601 3.904 1.00 0.00 N ATOM 1557 CA TYR A 99 124.390 5.020 3.731 1.00 0.00 C ATOM 1558 C TYR A 99 123.163 5.933 3.780 1.00 0.00 C ATOM 1559 O TYR A 99 123.260 7.072 4.194 1.00 0.00 O ATOM 1560 CB TYR A 99 125.167 5.208 2.421 1.00 0.00 C ATOM 1561 CG TYR A 99 124.230 5.373 1.255 1.00 0.00 C ATOM 1562 CD1 TYR A 99 123.476 6.541 1.108 1.00 0.00 C ATOM 1563 CD2 TYR A 99 124.133 4.353 0.311 1.00 0.00 C ATOM 1564 CE1 TYR A 99 122.620 6.683 0.011 1.00 0.00 C ATOM 1565 CE2 TYR A 99 123.280 4.490 -0.787 1.00 0.00 C ATOM 1566 CZ TYR A 99 122.521 5.657 -0.939 1.00 0.00 C ATOM 1567 OH TYR A 99 121.677 5.798 -2.021 1.00 0.00 O ATOM 0 H TYR A 99 124.118 2.993 3.098 1.00 0.00 H new ATOM 0 HA TYR A 99 125.056 5.292 4.550 1.00 0.00 H new ATOM 0 HB2 TYR A 99 125.812 6.083 2.500 1.00 0.00 H new ATOM 0 HB3 TYR A 99 125.815 4.348 2.252 1.00 0.00 H new ATOM 0 HD1 TYR A 99 123.554 7.332 1.840 1.00 0.00 H new ATOM 0 HD2 TYR A 99 124.719 3.453 0.428 1.00 0.00 H new ATOM 0 HE1 TYR A 99 122.035 7.584 -0.104 1.00 0.00 H new ATOM 0 HE2 TYR A 99 123.206 3.698 -1.517 1.00 0.00 H new ATOM 0 HH TYR A 99 120.757 5.916 -1.705 1.00 0.00 H new ATOM 1577 N ILE A 100 122.004 5.458 3.391 1.00 0.00 N ATOM 1578 CA ILE A 100 120.804 6.346 3.463 1.00 0.00 C ATOM 1579 C ILE A 100 120.457 6.575 4.934 1.00 0.00 C ATOM 1580 O ILE A 100 120.392 7.695 5.399 1.00 0.00 O ATOM 1581 CB ILE A 100 119.614 5.688 2.766 1.00 0.00 C ATOM 1582 CG1 ILE A 100 119.874 5.616 1.262 1.00 0.00 C ATOM 1583 CG2 ILE A 100 118.354 6.519 3.021 1.00 0.00 C ATOM 1584 CD1 ILE A 100 120.802 4.441 0.967 1.00 0.00 C ATOM 0 H ILE A 100 121.839 4.516 3.035 1.00 0.00 H new ATOM 0 HA ILE A 100 121.023 7.292 2.968 1.00 0.00 H new ATOM 0 HB ILE A 100 119.477 4.681 3.159 1.00 0.00 H new ATOM 0 HG12 ILE A 100 118.934 5.496 0.724 1.00 0.00 H new ATOM 0 HG13 ILE A 100 120.324 6.546 0.914 1.00 0.00 H new ATOM 0 HG21 ILE A 100 117.503 6.052 2.525 1.00 0.00 H new ATOM 0 HG22 ILE A 100 118.164 6.573 4.093 1.00 0.00 H new ATOM 0 HG23 ILE A 100 118.496 7.525 2.627 1.00 0.00 H new ATOM 0 HD11 ILE A 100 120.990 4.386 -0.105 1.00 0.00 H new ATOM 0 HD12 ILE A 100 121.746 4.581 1.494 1.00 0.00 H new ATOM 0 HD13 ILE A 100 120.334 3.515 1.301 1.00 0.00 H new ATOM 1596 N LEU A 101 120.251 5.519 5.676 1.00 0.00 N ATOM 1597 CA LEU A 101 119.929 5.683 7.123 1.00 0.00 C ATOM 1598 C LEU A 101 121.161 6.216 7.844 1.00 0.00 C ATOM 1599 O LEU A 101 121.121 7.247 8.487 1.00 0.00 O ATOM 1600 CB LEU A 101 119.548 4.326 7.716 1.00 0.00 C ATOM 1601 CG LEU A 101 118.199 4.437 8.421 1.00 0.00 C ATOM 1602 CD1 LEU A 101 117.750 3.049 8.887 1.00 0.00 C ATOM 1603 CD2 LEU A 101 118.330 5.371 9.626 1.00 0.00 C ATOM 0 H LEU A 101 120.292 4.555 5.345 1.00 0.00 H new ATOM 0 HA LEU A 101 119.097 6.378 7.240 1.00 0.00 H new ATOM 0 HB2 LEU A 101 119.497 3.575 6.928 1.00 0.00 H new ATOM 0 HB3 LEU A 101 120.312 3.998 8.421 1.00 0.00 H new ATOM 0 HG LEU A 101 117.458 4.841 7.731 1.00 0.00 H new ATOM 0 HD11 LEU A 101 116.787 3.128 9.391 1.00 0.00 H new ATOM 0 HD12 LEU A 101 117.656 2.389 8.025 1.00 0.00 H new ATOM 0 HD13 LEU A 101 118.488 2.641 9.578 1.00 0.00 H new ATOM 0 HD21 LEU A 101 117.367 5.451 10.131 1.00 0.00 H new ATOM 0 HD22 LEU A 101 119.070 4.970 10.318 1.00 0.00 H new ATOM 0 HD23 LEU A 101 118.646 6.358 9.289 1.00 0.00 H new ATOM 1615 N ALA A 102 122.260 5.528 7.735 1.00 0.00 N ATOM 1616 CA ALA A 102 123.493 6.003 8.407 1.00 0.00 C ATOM 1617 C ALA A 102 123.717 7.465 8.032 1.00 0.00 C ATOM 1618 O ALA A 102 123.317 8.365 8.744 1.00 0.00 O ATOM 1619 CB ALA A 102 124.688 5.165 7.946 1.00 0.00 C ATOM 0 H ALA A 102 122.356 4.659 7.210 1.00 0.00 H new ATOM 0 HA ALA A 102 123.390 5.906 9.488 1.00 0.00 H new ATOM 0 HB1 ALA A 102 125.592 5.517 8.442 1.00 0.00 H new ATOM 0 HB2 ALA A 102 124.519 4.119 8.200 1.00 0.00 H new ATOM 0 HB3 ALA A 102 124.805 5.261 6.867 1.00 0.00 H new ATOM 1625 N LEU A 103 124.340 7.709 6.912 1.00 0.00 N ATOM 1626 CA LEU A 103 124.586 9.113 6.483 1.00 0.00 C ATOM 1627 C LEU A 103 125.334 9.868 7.584 1.00 0.00 C ATOM 1628 O LEU A 103 125.977 10.866 7.327 1.00 0.00 O ATOM 1629 CB LEU A 103 123.250 9.805 6.204 1.00 0.00 C ATOM 1630 CG LEU A 103 123.493 11.287 5.913 1.00 0.00 C ATOM 1631 CD1 LEU A 103 124.502 11.425 4.772 1.00 0.00 C ATOM 1632 CD2 LEU A 103 122.173 11.949 5.510 1.00 0.00 C ATOM 0 H LEU A 103 124.690 6.994 6.274 1.00 0.00 H new ATOM 0 HA LEU A 103 125.190 9.110 5.576 1.00 0.00 H new ATOM 0 HB2 LEU A 103 122.755 9.333 5.355 1.00 0.00 H new ATOM 0 HB3 LEU A 103 122.586 9.696 7.062 1.00 0.00 H new ATOM 0 HG LEU A 103 123.887 11.773 6.806 1.00 0.00 H new ATOM 0 HD11 LEU A 103 124.675 12.481 4.565 1.00 0.00 H new ATOM 0 HD12 LEU A 103 125.442 10.953 5.058 1.00 0.00 H new ATOM 0 HD13 LEU A 103 124.109 10.940 3.878 1.00 0.00 H new ATOM 0 HD21 LEU A 103 122.344 13.005 5.302 1.00 0.00 H new ATOM 0 HD22 LEU A 103 121.780 11.463 4.617 1.00 0.00 H new ATOM 0 HD23 LEU A 103 121.454 11.851 6.323 1.00 0.00 H new ATOM 1644 N LYS A 104 125.263 9.401 8.807 1.00 0.00 N ATOM 1645 CA LYS A 104 125.982 10.098 9.915 1.00 0.00 C ATOM 1646 C LYS A 104 127.214 10.789 9.331 1.00 0.00 C ATOM 1647 O LYS A 104 127.510 11.927 9.636 1.00 0.00 O ATOM 1648 CB LYS A 104 126.421 9.071 10.964 1.00 0.00 C ATOM 1649 CG LYS A 104 126.434 9.701 12.361 1.00 0.00 C ATOM 1650 CD LYS A 104 125.509 8.914 13.294 1.00 0.00 C ATOM 1651 CE LYS A 104 124.091 8.892 12.717 1.00 0.00 C ATOM 1652 NZ LYS A 104 123.105 9.103 13.813 1.00 0.00 N ATOM 0 H LYS A 104 124.740 8.570 9.084 1.00 0.00 H new ATOM 0 HA LYS A 104 125.327 10.832 10.386 1.00 0.00 H new ATOM 0 HB2 LYS A 104 125.744 8.217 