USER MOD reduce.3.24.130724 H: found=0, std=0, add=1025, rem=0, adj=26 USER MOD reduce.3.24.130724 removed 1024 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 116 LYS NZ :NH3+ -159:sc= 0.228 (180deg=-0.436) USER MOD Set 1.2: A 117 SER OG : rot 180:sc= 0.274 USER MOD Set 2.1: A 19 MET CE :methyl -137:sc= -0.763 (180deg=-2.11!) USER MOD Set 2.2: A 115 MET CE :methyl -140:sc= -2.2 (180deg=-3.54!) USER MOD Set 3.1: A 41 SER OG : rot 158:sc= -3.11! USER MOD Set 3.2: A 119 SER OG : rot 57:sc= 0.612 USER MOD Single : A 9 GLN : amide:sc= -1.4 X(o=-1.4,f=-1.2) USER MOD Single : A 10 GLN : amide:sc= -0.352 X(o=-0.35,f=-0.26) USER MOD Single : A 13 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 24 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 31 GLN : amide:sc= -0.175 X(o=-0.17,f=-0.54) USER MOD Single : A 34 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 38 SER OG : rot 180:sc= 0 USER MOD Single : A 42 SER OG : rot 160:sc= -0.021 USER MOD Single : A 44 ASN : amide:sc= -1.05 K(o=-1.1,f=-5.6!) USER MOD Single : A 55 LYS NZ :NH3+ -135:sc= -0.429 (180deg=-1.84!) USER MOD Single : A 56 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 60 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 64 SER OG : rot 180:sc= 0 USER MOD Single : A 67 GLN : amide:sc= 0 K(o=0,f=-0.65) USER MOD Single : A 71 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 80 SER OG : rot 176:sc= 0 USER MOD Single : A 83 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 86 SER OG : rot 180:sc= 0 USER MOD Single : A 87 LYS NZ :NH3+ -177:sc= 0 (180deg=-0.00751) USER MOD Single : A 88 SER OG : rot -135:sc= 0.0118 USER MOD Single : A 89 TYR OH : rot 180:sc= 0 USER MOD Single : A 91 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 92 THR OG1 : rot 140:sc= -0.117 USER MOD Single : A 93 THR OG1 : rot 93:sc= 1.24 USER MOD Single : A 94 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 95 ASN : amide:sc= -0.828 X(o=-0.83,f=-1.3!) USER MOD Single : A 97 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 102 TYR OH : rot 180:sc= 0 USER MOD Single : A 103 THR OG1 : rot -131:sc= 0.0149 USER MOD Single : A 108 GLN :FLIP amide:sc= -1.55 F(o=-3.5!,f=-1.5) USER MOD Single : A 110 HIS : no HD1:sc= -0.107 X(o=-0.11,f=0) USER MOD Single : A 112 TYR OH : rot 180:sc= 0 USER MOD Single : A 113 LYS NZ :NH3+ -176:sc= 0.26 (180deg=0.254) USER MOD Single : A 120 TYR OH : rot 166:sc= 0.0501 USER MOD Single : A 126 SER OG : rot 180:sc= -0.0628 USER MOD Single : A 127 SER OG : rot 180:sc= 0 USER MOD Single : A 129 TYR OH : rot 0:sc= -0.128 USER MOD