10.950 1.00 0.00 H new ATOM 0 HB3 LYS A 104 127.414 8.695 10.719 1.00 0.00 H new ATOM 0 HG2 LYS A 104 127.449 9.705 12.759 1.00 0.00 H new ATOM 0 HG3 LYS A 104 126.110 10.740 12.304 1.00 0.00 H new ATOM 0 HD2 LYS A 104 125.879 7.896 13.414 1.00 0.00 H new ATOM 0 HD3 LYS A 104 125.502 9.370 14.284 1.00 0.00 H new ATOM 0 HE2 LYS A 104 123.982 9.670 11.961 1.00 0.00 H new ATOM 0 HE3 LYS A 104 123.903 7.939 12.223 1.00 0.00 H new ATOM 0 HZ1 LYS A 104 122.142 9.088 13.421 1.00 0.00 H new ATOM 0 HZ2 LYS A 104 123.203 8.346 14.519 1.00 0.00 H new ATOM 0 HZ3 LYS A 104 123.280 10.023 14.265 1.00 0.00 H new ATOM 1666 N ASP A 105 127.919 10.105 8.472 1.00 0.00 N ATOM 1667 CA ASP A 105 129.121 10.709 7.835 1.00 0.00 C ATOM 1668 C ASP A 105 128.935 10.662 6.315 1.00 0.00 C ATOM 1669 O ASP A 105 128.448 11.598 5.714 1.00 0.00 O ATOM 1670 CB ASP A 105 130.369 9.915 8.236 1.00 0.00 C ATOM 1671 CG ASP A 105 131.275 10.787 9.108 1.00 0.00 C ATOM 1672 OD1 ASP A 105 130.747 11.595 9.854 1.00 0.00 O ATOM 1673 OD2 ASP A 105 132.482 10.632 9.016 1.00 0.00 O ATOM 0 H ASP A 105 127.712 9.149 8.183 1.00 0.00 H new ATOM 0 HA ASP A 105 129.245 11.741 8.162 1.00 0.00 H new ATOM 0 HB2 ASP A 105 130.081 9.015 8.780 1.00 0.00 H new ATOM 0 HB3 ASP A 105 130.907 9.590 7.346 1.00 0.00 H new ATOM 1678 N GLN A 106 129.299 9.570 5.697 1.00 0.00 N ATOM 1679 CA GLN A 106 129.126 9.442 4.218 1.00 0.00 C ATOM 1680 C GLN A 106 130.075 8.365 3.680 1.00 0.00 C ATOM 1681 O GLN A 106 129.644 7.333 3.198 1.00 0.00 O ATOM 1682 CB GLN A 106 129.422 10.784 3.534 1.00 0.00 C ATOM 1683 CG GLN A 106 128.107 11.490 3.184 1.00 0.00 C ATOM 1684 CD GLN A 106 127.704 11.137 1.751 1.00 0.00 C ATOM 1685 OE1 GLN A 106 127.085 11.929 1.069 1.00 0.00 O ATOM 1686 NE2 GLN A 106 128.031 9.972 1.262 1.00 0.00 N ATOM 0 H GLN A 106 129.711 8.757 6.154 1.00 0.00 H new ATOM 0 HA GLN A 106 128.096 9.156 4.004 1.00 0.00 H new ATOM 0 HB2 GLN A 106 130.020 11.414 4.193 1.00 0.00 H new ATOM 0 HB3 GLN A 106 130.009 10.620 2.630 1.00 0.00 H new ATOM 0 HG2 GLN A 106 127.323 11.187 3.878 1.00 0.00 H new ATOM 0 HG3 GLN A 106 128.223 12.569 3.285 1.00 0.00 H new ATOM 0 HE21 GLN A 106 128.551 9.306 1.834 1.00 0.00 H new ATOM 0 HE22 GLN A 106 127.767 9.727 0.308 1.00 0.00 H new ATOM 1695 N PRO A 107 131.359 8.601 3.757 1.00 0.00 N ATOM 1696 CA PRO A 107 132.388 7.636 3.265 1.00 0.00 C ATOM 1697 C PRO A 107 132.395 6.319 4.048 1.00 0.00 C ATOM 1698 O PRO A 107 132.963 5.339 3.612 1.00 0.00 O ATOM 1699 CB PRO A 107 133.715 8.374 3.471 1.00 0.00 C ATOM 1700 CG PRO A 107 133.435 9.406 4.511 1.00 0.00 C ATOM 1701 CD PRO A 107 131.977 9.811 4.320 1.00 0.00 C ATOM 0 HA PRO A 107 132.195 7.352 2.231 1.00 0.00 H new ATOM 0 HB2 PRO A 107 134.499 7.690 3.797 1.00 0.00 H new ATOM 0 HB3 PRO A 107 134.058 8.833 2.544 1.00 0.00 H new ATOM 0 HG2 PRO A 107 133.601 9.007 5.512 1.00 0.00 H new ATOM 0 HG3 PRO A 107 134.097 10.265 4.397 1.00 0.00 H new ATOM 0 HD2 PRO A 107 131.513 10.098 5.263 1.00 0.00 H new ATOM 0 HD3 PRO A 107 131.881 10.662 3.646 1.00 0.00 H new ATOM 1709 N GLU A 108 131.779 6.280 5.199 1.00 0.00 N ATOM 1710 CA GLU A 108 131.779 5.012 5.988 1.00 0.00 C ATOM 1711 C GLU A 108 130.831 4.006 5.335 1.00 0.00 C ATOM 1712 O GLU A 108 131.210 2.895 5.004 1.00 0.00 O ATOM 1713 CB GLU A 108 131.321 5.293 7.425 1.00 0.00 C ATOM 1714 CG GLU A 108 130.556 6.615 7.481 1.00 0.00 C ATOM 1715 CD GLU A 108 129.266 6.493 6.668 1.00 0.00 C ATOM 1716 OE1 GLU A 108 128.565 5.511 6.851 1.00 0.00 O ATOM 1717 OE2 GLU A 108 129.003 7.377 5.873 1.00 0.00 O ATOM 0 H GLU A 108 131.281 7.062 5.624 1.00 0.00 H new ATOM 0 HA GLU A 108 132.788 4.601 6.009 1.00 0.00 H new ATOM 0 HB2 GLU A 108 130.686 4.481 7.778 1.00 0.00 H new ATOM 0 HB3 GLU A 108 132.184 5.335 8.089 1.00 0.00 H new ATOM 0 HG2 GLU A 108 130.324 6.870 8.515 1.00 0.00 H new ATOM 0 HG3 GLU A 108 131.173 7.422 7.085 1.00 0.00 H new ATOM 1724 N ALA A 109 129.605 4.389 5.128 1.00 0.00 N ATOM 1725 CA ALA A 109 128.639 3.465 4.488 1.00 0.00 C ATOM 1726 C ALA A 109 129.152 3.125 3.089 1.00 0.00 C ATOM 1727 O ALA A 109 129.020 2.014 2.613 1.00 0.00 O ATOM 1728 CB ALA A 109 127.275 4.149 4.398 1.00 0.00 C ATOM 0 H ALA A 109 129.231 5.305 5.376 1.00 0.00 H new ATOM 0 HA ALA A 109 128.537 2.551 5.072 1.00 0.00 H new ATOM 0 HB1 ALA A 109 126.560 3.474 3.928 1.00 0.00 H new ATOM 0 HB2 ALA A 109 126.929 4.404 5.400 1.00 0.00 H new ATOM 0 HB3 ALA A 109 127.362 5.058 3.802 1.00 0.00 H new ATOM 1734 N ALA A 110 129.757 4.079 2.439 1.00 0.00 N ATOM 1735 CA ALA A 110 130.306 3.829 1.080 1.00 0.00 C ATOM 1736 C ALA A 110 131.500 2.884 1.196 1.00 0.00 C ATOM 1737 O ALA A 110 131.729 2.053 0.339 1.00 0.00 O ATOM 1738 CB ALA A 110 130.756 5.152 0.456 1.00 0.00 C ATOM 0 H ALA A 110 129.895 5.025 2.793 1.00 0.00 H new ATOM 0 HA ALA A 110 129.539 3.380 0.448 1.00 0.00 H new ATOM 0 HB1 ALA A 110 131.158 4.966 -0.540 1.00 0.00 H new ATOM 0 HB2 ALA A 110 129.904 5.828 0.383 1.00 0.00 H new ATOM 0 HB3 ALA A 110 131.527 5.605 1.080 1.00 0.00 H new ATOM 1744 N GLN A 111 132.259 2.990 2.255 1.00 0.00 N ATOM 1745 CA GLN A 111 133.423 2.078 2.413 1.00 0.00 C ATOM 1746 C GLN A 111 132.931 0.649 2.229 1.00 0.00 C ATOM 1747 O GLN A 111 133.465 -0.110 1.440 1.00 0.00 O ATOM 1748 CB GLN A 111 134.036 2.245 3.804 1.00 0.00 C ATOM 1749 CG GLN A 111 134.827 3.555 3.855 1.00 0.00 C ATOM 1750 CD GLN A 111 136.315 3.252 4.048 1.00 0.00 C ATOM 1751 OE1 GLN A 111 136.966 2.752 3.153 1.00 0.00 O ATOM 1752 NE2 GLN A 111 136.883 3.537 5.188 1.00 0.00 N ATOM 0 H GLN A 111 132.123 3.663 3.009 1.00 0.00 H new ATOM 0 HA GLN A 111 134.188 2.312 1.673 1.00 0.00 H new ATOM 0 HB2 GLN A 111 133.252 2.251 4.561 1.00 0.00 H new ATOM 0 HB3 GLN A 111 134.690 1.403 4.029 1.00 0.00 H new ATOM 0 HG2 GLN A 111 134.677 4.118 2.934 1.00 0.00 H new ATOM 0 HG3 GLN A 111 134.464 4.179 4.672 1.00 0.00 H new ATOM 0 HE21 GLN A 111 136.336 3.957 5.939 1.00 0.00 H new ATOM 0 HE22 GLN A 111 137.874 3.340 5.327 1.00 0.00 H new ATOM 1761 N LEU A 112 131.889 0.279 2.923 1.00 0.00 N ATOM 1762 CA LEU A 112 131.356 -1.090 2.740 1.00 0.00 C ATOM 1763 C LEU A 112 131.061 -1.263 1.255 1.00 0.00 C ATOM 1764 O LEU A 112 131.434 -2.242 0.645 1.00 0.00 O ATOM 1765 CB LEU A 112 130.073 -1.261 3.554 1.00 0.00 C ATOM 1766 CG LEU A 112 130.422 -1.790 4.945 1.00 0.00 C ATOM 1767 CD1 LEU A 112 131.017 -3.195 4.831 1.00 0.00 C ATOM 1768 CD2 LEU A 112 131.444 -0.859 5.597 1.00 0.00 C ATOM 0 H LEU A 112 131.393 0.860 3.599 1.00 0.00 H new ATOM 0 HA LEU A 112 132.074 -1.836 3.080 1.00 0.00 H new ATOM 0 HB2 LEU A 112 129.551 -0.308 3.636 1.00 0.00 H new ATOM 0 HB3 LEU A 112 129.398 -1.952 3.049 1.00 0.00 H new ATOM 0 HG LEU A 112 129.518 -1.830 5.553 1.00 0.00 H new ATOM 0 HD11 LEU A 112 131.264 -3.567 5.825 1.00 0.00 H new ATOM 0 HD12 LEU A 112 130.291 -3.861 4.364 1.00 0.00 H new ATOM 0 HD13 LEU A 112 131.920 -3.159 4.222 1.00 0.00 H new ATOM 0 HD21 LEU A 112 131.696 -1.233 6.589 1.00 0.00 H new ATOM 0 HD22 LEU A 112 132.345 -0.821 4.984 1.00 0.00 H new ATOM 0 HD23 LEU A 112 131.021 0.142 5.683 1.00 0.00 H new ATOM 1780 N ALA A 113 130.426 -0.294 0.657 1.00 0.00 N ATOM 1781 CA ALA A 113 130.143 -0.389 -0.797 1.00 0.00 C ATOM 1782 C ALA A 113 131.438 -0.785 -1.505 1.00 0.00 C ATOM 1783 O ALA A 113 131.429 -1.403 -2.551 1.00 0.00 O ATOM 1784 CB ALA A 113 129.663 0.967 -1.320 1.00 0.00 C ATOM 0 H ALA A 113 130.093 0.556 1.112 1.00 0.00 H new ATOM 0 HA ALA A 113 129.366 -1.130 -0.984 1.00 0.00 H new ATOM 0 HB1 ALA A 113 129.456 0.893 -2.388 1.00 0.00 H new ATOM 0 HB2 ALA A 113 128.754 1.259 -0.794 1.00 0.00 H new ATOM 0 HB3 ALA A 113 130.436 1.716 -1.151 1.00 0.00 H new ATOM 1790 N LEU A 114 132.557 -0.435 -0.926 1.00 0.00 N ATOM 1791 CA LEU A 114 133.867 -0.791 -1.541 1.00 0.00 C ATOM 1792 C LEU A 114 134.024 -2.310 -1.517 1.00 0.00 C ATOM 1793 O LEU A 114 134.231 -2.945 -2.541 1.00 0.00 O ATOM 1794 CB LEU A 114 135.001 -0.144 -0.742 1.00 0.00 C ATOM 1795 CG LEU A 114 136.203 0.092 -1.659 1.00 0.00 C ATOM 1796 CD1 LEU A 114 136.559 -1.211 -2.379 1.00 0.00 C ATOM 1797 CD2 LEU A 114 135.857 1.168 -2.693 1.00 0.00 C ATOM 0 H LEU A 114 132.618 0.084 -0.050 1.00 0.00 H new ATOM 0 HA LEU A 114 133.905 -0.431 -2.569 1.00 0.00 H new ATOM 0 HB2 LEU A 114 134.666 0.801 -0.314 1.00 0.00 H new ATOM 0 HB3 LEU A 114 135.286 -0.787 0.091 1.00 0.00 H new ATOM 0 HG LEU A 114 137.053 0.423 -1.063 1.00 0.00 H new ATOM 0 HD11 LEU A 114 137.415 -1.043 -3.032 1.00 0.00 H new ATOM 0 HD12 LEU A 114 136.808 -1.977 -1.644 1.00 0.00 H new ATOM 0 HD13 LEU A 114 135.708 -1.542 -2.974 1.00 0.00 H new ATOM 0 HD21 LEU A 114 136.714 1.335 -3.345 1.00 0.00 H new ATOM 0 HD22 LEU A 114 135.006 0.839 -3.289 1.00 0.00 H new ATOM 0 HD23 LEU A 114 135.604 2.097 -2.181 1.00 0.00 H new ATOM 1809 N ARG A 115 133.905 -2.914 -0.364 1.00 0.00 N ATOM 1810 CA ARG A 115 134.028 -4.392 -0.322 1.00 0.00 C ATOM 1811 C ARG A 115 133.044 -4.936 -1.351 1.00 0.00 C ATOM 1812 O ARG A 115 133.372 -5.769 -2.164 1.00 0.00 O ATOM 1813 CB ARG A 115 133.695 -4.923 1.080 1.00 0.00 C ATOM 1814 CG ARG A 115 134.878 -4.666 2.018 1.00 0.00 C ATOM 1815 CD ARG A 115 135.351 -3.220 1.866 1.00 0.00 C ATOM 1816 NE ARG A 115 136.339 -2.906 2.937 1.00 0.00 N ATOM 1817 CZ ARG A 115 137.592 -3.238 2.787 1.00 0.00 C ATOM 1818 NH1 ARG A 115 137.981 -3.843 1.699 1.00 0.00 N ATOM 1819 NH2 ARG A 115 138.456 -2.964 3.726 1.00 0.00 N ATOM 0 H ARG A 115 133.732 -2.456 0.531 1.00 0.00 H new ATOM 0 HA ARG A 115 135.046 -4.708 -0.548 1.00 0.00 H new ATOM 0 HB2 ARG A 115 132.800 -4.432 1.463 1.00 0.00 H new ATOM 0 HB3 ARG A 115 133.479 -5.990 1.034 1.00 0.00 H new ATOM 0 HG2 ARG A 115 134.584 -4.856 3.050 1.00 0.00 H new ATOM 0 HG3 ARG A 115 135.693 -5.352 1.787 1.00 0.00 H new ATOM 0 HD2 ARG A 115 135.804 -3.075 0.885 1.00 0.00 H new ATOM 0 HD3 ARG A 115 134.502 -2.540 1.929 1.00 0.00 H new ATOM 0 HE ARG A 115 136.036 -2.431 3.787 1.00 0.00 H new ATOM 0 HH11 ARG A 115 137.306 -4.057 0.965 1.00 0.00 H new ATOM 0 HH12 ARG A 115 138.961 -4.102 1.582 1.00 0.00 H new ATOM 0 HH21 ARG A 115 138.152 -2.491 4.577 1.00 0.00 H new ATOM 0 HH22 ARG A 115 139.436 -3.223 3.609 1.00 0.00 H new ATOM 1833 N VAL A 116 131.845 -4.428 -1.362 1.00 0.00 N ATOM 1834 CA VAL A 116 130.869 -4.884 -2.380 1.00 0.00 C ATOM 1835 C VAL A 116 131.543 -4.782 -3.747 1.00 0.00 C ATOM 1836 O VAL A 116 131.314 -5.580 -4.629 1.00 0.00 O ATOM 1837 CB VAL A 116 129.629 -3.979 -2.336 1.00 0.00 C ATOM 1838 CG1 VAL A 116 129.098 -3.741 -3.750 1.00 0.00 C ATOM 1839 CG2 VAL A 116 128.532 -4.630 -1.485 1.00 0.00 C ATOM 0 H VAL A 116 131.502 -3.720 -0.712 1.00 0.00 H new ATOM 0 HA VAL A 116 130.558 -5.911 -2.189 1.00 0.00 H new ATOM 0 HB VAL A 116 129.913 -3.024 -1.893 1.00 0.00 H new ATOM 0 HG11 VAL A 116 128.219 -3.098 -3.705 1.00 0.00 H new ATOM 0 HG12 VAL A 116 129.869 -3.260 -4.352 1.00 0.00 H new ATOM 0 HG13 VAL A 116 128.827 -4.695 -4.202 1.00 0.00 H new ATOM 0 HG21 VAL A 116 127.657 -3.980 -1.460 1.00 0.00 H new ATOM 0 HG22 VAL A 116 128.258 -5.592 -1.919 1.00 0.00 H new ATOM 0 HG23 VAL A 116 128.900 -4.781 -0.470 1.00 0.00 H new ATOM 1849 N GLY A 117 132.397 -3.814 -3.924 1.00 0.00 N ATOM 1850 CA GLY A 117 133.095 -3.687 -5.228 1.00 0.00 C ATOM 1851 C GLY A 