Single : A 130 GLN : amide:sc= -0.0946 K(o=-0.095,f=-1.8!) USER MOD ----------------------------------------------------------------- ATOM 77 N GLN A 9 -19.098 8.836 1.518 1.00 0.00 N ATOM 78 CA GLN A 9 -19.301 7.993 0.346 1.00 0.00 C ATOM 79 C GLN A 9 -18.573 8.562 -0.867 1.00 0.00 C ATOM 80 O GLN A 9 -17.867 7.842 -1.573 1.00 0.00 O ATOM 81 CB GLN A 9 -20.793 7.856 0.042 1.00 0.00 C ATOM 82 CG GLN A 9 -21.092 6.959 -1.148 1.00 0.00 C ATOM 83 CD GLN A 9 -22.502 6.403 -1.121 1.00 0.00 C ATOM 84 OE1 GLN A 9 -23.389 6.959 -0.472 1.00 0.00 O ATOM 85 NE2 GLN A 9 -22.718 5.299 -1.827 1.00 0.00 N ATOM 0 HA GLN A 9 -18.890 7.007 0.564 1.00 0.00 H new ATOM 0 HB2 GLN A 9 -21.299 7.459 0.922 1.00 0.00 H new ATOM 0 HB3 GLN A 9 -21.209 8.846 -0.146 1.00 0.00 H new ATOM 0 HG2 GLN A 9 -20.946 7.523 -2.069 1.00 0.00 H new ATOM 0 HG3 GLN A 9 -20.380 6.133 -1.164 1.00 0.00 H new ATOM 0 HE21 GLN A 9 -21.954 4.871 -2.351 1.00 0.00 H new ATOM 0 HE22 GLN A 9 -23.647 4.879 -1.846 1.00 0.00 H new ATOM 94 N GLN A 10 -18.751 9.858 -1.103 1.00 0.00 N ATOM 95 CA GLN A 10 -18.111 10.523 -2.232 1.00 0.00 C ATOM 96 C GLN A 10 -16.598 10.573 -2.049 1.00 0.00 C ATOM 97 O GLN A 10 -15.842 10.194 -2.943 1.00 0.00 O ATOM 98 CB GLN A 10 -18.664 11.940 -2.397 1.00 0.00 C ATOM 99 CG GLN A 10 -20.154 11.980 -2.696 1.00 0.00 C ATOM 100 CD GLN A 10 -20.562 10.988 -3.767 1.00 0.00 C ATOM 101 OE1 GLN A 10 -20.465 11.271 -4.961 1.00 0.00 O ATOM 102 NE2 GLN A 10 -21.021 9.816 -3.344 1.00 0.00 N ATOM 0 H GLN A 10 -19.332 10.468 -0.528 1.00 0.00 H new ATOM 0 HA GLN A 10 -18.331 9.948 -3.131 1.00 0.00 H new ATOM 0 HB2 GLN A 10 -18.469 12.506 -1.486 1.00 0.00 H new ATOM 0 HB3 GLN A 10 -18.126 12.439 -3.203 1.00 0.00 H new ATOM 0 HG2 GLN A 10 -20.710 11.771 -1.782 1.00 0.00 H new ATOM 0 HG3 GLN A 10 -20.430 12.986 -3.014 1.00 0.00 H new ATOM 0 HE21 GLN A 10 -21.084 9.624 -2.344 1.00 0.00 H new ATOM 0 HE22 GLN A 10 -21.310 9.108 -4.019 1.00 0.00 H new ATOM 111 N ARG A 11 -16.163 11.043 -0.884 1.00 0.00 N ATOM 112 CA ARG A 11 -14.740 11.145 -0.584 1.00 0.00 C ATOM 113 C ARG A 11 -14.024 9.835 -0.900 1.00 0.00 C ATOM 114 O ARG A 11 -12.959 9.831 -1.519 1.00 0.00 O ATOM 115 CB ARG A 11 -14.532 11.511 0.887 1.00 0.00 C ATOM 116 CG ARG A 11 -13.071 11.666 1.275 1.00 0.00 C ATOM 117 CD ARG A 11 -12.921 12.388 2.605 1.00 0.00 C ATOM 118 NE ARG A 11 -11.602 12.178 3.196 1.00 0.00 N ATOM 119 CZ ARG A 11 -11.305 11.151 3.984 1.00 0.00 C ATOM 120 NH1 ARG A 11 -12.228 10.244 4.273 1.00 0.00 N ATOM 121 NH2 ARG A 11 -10.082 11.029 4.484 1.00 0.00 N ATOM 0 H ARG A 11 -16.776 11.359 -0.133 1.00 