117 133.680 -5.052 -5.557 1.00 0.00 C ATOM 1852 O GLY A 117 133.513 -5.592 -6.647 1.00 0.00 O ATOM 0 H GLY A 117 132.639 -3.111 -3.226 1.00 0.00 H new ATOM 0 HA2 GLY A 117 132.402 -3.367 -6.006 1.00 0.00 H new ATOM 0 HA3 GLY A 117 133.881 -2.934 -5.172 1.00 0.00 H new ATOM 1856 N ILE A 118 134.342 -5.639 -4.603 1.00 0.00 N ATOM 1857 CA ILE A 118 134.903 -6.981 -4.855 1.00 0.00 C ATOM 1858 C ILE A 118 133.762 -7.855 -5.369 1.00 0.00 C ATOM 1859 O ILE A 118 133.935 -8.646 -6.275 1.00 0.00 O ATOM 1860 CB ILE A 118 135.543 -7.579 -3.583 1.00 0.00 C ATOM 1861 CG1 ILE A 118 134.702 -8.742 -3.044 1.00 0.00 C ATOM 1862 CG2 ILE A 118 135.721 -6.519 -2.487 1.00 0.00 C ATOM 1863 CD1 ILE A 118 133.318 -8.263 -2.592 1.00 0.00 C ATOM 0 H ILE A 118 134.515 -5.251 -3.675 1.00 0.00 H new ATOM 0 HA ILE A 118 135.703 -6.924 -5.593 1.00 0.00 H new ATOM 0 HB ILE A 118 136.528 -7.950 -3.864 1.00 0.00 H new ATOM 0 HG12 ILE A 118 134.592 -9.503 -3.817 1.00 0.00 H new ATOM 0 HG13 ILE A 118 135.219 -9.210 -2.206 1.00 0.00 H new ATOM 0 HG21 ILE A 118 136.174 -6.977 -1.608 1.00 0.00 H new ATOM 0 HG22 ILE A 118 136.367 -5.721 -2.854 1.00 0.00 H new ATOM 0 HG23 ILE A 118 134.749 -6.105 -2.220 1.00 0.00 H new ATOM 0 HD11 ILE A 118 132.745 -9.110 -2.215 1.00 0.00 H new ATOM 0 HD12 ILE A 118 133.430 -7.520 -1.802 1.00 0.00 H new ATOM 0 HD13 ILE A 118 132.793 -7.818 -3.437 1.00 0.00 H new ATOM 1875 N ALA A 119 132.583 -7.706 -4.816 1.00 0.00 N ATOM 1876 CA ALA A 119 131.448 -8.514 -5.303 1.00 0.00 C ATOM 1877 C ALA A 119 131.242 -8.211 -6.784 1.00 0.00 C ATOM 1878 O ALA A 119 130.840 -9.065 -7.542 1.00 0.00 O ATOM 1879 CB ALA A 119 130.184 -8.191 -4.506 1.00 0.00 C ATOM 0 H ALA A 119 132.369 -7.062 -4.055 1.00 0.00 H new ATOM 0 HA ALA A 119 131.662 -9.575 -5.171 1.00 0.00 H new ATOM 0 HB1 ALA A 119 129.356 -8.795 -4.877 1.00 0.00 H new ATOM 0 HB2 ALA A 119 130.352 -8.413 -3.452 1.00 0.00 H new ATOM 0 HB3 ALA A 119 129.942 -7.134 -4.620 1.00 0.00 H new ATOM 1885 N VAL A 120 131.555 -7.023 -7.233 1.00 0.00 N ATOM 1886 CA VAL A 120 131.393 -6.766 -8.687 1.00 0.00 C ATOM 1887 C VAL A 120 132.108 -7.907 -9.367 1.00 0.00 C ATOM 1888 O VAL A 120 131.633 -8.485 -10.325 1.00 0.00 O ATOM 1889 CB VAL A 120 132.027 -5.433 -9.075 1.00 0.00 C ATOM 1890 CG1 VAL A 120 131.761 -5.158 -10.555 1.00 0.00 C ATOM 1891 CG2 VAL A 120 131.417 -4.316 -8.232 1.00 0.00 C ATOM 0 H VAL A 120 131.904 -6.245 -6.674 1.00 0.00 H new ATOM 0 HA VAL A 120 130.343 -6.707 -8.975 1.00 0.00 H new ATOM 0 HB VAL A 120 133.102 -5.475 -8.899 1.00 0.00 H new ATOM 0 HG11 VAL A 120 132.213 -4.206 -10.835 1.00 0.00 H new ATOM 0 HG12 VAL A 120 132.194 -5.957 -11.157 1.00 0.00 H new ATOM 0 HG13 VAL A 120 130.686 -5.115 -10.730 1.00 0.00 H new ATOM 0 HG21 VAL A 120 131.869 -3.363 -8.508 1.00 0.00 H new ATOM 0 HG22 VAL A 120 130.342 -4.272 -8.409 1.00 0.00 H new ATOM 0 HG23 VAL A 120 131.604 -4.514 -7.176 1.00 0.00 H new ATOM 1901 N ALA A 121 133.219 -8.289 -8.815 1.00 0.00 N ATOM 1902 CA ALA A 121 133.940 -9.463 -9.362 1.00 0.00 C ATOM 1903 C ALA A 121 133.339 -10.706 -8.693 1.00 0.00 C ATOM 1904 O ALA A 121 133.486 -11.819 -9.157 1.00 0.00 O ATOM 1905 CB ALA A 121 135.430 -9.360 -9.029 1.00 0.00 C ATOM 0 H ALA A 121 133.658 -7.841 -8.011 1.00 0.00 H new ATOM 0 HA ALA A 121 133.839 -9.515 -10.446 1.00 0.00 H new ATOM 0 HB1 ALA A 121 135.954 -10.226 -9.434 1.00 0.00 H new ATOM 0 HB2 ALA A 121 135.839 -8.450 -9.468 1.00 0.00 H new ATOM 0 HB3 ALA A 121 135.560 -9.330 -7.947 1.00 0.00 H new ATOM 1911 N LYS A 122 132.663 -10.499 -7.586 1.00 0.00 N ATOM 1912 CA LYS A 122 132.035 -11.629 -6.833 1.00 0.00 C ATOM 1913 C LYS A 122 130.590 -11.261 -6.451 1.00 0.00 C ATOM 1914 O LYS A 122 130.203 -11.365 -5.304 1.00 0.00 O ATOM 1915 CB LYS A 122 132.846 -11.902 -5.562 1.00 0.00 C ATOM 1916 CG LYS A 122 133.978 -12.880 -5.877 1.00 0.00 C ATOM 1917 CD LYS A 122 133.411 -14.296 -6.009 1.00 0.00 C ATOM 1918 CE LYS A 122 133.972 -14.959 -7.268 1.00 0.00 C ATOM 1919 NZ LYS A 122 135.416 -15.268 -7.065 1.00 0.00 N ATOM 0 H LYS A 122 132.519 -9.580 -7.168 1.00 0.00 H new ATOM 0 HA LYS A 122 132.024 -12.520 -7.460 1.00 0.00 H new ATOM 0 HB2 LYS A 122 133.255 -10.970 -5.172 1.00 0.00 H new ATOM 0 HB3 LYS A 122 132.200 -12.315 -4.788 1.00 0.00 H new ATOM 0 HG2 LYS A 122 134.477 -12.589 -6.802 1.00 0.00 H new ATOM 0 HG3 LYS A 122 134.729 -12.850 -5.087 1.00 0.00 H new ATOM 0 HD2 LYS A 122 133.670 -14.885 -5.129 1.00 0.00 H new ATOM 0 HD3 LYS A 122 132.323 -14.259 -6.059 1.00 0.00 H new ATOM 0 HE2 LYS A 122 133.421 -15.873 -7.487 1.00 0.00 H new ATOM 0 HE3 LYS A 122 133.847 -14.299 -8.126 1.00 0.00 H new ATOM 0 HZ1 LYS A 122 135.786 -15.764 -7.901 1.00 0.00 H new ATOM 0 HZ2 LYS A 122 135.944 -14.383 -6.926 1.00 0.00 H new ATOM 0 HZ3 LYS A 122 135.527 -15.873 -6.226 1.00 0.00 H new ATOM 1933 N SER A 123 129.804 -10.795 -7.387 1.00 0.00 N ATOM 1934 CA SER A 123 128.401 -10.381 -7.062 1.00 0.00 C ATOM 1935 C SER A 123 127.765 -11.355 -6.078 1.00 0.00 C ATOM 1936 O SER A 123 126.741 -11.074 -5.488 1.00 0.00 O ATOM 1937 CB SER A 123 127.566 -10.340 -8.340 1.00 0.00 C ATOM 1938 OG SER A 123 128.429 -10.209 -9.462 1.00 0.00 O ATOM 0 H SER A 123 130.071 -10.682 -8.365 1.00 0.00 H new ATOM 0 HA SER A 123 128.432 -9.391 -6.607 1.00 0.00 H new ATOM 0 HB2 SER A 123 126.971 -11.249 -8.429 1.00 0.00 H new ATOM 0 HB3 SER A 123 126.867 -9.504 -8.305 1.00 0.00 H new ATOM 0 HG SER A 123 127.896 -10.184 -10.284 1.00 0.00 H new ATOM 1944 N ASP A 124 128.354 -12.491 -5.891 1.00 0.00 N ATOM 1945 CA ASP A 124 127.767 -13.467 -4.935 1.00 0.00 C ATOM 1946 C ASP A 124 128.860 -14.396 -4.410 1.00 0.00 C ATOM 1947 O ASP A 124 128.754 -15.603 -4.498 1.00 0.00 O ATOM 1948 CB ASP A 124 126.686 -14.286 -5.645 1.00 0.00 C ATOM 1949 CG ASP A 124 127.345 -15.324 -6.556 1.00 0.00 C ATOM 1950 OD1 ASP A 124 128.421 -15.045 -7.057 1.00 0.00 O ATOM 1951 OD2 ASP A 124 126.760 -16.379 -6.738 1.00 0.00 O ATOM 0 H ASP A 124 129.212 -12.791 -6.353 1.00 0.00 H new ATOM 0 HA ASP A 124 127.323 -12.932 -4.096 1.00 0.00 H new ATOM 0 HB2 ASP A 124 126.051 -14.782 -4.911 1.00 0.00 H new ATOM 0 HB3 ASP A 124 126.043 -13.629 -6.231 1.00 0.00 H new ATOM 1956 N GLY A 125 129.910 -13.849 -3.860 1.00 0.00 N ATOM 1957 CA GLY A 125 130.997 -14.722 -3.333 1.00 0.00 C ATOM 1958 C GLY A 125 131.750 -14.008 -2.212 1.00 0.00 C ATOM 1959 O GLY A 125 132.258 -14.633 -1.302 1.00 0.00 O ATOM 0 H GLY A 125 130.062 -12.846 -3.753 1.00 0.00 H new ATOM 0 HA2 GLY A 125 130.575 -15.656 -2.961 1.00 0.00 H new ATOM 0 HA3 GLY A 125 131.687 -14.982 -4.136 1.00 0.00 H new ATOM 1963 N ASN A 126 131.841 -12.707 -2.268 1.00 0.00 N ATOM 1964 CA ASN A 126 132.577 -11.974 -1.203 1.00 0.00 C ATOM 1965 C ASN A 126 131.639 -11.014 -0.467 1.00 0.00 C ATOM 1966 O ASN A 126 130.449 -10.981 -0.708 1.00 0.00 O ATOM 1967 CB ASN A 126 133.719 -11.187 -1.831 1.00 0.00 C ATOM 1968 CG ASN A 126 134.980 -12.052 -1.866 1.00 0.00 C ATOM 1969 OD1 ASN A 126 135.074 -12.978 -2.647 1.00 0.00 O ATOM 1970 ND2 ASN A 126 135.961 -11.789 -1.046 1.00 0.00 N ATOM 0 H ASN A 126 131.439 -12.124 -3.002 1.00 0.00 H new ATOM 0 HA ASN A 126 132.972 -12.694 -0.487 1.00 0.00 H new ATOM 0 HB2 ASN A 126 133.449 -10.879 -2.841 1.00 0.00 H new ATOM 0 HB3 ASN A 126 133.905 -10.278 -1.259 1.00 0.00 H new ATOM 0 HD21 ASN A 126 136.806 -12.361 -1.061 1.00 0.00 H new ATOM 0 HD22 ASN A 126 135.883 -11.012 -0.390 1.00 0.00 H new ATOM 1977 N PHE A 127 132.179 -10.236 0.435 1.00 0.00 N ATOM 1978 CA PHE A 127 131.346 -9.270 1.207 1.00 0.00 C ATOM 1979 C PHE A 127 130.766 -9.955 2.439 1.00 0.00 C ATOM 1980 O PHE A 127 130.765 -11.165 2.552 1.00 0.00 O ATOM 1981 CB PHE A 127 130.201 -8.745 0.341 1.00 0.00 C ATOM 1982 CG PHE A 127 129.827 -7.363 0.815 1.00 0.00 C ATOM 1983 CD1 PHE A 127 130.661 -6.280 0.525 1.00 0.00 C ATOM 1984 CD2 PHE A 127 128.651 -7.163 1.551 1.00 0.00 C ATOM 1985 CE1 PHE A 127 130.322 -4.998 0.966 1.00 0.00 C ATOM 1986 CE2 PHE A 127 128.314 -5.877 1.994 1.00 0.00 C ATOM 1987 CZ PHE A 127 129.150 -4.795 1.699 1.00 0.00 C ATOM 0 H PHE A 127 133.171 -10.230 0.671 1.00 0.00 H new ATOM 0 HA PHE A 127 131.978 -8.436 1.512 1.00 0.00 H new ATOM 0 HB2 PHE A 127 130.502 -8.716 -0.706 1.00 0.00 H new ATOM 0 HB3 PHE A 127 129.341 -9.412 0.407 1.00 0.00 H new ATOM 0 HD1 PHE A 127 131.568 -6.434 -0.040 1.00 0.00 H new ATOM 0 HD2 PHE A 127 128.005 -7.999 1.776 1.00 0.00 H new ATOM 0 HE1 PHE A 127 130.967 -4.162 0.740 1.00 0.00 H new ATOM 0 HE2 PHE A 127 127.409 -5.721 2.563 1.00 0.00 H new ATOM 0 HZ PHE A 127 128.890 -3.803 2.038 1.00 0.00 H new ATOM 1997 N ASP A 128 130.268 -9.183 3.362 1.00 0.00 N ATOM 1998 CA ASP A 128 129.678 -9.771 4.590 1.00 0.00 C ATOM 1999 C ASP A 128 130.795 -10.279 5.504 1.00 0.00 C ATOM 2000 O ASP A 128 130.557 -10.670 6.628 1.00 0.00 O ATOM 2001 CB ASP A 128 128.756 -10.925 4.202 1.00 0.00 C ATOM 2002 CG ASP A 128 128.131 -10.643 2.834 1.00 0.00 C ATOM 2003 OD1 ASP A 128 127.196 -9.861 2.781 1.00 0.00 O ATOM 2004 OD2 ASP A 128 128.598 -11.214 1.862 1.00 0.00 O ATOM 0 H ASP A 128 130.245 -8.164 3.316 1.00 0.00 H new ATOM 0 HA ASP A 128 129.103 -9.012 5.121 1.00 0.00 H new ATOM 0 HB2 ASP A 128 129.318 -11.858 4.171 1.00 0.00 H new ATOM 0 HB3 ASP A 128 127.975 -11.048 4.952 1.00 0.00 H new ATOM 2009 N ASP A 129 132.015 -10.258 5.040 1.00 0.00 N ATOM 2010 CA ASP A 129 133.142 -10.726 5.899 1.00 0.00 C ATOM 2011 C ASP A 129 133.850 -9.505 6.468 1.00 0.00 C ATOM 2012 O ASP A 129 134.166 -9.445 7.639 1.00 0.00 O ATOM 2013 CB ASP A 129 134.122 -11.552 5.063 1.00 0.00 C ATOM 2014 CG ASP A 129 134.593 -10.726 3.864 1.00 0.00 C ATOM 2015 OD1 ASP A 129 133.771 -10.029 3.291 1.00 0.00 O ATOM 2016 OD2 ASP A 129 135.766 -10.805 3.539 1.00 0.00 O ATOM 0 H ASP A 129 132.280 -9.939 4.108 1.00 0.00 H new ATOM 0 HA ASP A 129 132.763 -11.350 6.709 1.00 0.00 H new ATOM 0 HB2 ASP A 129 134.976 -11.848 5.672 1.00 0.00 H new ATOM 0 HB3 ASP A 129 133.642 -12.469 4.720 1.00 0.00 H new ATOM 2021 N ASP A 130 134.080 -8.519 5.654 1.00 0.00 N ATOM 2022 CA ASP A 130 134.739 -7.292 6.159 1.00 0.00 C ATOM 2023 C ASP A 130 133.720 -6.527 7.002 1.00 0.00 C ATOM 2024 O ASP A 130 134.067 -5.699 7.817 1.00 0.00 O ATOM 2025 CB ASP A 130 135.193 -6.430 4.979 1.00 0.00 C ATOM 2026 CG ASP A 130 136.703 -6.586 4.780 1.00 0.00 C ATOM 2027 OD1 ASP A 130 137.174 -7.710 4.831 1.00 0.00 O ATOM 2028 OD2 ASP A 130 137.361 -5.578 4.581 1.00 0.00 O ATOM 0 H ASP A 130 133.840 -8.510 4.663 1.00 0.00 H new ATOM 0 HA ASP A 130 135.613 -7.545 6.760 1.00 0.00 H new ATOM 0 HB2 ASP A 130 134.664 -6.727 4.074 1.00 0.00 H new ATOM 0 HB3 ASP A 130 134.946 -5.384 5.163 1.00 0.00 H new ATOM 2033 N GLU A 131 132.457 -6.812 6.811 1.00 0.00 N ATOM 2034 CA GLU A 131 131.406 -6.115 7.598 1.00 0.00 C ATOM 2035 C GLU A 131 131.735 -6.209 9.087 1.00 0.00 C ATOM 2036 O GLU A 131 131.389 -5.348 9.861 1.00 0.00 O ATOM 2037 CB GLU A 131 130.054 -6.780 7.333 1.00 0.00 C ATOM 2038 CG GLU A 131 129.408 -6.156 6.093 1.00 0.00 C ATOM 2039 CD GLU A 131 128.645 -4.890 6.492 1.00 0.00 C ATOM 2040 OE1 GLU A 131 128.289 -4.777 7.654 1.00 0.00 O ATOM 2041 OE2 GLU A 131 128.429 -4.056 5.628 1.00 0.00 O ATOM 0 H GLU A 131 132.112 -7.500 6.141 1.00 0.00 H new ATOM 0 HA GLU A 131 