0.00 H new ATOM 0 HA ARG A 11 -14.317 11.931 -1.210 1.00 0.00 H new ATOM 0 HB2 ARG A 11 -15.056 12.443 1.098 1.00 0.00 H new ATOM 0 HB3 ARG A 11 -14.985 10.741 1.512 1.00 0.00 H new ATOM 0 HG2 ARG A 11 -12.604 10.683 1.339 1.00 0.00 H new ATOM 0 HG3 ARG A 11 -12.544 12.219 0.498 1.00 0.00 H new ATOM 0 HD2 ARG A 11 -13.087 13.455 2.459 1.00 0.00 H new ATOM 0 HD3 ARG A 11 -13.688 12.038 3.296 1.00 0.00 H new ATOM 0 HE ARG A 11 -10.869 12.857 2.992 1.00 0.00 H new ATOM 0 HH11 ARG A 11 -13.169 10.334 3.890 1.00 0.00 H new ATOM 0 HH12 ARG A 11 -11.997 9.456 4.878 1.00 0.00 H new ATOM 0 HH21 ARG A 11 -9.369 11.724 4.263 1.00 0.00 H new ATOM 0 HH22 ARG A 11 -9.855 10.240 5.089 1.00 0.00 H new ATOM 135 N VAL A 12 -14.614 8.724 -0.469 1.00 0.00 N ATOM 136 CA VAL A 12 -14.033 7.408 -0.706 1.00 0.00 C ATOM 137 C VAL A 12 -13.634 7.239 -2.168 1.00 0.00 C ATOM 138 O VAL A 12 -12.463 7.026 -2.483 1.00 0.00 O ATOM 139 CB VAL A 12 -15.012 6.284 -0.319 1.00 0.00 C ATOM 140 CG1 VAL A 12 -14.458 4.928 -0.729 1.00 0.00 C ATOM 141 CG2 VAL A 12 -15.302 6.322 1.174 1.00 0.00 C ATOM 0 H VAL A 12 -15.494 8.710 0.046 1.00 0.00 H new ATOM 0 HA VAL A 12 -13.144 7.337 -0.079 1.00 0.00 H new ATOM 0 HB VAL A 12 -15.949 6.442 -0.852 1.00 0.00 H new ATOM 0 HG11 VAL A 12 -15.164 4.146 -0.447 1.00 0.00 H new ATOM 0 HG12 VAL A 12 -14.306 4.908 -1.808 1.00 0.00 H new ATOM 0 HG13 VAL A 12 -13.507 4.756 -0.226 1.00 0.00 H new ATOM 0 HG21 VAL A 12 -15.995 5.521 1.430 1.00 0.00 H new ATOM 0 HG22 VAL A 12 -14.373 6.189 1.729 1.00 0.00 H new ATOM 0 HG23 VAL A 12 -15.746 7.283 1.434 1.00 0.00 H new ATOM 151 N LYS A 13 -14.616 7.334 -3.058 1.00 0.00 N ATOM 152 CA LYS A 13 -14.369 7.194 -4.488 1.00 0.00 C ATOM 153 C LYS A 13 -13.152 8.009 -4.913 1.00 0.00 C ATOM 154 O LYS A 13 -12.399 7.603 -5.798 1.00 0.00 O ATOM 155 CB LYS A 13 -15.597 7.638 -5.285 1.00 0.00 C ATOM 156 CG LYS A 13 -15.632 7.094 -6.703 1.00 0.00 C ATOM 157 CD LYS A 13 -17.056 6.847 -7.170 1.00 0.00 C ATOM 158 CE LYS A 13 -17.811 8.152 -7.372 1.00 0.00 C ATOM 159 NZ LYS A 13 -19.047 7.959 -8.180 1.00 0.00 N ATOM 0 H LYS A 13 -15.591 7.508 -2.814 1.00 0.00 H new ATOM 0 HA LYS A 13 -14.170 6.142 -4.695 1.00 0.00 H new ATOM 0 HB2 LYS A 13 -16.496 7.317 -4.759 1.00 0.00 H new ATOM 0 HB3 LYS A 13 -15.621 8.727 -5.322 1.00 0.00 H new ATOM 0 HG2 LYS A 13 -15.144 7.799 -7.376 1.00 0.00 H new ATOM 0 HG3 LYS A 13 -15.066 6.164 -6.751 1.00 0.00 H new ATOM 0 HD2 LYS A 13 -17.041 6.286 -8.104 1.00 0.00 H new ATOM 0 HD3 LYS A 13 -17.579 6.233 -6.437 1.00 0.00 H new ATOM 0 HE2 LYS A 13 -18.074 8.573 -6.402 1.00 0.00 H new