131.364 -5.067 7.303 1.00 0.00 H new ATOM 0 HB2 GLU A 131 130.187 -7.852 7.185 1.00 0.00 H new ATOM 0 HB3 GLU A 131 129.401 -6.656 8.197 1.00 0.00 H new ATOM 0 HG2 GLU A 131 130.173 -5.914 5.355 1.00 0.00 H new ATOM 0 HG3 GLU A 131 128.729 -6.870 5.626 1.00 0.00 H new ATOM 2048 N LYS A 132 132.402 -7.246 9.500 1.00 0.00 N ATOM 2049 CA LYS A 132 132.743 -7.372 10.943 1.00 0.00 C ATOM 2050 C LYS A 132 133.766 -6.296 11.310 1.00 0.00 C ATOM 2051 O LYS A 132 133.581 -5.545 12.248 1.00 0.00 O ATOM 2052 CB LYS A 132 133.314 -8.764 11.201 1.00 0.00 C ATOM 2053 CG LYS A 132 132.548 -9.774 10.342 1.00 0.00 C ATOM 2054 CD LYS A 132 132.235 -11.024 11.161 1.00 0.00 C ATOM 2055 CE LYS A 132 131.814 -12.155 10.223 1.00 0.00 C ATOM 2056 NZ LYS A 132 131.834 -13.448 10.964 1.00 0.00 N ATOM 0 H LYS A 132 132.725 -8.009 8.905 1.00 0.00 H new ATOM 0 HA LYS A 132 131.852 -7.237 11.557 1.00 0.00 H new ATOM 0 HB2 LYS A 132 134.376 -8.788 10.957 1.00 0.00 H new ATOM 0 HB3 LYS A 132 133.224 -9.020 12.257 1.00 0.00 H new ATOM 0 HG2 LYS A 132 131.623 -9.327 9.978 1.00 0.00 H new ATOM 0 HG3 LYS A 132 133.139 -10.041 9.466 1.00 0.00 H new ATOM 0 HD2 LYS A 132 133.110 -11.322 11.738 1.00 0.00 H new ATOM 0 HD3 LYS A 132 131.439 -10.814 11.875 1.00 0.00 H new ATOM 0 HE2 LYS A 132 130.815 -11.964 9.831 1.00 0.00 H new ATOM 0 HE3 LYS A 132 132.488 -12.203 9.368 1.00 0.00 H new ATOM 0 HZ1 LYS A 132 131.548 -14.218 10.326 1.00 0.00 H new ATOM 0 HZ2 LYS A 132 132.795 -13.631 11.318 1.00 0.00 H new ATOM 0 HZ3 LYS A 132 131.173 -13.399 11.766 1.00 0.00 H new ATOM 2070 N SER A 133 134.833 -6.198 10.566 1.00 0.00 N ATOM 2071 CA SER A 133 135.849 -5.150 10.862 1.00 0.00 C ATOM 2072 C SER A 133 135.339 -3.815 10.317 1.00 0.00 C ATOM 2073 O SER A 133 135.519 -2.768 10.916 1.00 0.00 O ATOM 2074 CB SER A 133 137.172 -5.511 10.186 1.00 0.00 C ATOM 2075 OG SER A 133 137.136 -5.087 8.829 1.00 0.00 O ATOM 0 H SER A 133 135.045 -6.797 9.768 1.00 0.00 H new ATOM 0 HA SER A 133 136.011 -5.078 11.937 1.00 0.00 H new ATOM 0 HB2 SER A 133 138.002 -5.033 10.707 1.00 0.00 H new ATOM 0 HB3 SER A 133 137.339 -6.587 10.239 1.00 0.00 H new ATOM 0 HG SER A 133 137.983 -5.315 8.392 1.00 0.00 H new ATOM 2081 N ALA A 134 134.677 -3.850 9.191 1.00 0.00 N ATOM 2082 CA ALA A 134 134.132 -2.596 8.613 1.00 0.00 C ATOM 2083 C ALA A 134 133.101 -2.048 9.589 1.00 0.00 C ATOM 2084 O ALA A 134 133.082 -0.872 9.896 1.00 0.00 O ATOM 2085 CB ALA A 134 133.471 -2.888 7.264 1.00 0.00 C ATOM 0 H ALA A 134 134.492 -4.695 8.650 1.00 0.00 H new ATOM 0 HA ALA A 134 134.929 -1.870 8.453 1.00 0.00 H new ATOM 0 HB1 ALA A 134 133.073 -1.963 6.846 1.00 0.00 H new ATOM 0 HB2 ALA A 134 134.209 -3.307 6.580 1.00 0.00 H new ATOM 0 HB3 ALA A 134 132.659 -3.602 7.404 1.00 0.00 H new ATOM 2091 N VAL A 135 132.256 -2.900 10.103 1.00 0.00 N ATOM 2092 CA VAL A 135 131.251 -2.427 11.083 1.00 0.00 C ATOM 2093 C VAL A 135 131.997 -1.782 12.252 1.00 0.00 C ATOM 2094 O VAL A 135 131.541 -0.827 12.841 1.00 0.00 O ATOM 2095 CB VAL A 135 130.401 -3.604 11.563 1.00 0.00 C ATOM 2096 CG1 VAL A 135 129.662 -3.222 12.847 1.00 0.00 C ATOM 2097 CG2 VAL A 135 129.382 -3.951 10.475 1.00 0.00 C ATOM 0 H VAL A 135 132.222 -3.896 9.885 1.00 0.00 H new ATOM 0 HA VAL A 135 130.583 -1.697 10.627 1.00 0.00 H new ATOM 0 HB VAL A 135 131.043 -4.462 11.764 1.00 0.00 H new ATOM 0 HG11 VAL A 135 129.058 -4.065 13.184 1.00 0.00 H new ATOM 0 HG12 VAL A 135 130.386 -2.962 13.620 1.00 0.00 H new ATOM 0 HG13 VAL A 135 129.015 -2.366 12.654 1.00 0.00 H new ATOM 0 HG21 VAL A 135 128.769 -4.790 10.805 1.00 0.00 H new ATOM 0 HG22 VAL A 135 128.744 -3.088 10.285 1.00 0.00 H new ATOM 0 HG23 VAL A 135 129.906 -4.223 9.559 1.00 0.00 H new ATOM 2107 N ARG A 136 133.159 -2.283 12.581 1.00 0.00 N ATOM 2108 CA ARG A 136 133.937 -1.669 13.695 1.00 0.00 C ATOM 2109 C ARG A 136 134.055 -0.169 13.434 1.00 0.00 C ATOM 2110 O ARG A 136 133.745 0.650 14.277 1.00 0.00 O ATOM 2111 CB ARG A 136 135.344 -2.275 13.743 1.00 0.00 C ATOM 2112 CG ARG A 136 135.908 -2.158 15.164 1.00 0.00 C ATOM 2113 CD ARG A 136 135.383 -3.307 16.029 1.00 0.00 C ATOM 2114 NE ARG A 136 135.903 -3.159 17.417 1.00 0.00 N ATOM 2115 CZ ARG A 136 137.084 -3.622 17.725 1.00 0.00 C ATOM 2116 NH1 ARG A 136 137.810 -4.213 16.816 1.00 0.00 N ATOM 2117 NH2 ARG A 136 137.539 -3.493 18.941 1.00 0.00 N ATOM 0 H ARG A 136 133.600 -3.085 12.130 1.00 0.00 H new ATOM 0 HA ARG A 136 133.431 -1.856 14.642 1.00 0.00 H new ATOM 0 HB2 ARG A 136 135.310 -3.321 13.440 1.00 0.00 H new ATOM 0 HB3 ARG A 136 135.997 -1.760 13.039 1.00 0.00 H new ATOM 0 HG2 ARG A 136 136.997 -2.181 15.135 1.00 0.00 H new ATOM 0 HG3 ARG A 136 135.621 -1.202 15.601 1.00 0.00 H new ATOM 0 HD2 ARG A 136 134.293 -3.304 16.035 1.00 0.00 H new ATOM 0 HD3 ARG A 136 135.697 -4.264 15.611 1.00 0.00 H new ATOM 0 HE ARG A 136 135.336 -2.696 18.127 1.00 0.00 H new ATOM 0 HH11 ARG A 136 137.455 -4.313 15.865 1.00 0.00 H new ATOM 0 HH12 ARG A 136 138.733 -4.575 17.056 1.00 0.00 H new ATOM 0 HH21 ARG A 136 136.972 -3.030 19.651 1.00 0.00 H new ATOM 0 HH22 ARG A 136 138.462 -3.855 19.181 1.00 0.00 H new ATOM 2131 N GLU A 137 134.507 0.193 12.265 1.00 0.00 N ATOM 2132 CA GLU A 137 134.657 1.638 11.932 1.00 0.00 C ATOM 2133 C GLU A 137 133.286 2.256 11.641 1.00 0.00 C ATOM 2134 O GLU A 137 133.077 3.437 11.836 1.00 0.00 O ATOM 2135 CB GLU A 137 135.551 1.784 10.699 1.00 0.00 C ATOM 2136 CG GLU A 137 136.876 1.058 10.939 1.00 0.00 C ATOM 2137 CD GLU A 137 137.554 1.631 12.185 1.00 0.00 C ATOM 2138 OE1 GLU A 137 137.927 2.792 12.151 1.00 0.00 O ATOM 2139 OE2 GLU A 137 137.687 0.900 13.152 1.00 0.00 O ATOM 0 H GLU A 137 134.780 -0.452 11.523 1.00 0.00 H new ATOM 0 HA GLU A 137 135.108 2.154 12.779 1.00 0.00 H new ATOM 0 HB2 GLU A 137 135.051 1.370 9.823 1.00 0.00 H new ATOM 0 HB3 GLU A 137 135.734 2.838 10.493 1.00 0.00 H new ATOM 0 HG2 GLU A 137 136.700 -0.010 11.067 1.00 0.00 H new ATOM 0 HG3 GLU A 137 137.527 1.172 10.073 1.00 0.00 H new ATOM 2146 N ILE A 138 132.353 1.479 11.161 1.00 0.00 N ATOM 2147 CA ILE A 138 131.007 2.042 10.848 1.00 0.00 C ATOM 2148 C ILE A 138 130.251 2.329 12.152 1.00 0.00 C ATOM 2149 O ILE A 138 129.816 3.435 12.397 1.00 0.00 O ATOM 2150 CB ILE A 138 130.233 1.030 9.981 1.00 0.00 C ATOM 2151 CG1 ILE A 138 129.687 1.733 8.734 1.00 0.00 C ATOM 2152 CG2 ILE A 138 129.066 0.413 10.763 1.00 0.00 C ATOM 2153 CD1 ILE A 138 130.752 1.728 7.634 1.00 0.00 C ATOM 0 H ILE A 138 132.463 0.483 10.972 1.00 0.00 H new ATOM 0 HA ILE A 138 131.110 2.978 10.299 1.00 0.00 H new ATOM 0 HB ILE A 138 130.919 0.234 9.693 1.00 0.00 H new ATOM 0 HG12 ILE A 138 128.786 1.228 8.385 1.00 0.00 H new ATOM 0 HG13 ILE A 138 129.405 2.758 8.976 1.00 0.00 H new ATOM 0 HG21 ILE A 138 128.537 -0.297 10.127 1.00 0.00 H new ATOM 0 HG22 ILE A 138 129.450 -0.103 11.643 1.00 0.00 H new ATOM 0 HG23 ILE A 138 128.380 1.201 11.075 1.00 0.00 H new ATOM 0 HD11 ILE A 138 130.362 2.228 6.748 1.00 0.00 H new ATOM 0 HD12 ILE A 138 131.641 2.253 7.985 1.00 0.00 H new ATOM 0 HD13 ILE A 138 131.013 0.699 7.385 1.00 0.00 H new ATOM 2165 N ALA A 139 130.096 1.347 12.990 1.00 0.00 N ATOM 2166 CA ALA A 139 129.377 1.561 14.273 1.00 0.00 C ATOM 2167 C ALA A 139 130.021 2.724 15.026 1.00 0.00 C ATOM 2168 O ALA A 139 129.347 3.558 15.597 1.00 0.00 O ATOM 2169 CB ALA A 139 129.474 0.292 15.120 1.00 0.00 C ATOM 0 H ALA A 139 130.439 0.398 12.841 1.00 0.00 H new ATOM 0 HA ALA A 139 128.330 1.791 14.075 1.00 0.00 H new ATOM 0 HB1 ALA A 139 128.948 0.443 16.063 1.00 0.00 H new ATOM 0 HB2 ALA A 139 129.021 -0.540 14.581 1.00 0.00 H new ATOM 0 HB3 ALA A 139 130.522 0.068 15.321 1.00 0.00 H new ATOM 2175 N ARG A 140 131.323 2.784 15.033 1.00 0.00 N ATOM 2176 CA ARG A 140 132.012 3.890 15.751 1.00 0.00 C ATOM 2177 C ARG A 140 131.881 5.184 14.944 1.00 0.00 C ATOM 2178 O ARG A 140 131.481 6.209 15.459 1.00 0.00 O ATOM 2179 CB ARG A 140 133.493 3.540 15.919 1.00 0.00 C ATOM 2180 CG ARG A 140 133.674 2.664 17.159 1.00 0.00 C ATOM 2181 CD ARG A 140 133.917 3.552 18.381 1.00 0.00 C ATOM 2182 NE ARG A 140 135.276 4.156 18.293 1.00 0.00 N ATOM 2183 CZ ARG A 140 135.857 4.614 19.368 1.00 0.00 C ATOM 2184 NH1 ARG A 140 135.247 4.544 20.520 1.00 0.00 N ATOM 2185 NH2 ARG A 140 137.048 5.142 19.291 1.00 0.00 N ATOM 0 H ARG A 140 131.939 2.115 14.572 1.00 0.00 H new ATOM 0 HA ARG A 140 131.556 4.028 16.731 1.00 0.00 H new ATOM 0 HB2 ARG A 140 133.856 3.016 15.035 1.00 0.00 H new ATOM 0 HB3 ARG A 140 134.084 4.451 16.015 1.00 0.00 H new ATOM 0 HG2 ARG A 140 132.788 2.048 17.314 1.00 0.00 H new ATOM 0 HG3 ARG A 140 134.514 1.984 17.017 1.00 0.00 H new ATOM 0 HD2 ARG A 140 133.161 4.336 18.430 1.00 0.00 H new ATOM 0 HD3 ARG A 140 133.827 2.964 19.295 1.00 0.00 H new ATOM 0 HE ARG A 140 135.752 4.212 17.393 1.00 0.00 H new ATOM 0 HH11 ARG A 140 134.316 4.131 20.580 1.00 0.00 H new ATOM 0 HH12 ARG A 140 135.701 4.902 21.360 1.00 0.00 H new ATOM 0 HH21 ARG A 140 137.524 5.197 18.391 1.00 0.00 H new ATOM 0 HH22 ARG A 140 137.502 5.500 20.131 1.00 0.00 H new ATOM 2199 N SER A 141 132.214 5.145 13.682 1.00 0.00 N ATOM 2200 CA SER A 141 132.106 6.373 12.845 1.00 0.00 C ATOM 2201 C SER A 141 130.701 6.960 12.984 1.00 0.00 C ATOM 2202 O SER A 141 130.529 8.148 13.169 1.00 0.00 O ATOM 2203 CB SER A 141 132.369 6.018 11.382 1.00 0.00 C ATOM 2204 OG SER A 141 133.748 5.717 11.211 1.00 0.00 O ATOM 0 H SER A 141 132.556 4.316 13.195 1.00 0.00 H new ATOM 0 HA SER A 141 132.841 7.106 13.177 1.00 0.00 H new ATOM 0 HB2 SER A 141 131.760 5.163 11.088 1.00 0.00 H new ATOM 0 HB3 SER A 141 132.084 6.849 10.737 1.00 0.00 H new ATOM 0 HG SER A 141 133.957 4.872 11.662 1.00 0.00 H new ATOM 2210 N LEU A 142 129.694 6.134 12.900 1.00 0.00 N ATOM 2211 CA LEU A 142 128.303 6.642 13.032 1.00 0.00 C ATOM 2212 C LEU A 142 127.902 6.616 14.509 1.00 0.00 C ATOM 2213 O LEU A 142 127.768 7.646 15.140 1.00 0.00 O ATOM 2214 CB LEU A 142 127.350 5.763 12.215 1.00 0.00 C ATOM 2215 CG LEU A 142 128.039 5.307 10.926 1.00 0.00 C ATOM 2216 CD1 LEU A 142 127.278 4.122 10.340 1.00 0.00 C ATOM 2217 CD2 LEU A 142 128.042 6.449 9.913 1.00 0.00 C ATOM 0 H LEU A 142 129.777 5.129 12.746 1.00 0.00 H new ATOM 0 HA LEU A 142 128.246 7.664 12.656 1.00 0.00 H new ATOM 0 HB2 LEU A 142 127.047 4.896 12.802 1.00 0.00 H new ATOM 0 HB3 LEU A 142 126.443 6.319 11.976 1.00 0.00 H new ATOM 0 HG LEU A 142 129.065 5.015 11.149 1.00 0.00 H new ATOM 0 HD11 LEU A 142 127.766 3.794 9.422 1.00 0.00 H new ATOM 0 HD12 LEU A 142 127.271 3.303 11.059 1.00 0.00 H new ATOM 0 HD13 LEU A 142 126.253 4.421 10.120 1.00 0.00 H new ATOM 0 HD21 LEU A 142 128.533 6.121 8.997 1.00 0.00 H new ATOM 0 HD22 LEU A 142 127.016 6.741 9.690 1.00 0.00 H new ATOM 0 HD23 LEU A 142 128.580 7.302 10.328 1.00 0.00 H new ATOM 2229 N GLY A 143 127.723 5.450 15.076 1.00 0.00 N ATOM 2230 CA GLY A 143 127.350 5.387 16.520 1.00 0.00 C ATOM 2231 C GLY A 143 126.592 4.092 16.837 1.00 0.00 C ATOM 2232 O GLY A 143 125.641 4.099 17.593 1.00 0.00 O ATOM 0 H GLY A 143 127.818 4.549 14.607 1.00 0.00 H new ATOM 0 HA2 GLY A 143 128.249 5.446 17.134 1.00 0.00 H new ATOM 0 HA3 GLY A 143 126.731 6.247 16.777 1.00 0.00 H new ATOM 2236 N PHE A 144 126.999 2.977 16.285 1.00 0.00 N ATOM 2237 CA PHE