ATOM 0 HE3 LYS A 13 -17.162 8.874 -7.868 1.00 0.00 H new ATOM 0 HZ1 LYS A 13 -19.533 8.871 -8.295 1.00 0.00 H new ATOM 0 HZ2 LYS A 13 -18.795 7.581 -9.115 1.00 0.00 H new ATOM 0 HZ3 LYS A 13 -19.678 7.290 -7.695 1.00 0.00 H new ATOM 173 N ARG A 14 -12.965 9.160 -4.275 1.00 0.00 N ATOM 174 CA ARG A 14 -11.839 10.032 -4.588 1.00 0.00 C ATOM 175 C ARG A 14 -10.540 9.236 -4.669 1.00 0.00 C ATOM 176 O ARG A 14 -9.661 9.544 -5.474 1.00 0.00 O ATOM 177 CB ARG A 14 -11.710 11.132 -3.532 1.00 0.00 C ATOM 178 CG ARG A 14 -11.132 12.430 -4.072 1.00 0.00 C ATOM 179 CD ARG A 14 -12.152 13.188 -4.907 1.00 0.00 C ATOM 180 NE ARG A 14 -11.612 14.443 -5.425 1.00 0.00 N ATOM 181 CZ ARG A 14 -11.039 14.560 -6.617 1.00 0.00 C ATOM 182 NH1 ARG A 14 -10.933 13.504 -7.412 1.00 0.00 N ATOM 183 NH2 ARG A 14 -10.571 15.735 -7.018 1.00 0.00 N ATOM 0 H ARG A 14 -13.578 9.510 -3.539 1.00 0.00 H new ATOM 0 HA ARG A 14 -12.026 10.489 -5.560 1.00 0.00 H new ATOM 0 HB2 ARG A 14 -12.693 11.332 -3.106 1.00 0.00 H new ATOM 0 HB3 ARG A 14 -11.077 10.772 -2.720 1.00 0.00 H new ATOM 0 HG2 ARG A 14 -10.802 13.056 -3.243 1.00 0.00 H new ATOM 0 HG3 ARG A 14 -10.252 12.214 -4.678 1.00 0.00 H new ATOM 0 HD2 ARG A 14 -12.476 12.562 -5.739 1.00 0.00 H new ATOM 0 HD3 ARG A 14 -13.034 13.396 -4.301 1.00 0.00 H new ATOM 0 HE ARG A 14 -11.679 15.275 -4.839 1.00 0.00 H new ATOM 0 HH11 ARG A 14 -11.292 12.599 -7.108 1.00 0.00 H new ATOM 0 HH12 ARG A 14 -10.492 13.597 -8.327 1.00 0.00 H new ATOM 0 HH21 ARG A 14 -10.651 16.550 -6.410 1.00 0.00 H new ATOM 0 HH22 ARG A 14 -10.131 15.823 -7.934 1.00 0.00 H new ATOM 197 N TRP A 15 -10.427 8.212 -3.831 1.00 0.00 N ATOM 198 CA TRP A 15 -9.236 7.371 -3.808 1.00 0.00 C ATOM 199 C TRP A 15 -9.144 6.522 -5.071 1.00 0.00 C ATOM 200 O TRP A 15 -8.053 6.160 -5.510 1.00 0.00 O ATOM 201 CB TRP A 15 -9.246 6.470 -2.572 1.00 0.00 C ATOM 202 CG TRP A 15 -9.700 7.172 -1.329 1.00 0.00 C ATOM 203 CD1 TRP A 15 -9.494 8.483 -1.006 1.00 0.00 C ATOM 204 CD2 TRP A 15 -10.436 6.600 -0.241 1.00 0.00 C ATOM 205 NE1 TRP A 15 -10.057 8.761 0.216 1.00 0.00 N ATOM 206 CE2 TRP A 15 -10.642 7.623 0.706 1.00 0.00 C ATOM 207 CE3 TRP A 15 -10.942 5.325 0.024 1.00 0.00 C ATOM 208 CZ2 TRP A 15 -11.330 7.406 1.896 1.00 0.00 C ATOM 209 CZ3 TRP A 15 -11.625 5.112 1.206 1.00 0.00 C ATOM 210 CH2 TRP A 15 -11.815 6.148 2.130 1.00 0.00 C ATOM 0 H TRP A 15 -11.146 7.944 -3.159 1.00 0.00 H new ATOM 0 HA TRP A 15 -8.363 8.022 -3.767 1.00 0.00 H new ATOM 0 HB2 TRP A 15 -9.899 5.617 -2.758 1.00 0.00 H new ATOM 0 HB3 TRP A 15 -8.243 6.074 -2.411 1.00 0.00 H new ATOM 0 HD1 TRP A 15 -8.966 