A 144 126.283 1.700 16.592 1.00 0.00 C ATOM 2238 C PHE A 144 127.159 0.813 17.483 1.00 0.00 C ATOM 2239 O PHE A 144 127.692 1.253 18.482 1.00 0.00 O ATOM 2240 CB PHE A 144 125.956 0.945 15.300 1.00 0.00 C ATOM 2241 CG PHE A 144 125.496 1.906 14.231 1.00 0.00 C ATOM 2242 CD1 PHE A 144 124.818 3.081 14.579 1.00 0.00 C ATOM 2243 CD2 PHE A 144 125.746 1.615 12.886 1.00 0.00 C ATOM 2244 CE1 PHE A 144 124.392 3.963 13.581 1.00 0.00 C ATOM 2245 CE2 PHE A 144 125.319 2.496 11.888 1.00 0.00 C ATOM 2246 CZ PHE A 144 124.642 3.671 12.235 1.00 0.00 C ATOM 0 H PHE A 144 127.787 2.894 15.642 1.00 0.00 H new ATOM 0 HA PHE A 144 125.355 1.942 17.110 1.00 0.00 H new ATOM 0 HB2 PHE A 144 126.836 0.402 14.956 1.00 0.00 H new ATOM 0 HB3 PHE A 144 125.179 0.204 15.491 1.00 0.00 H new ATOM 0 HD1 PHE A 144 124.624 3.306 15.617 1.00 0.00 H new ATOM 0 HD2 PHE A 144 126.269 0.709 12.618 1.00 0.00 H new ATOM 0 HE1 PHE A 144 123.870 4.870 13.849 1.00 0.00 H new ATOM 0 HE2 PHE A 144 125.511 2.270 10.850 1.00 0.00 H new ATOM 0 HZ PHE A 144 124.313 4.352 11.464 1.00 0.00 H new ATOM 2256 N ASP A 145 127.303 -0.440 17.132 1.00 0.00 N ATOM 2257 CA ASP A 145 128.133 -1.361 17.961 1.00 0.00 C ATOM 2258 C ASP A 145 129.406 -1.749 17.194 1.00 0.00 C ATOM 2259 O ASP A 145 129.339 -2.324 16.126 1.00 0.00 O ATOM 2260 CB ASP A 145 127.328 -2.625 18.266 1.00 0.00 C ATOM 2261 CG ASP A 145 126.528 -2.424 19.555 1.00 0.00 C ATOM 2262 OD1 ASP A 145 127.140 -2.396 20.610 1.00 0.00 O ATOM 2263 OD2 ASP A 145 125.318 -2.301 19.465 1.00 0.00 O ATOM 0 H ASP A 145 126.880 -0.864 16.306 1.00 0.00 H new ATOM 0 HA ASP A 145 128.409 -0.860 18.889 1.00 0.00 H new ATOM 0 HB2 ASP A 145 126.654 -2.848 17.439 1.00 0.00 H new ATOM 0 HB3 ASP A 145 127.998 -3.479 18.371 1.00 0.00 H new ATOM 2268 N PRO A 146 130.558 -1.442 17.738 1.00 0.00 N ATOM 2269 CA PRO A 146 131.865 -1.768 17.095 1.00 0.00 C ATOM 2270 C PRO A 146 131.942 -3.217 16.597 1.00 0.00 C ATOM 2271 O PRO A 146 132.029 -4.147 17.374 1.00 0.00 O ATOM 2272 CB PRO A 146 132.888 -1.541 18.209 1.00 0.00 C ATOM 2273 CG PRO A 146 132.256 -0.562 19.141 1.00 0.00 C ATOM 2274 CD PRO A 146 130.742 -0.744 19.021 1.00 0.00 C ATOM 0 HA PRO A 146 132.031 -1.155 16.209 1.00 0.00 H new ATOM 0 HB2 PRO A 146 133.123 -2.474 18.721 1.00 0.00 H new ATOM 0 HB3 PRO A 146 133.824 -1.152 17.808 1.00 0.00 H new ATOM 0 HG2 PRO A 146 132.585 -0.737 20.165 1.00 0.00 H new ATOM 0 HG3 PRO A 146 132.544 0.457 18.883 1.00 0.00 H new ATOM 0 HD2 PRO A 146 130.345 -1.328 19.851 1.00 0.00 H new ATOM 0 HD3 PRO A 146 130.224 0.215 19.029 1.00 0.00 H new ATOM 2282 N ALA A 147 131.922 -3.410 15.305 1.00 0.00 N ATOM 2283 CA ALA A 147 132.007 -4.789 14.742 1.00 0.00 C ATOM 2284 C ALA A 147 131.107 -5.734 15.522 1.00 0.00 C ATOM 2285 O ALA A 147 131.440 -6.179 16.602 1.00 0.00 O ATOM 2286 CB ALA A 147 133.443 -5.303 14.821 1.00 0.00 C ATOM 0 H ALA A 147 131.850 -2.666 14.611 1.00 0.00 H new ATOM 0 HA ALA A 147 131.685 -4.752 13.701 1.00 0.00 H new ATOM 0 HB1 ALA A 147 133.492 -6.310 14.407 1.00 0.00 H new ATOM 0 HB2 ALA A 147 134.097 -4.644 14.250 1.00 0.00 H new ATOM 0 HB3 ALA A 147 133.766 -5.322 15.862 1.00 0.00 H new ATOM 2292 N GLU A 148 129.976 -6.059 14.977 1.00 0.00 N ATOM 2293 CA GLU A 148 129.067 -6.992 15.684 1.00 0.00 C ATOM 2294 C GLU A 148 127.890 -7.356 14.776 1.00 0.00 C ATOM 2295 O GLU A 148 126.854 -7.783 15.245 1.00 0.00 O ATOM 2296 CB GLU A 148 128.542 -6.323 16.958 1.00 0.00 C ATOM 2297 CG GLU A 148 128.393 -7.371 18.063 1.00 0.00 C ATOM 2298 CD GLU A 148 127.524 -8.525 17.559 1.00 0.00 C ATOM 2299 OE1 GLU A 148 128.006 -9.291 16.742 1.00 0.00 O ATOM 2300 OE2 GLU A 148 126.390 -8.623 18.000 1.00 0.00 O ATOM 0 H GLU A 148 129.641 -5.720 14.075 1.00 0.00 H new ATOM 0 HA GLU A 148 129.613 -7.899 15.945 1.00 0.00 H new ATOM 0 HB2 GLU A 148 129.227 -5.538 17.277 1.00 0.00 H new ATOM 0 HB3 GLU A 148 127.581 -5.847 16.762 1.00 0.00 H new ATOM 0 HG2 GLU A 148 129.373 -7.743 18.360 1.00 0.00 H new ATOM 0 HG3 GLU A 148 127.941 -6.921 18.947 1.00 0.00 H new ATOM 2307 N PHE A 149 128.036 -7.208 13.480 1.00 0.00 N ATOM 2308 CA PHE A 149 126.913 -7.561 12.569 1.00 0.00 C ATOM 2309 C PHE A 149 127.400 -8.605 11.573 1.00 0.00 C ATOM 2310 O PHE A 149 126.872 -9.696 11.494 1.00 0.00 O ATOM 2311 CB PHE A 149 126.423 -6.324 11.805 1.00 0.00 C ATOM 2312 CG PHE A 149 126.378 -5.118 12.719 1.00 0.00 C ATOM 2313 CD1 PHE A 149 126.018 -5.258 14.064 1.00 0.00 C ATOM 2314 CD2 PHE A 149 126.698 -3.855 12.212 1.00 0.00 C ATOM 2315 CE1 PHE A 149 125.982 -4.136 14.900 1.00 0.00 C ATOM 2316 CE2 PHE A 149 126.664 -2.733 13.047 1.00 0.00 C ATOM 2317 CZ PHE A 149 126.306 -2.873 14.392 1.00 0.00 C ATOM 0 H PHE A 149 128.879 -6.861 13.022 1.00 0.00 H new ATOM 0 HA PHE A 149 126.086 -7.953 13.161 1.00 0.00 H new ATOM 0 HB2 PHE A 149 127.085 -6.124 10.962 1.00 0.00 H new ATOM 0 HB3 PHE A 149 125.431 -6.513 11.394 1.00 0.00 H new ATOM 0 HD1 PHE A 149 125.768 -6.232 14.457 1.00 0.00 H new ATOM 0 HD2 PHE A 149 126.972 -3.745 11.173 1.00 0.00 H new ATOM 0 HE1 PHE A 149 125.704 -4.245 15.938 1.00 0.00 H new ATOM 0 HE2 PHE A 149 126.914 -1.759 12.653 1.00 0.00 H new ATOM 0 HZ PHE A 149 126.280 -2.008 15.037 1.00 0.00 H new ATOM 2327 N GLY A 150 128.409 -8.279 10.816 1.00 0.00 N ATOM 2328 CA GLY A 150 128.936 -9.252 9.827 1.00 0.00 C ATOM 2329 C GLY A 150 127.772 -10.051 9.241 1.00 0.00 C ATOM 2330 O GLY A 150 127.530 -11.179 9.618 1.00 0.00 O ATOM 0 H GLY A 150 128.890 -7.380 10.841 1.00 0.00 H new ATOM 0 HA2 GLY A 150 129.470 -8.729 9.034 1.00 0.00 H new ATOM 0 HA3 GLY A 150 129.650 -9.923 10.304 1.00 0.00 H new