9.197 -1.621 1.00 0.00 H new ATOM 0 HE1 TRP A 15 -10.042 9.668 0.683 1.00 0.00 H new ATOM 0 HE3 TRP A 15 -10.802 4.520 -0.682 1.00 0.00 H new ATOM 0 HZ2 TRP A 15 -11.476 8.203 2.610 1.00 0.00 H new ATOM 0 HZ3 TRP A 15 -12.019 4.130 1.421 1.00 0.00 H new ATOM 0 HH2 TRP A 15 -12.355 5.950 3.044 1.00 0.00 H new ATOM 221 N GLY A 16 -10.298 6.206 -5.652 1.00 0.00 N ATOM 222 CA GLY A 16 -10.325 5.401 -6.859 1.00 0.00 C ATOM 223 C GLY A 16 -9.942 6.194 -8.093 1.00 0.00 C ATOM 224 O GLY A 16 -10.383 5.885 -9.200 1.00 0.00 O ATOM 0 H GLY A 16 -11.214 6.493 -5.308 1.00 0.00 H new ATOM 0 HA2 GLY A 16 -9.642 4.559 -6.746 1.00 0.00 H new ATOM 0 HA3 GLY A 16 -11.324 4.986 -6.993 1.00 0.00 H new ATOM 228 N PHE A 17 -9.120 7.221 -7.903 1.00 0.00 N ATOM 229 CA PHE A 17 -8.680 8.062 -9.010 1.00 0.00 C ATOM 230 C PHE A 17 -7.169 7.961 -9.203 1.00 0.00 C ATOM 231 O PHE A 17 -6.560 8.796 -9.870 1.00 0.00 O ATOM 232 CB PHE A 17 -9.076 9.519 -8.759 1.00 0.00 C ATOM 233 CG PHE A 17 -10.498 9.826 -9.134 1.00 0.00 C ATOM 234 CD1 PHE A 17 -10.970 9.545 -10.406 1.00 0.00 C ATOM 235 CD2 PHE A 17 -11.363 10.395 -8.213 1.00 0.00 C ATOM 236 CE1 PHE A 17 -12.278 9.825 -10.753 1.00 0.00 C ATOM 237 CE2 PHE A 17 -12.672 10.678 -8.555 1.00 0.00 C ATOM 238 CZ PHE A 17 -13.130 10.394 -9.826 1.00 0.00 C ATOM 0 H PHE A 17 -8.745 7.491 -6.993 1.00 0.00 H new ATOM 0 HA PHE A 17 -9.169 7.710 -9.918 1.00 0.00 H new ATOM 0 HB2 PHE A 17 -8.928 9.751 -7.704 1.00 0.00 H new ATOM 0 HB3 PHE A 17 -8.410 10.171 -9.325 1.00 0.00 H new ATOM 0 HD1 PHE A 17 -10.308 9.102 -11.135 1.00 0.00 H new ATOM 0 HD2 PHE A 17 -11.011 10.620 -7.217 1.00 0.00 H new ATOM 0 HE1 PHE A 17 -12.634 9.599 -11.747 1.00 0.00 H new ATOM 0 HE2 PHE A 17 -13.336 11.121 -7.828 1.00 0.00 H new ATOM 0 HZ PHE A 17 -14.152 10.616 -10.095 1.00 0.00 H new ATOM 248 N GLY A 18 -6.571 6.930 -8.613 1.00 0.00 N ATOM 249 CA GLY A 18 -5.137 6.738 -8.732 1.00 0.00 C ATOM 250 C GLY A 18 -4.429 6.825 -7.395 1.00 0.00 C ATOM 251 O GLY A 18 -4.744 7.685 -6.573 1.00 0.00 O ATOM 0 H GLY A 18 -7.053 6.225 -8.055 1.00 0.00 H new ATOM 0 HA2 GLY A 18 -4.940 5.765 -9.182 1.00 0.00 H new ATOM 0 HA3 GLY A 18 -4.727 7.490 -9.406 1.00 0.00 H new ATOM 255 N MET A 19 -3.469 5.932 -7.175 1.00 0.00 N ATOM 256 CA MET A 19 -2.715 5.912 -5.928 1.00 0.00 C ATOM 257 C MET A 19 -2.519 7.325 -5.388 1.00 0.00 C ATOM 258 O MET A 19 -2.747 7.585 -4.206 1.00 0.00 O ATOM 259 CB MET A 19 -1.356 5.242 -6.140 1.00 0.00 C ATOM 260 CG MET A 19 -0.720 4.736 -4.855 1.00 0.00 C ATOM 261 SD MET A 19 0.437 3.383 -5.138 1.00 0.00 S ATOM 262 CE MET A 19 1.814 4.264 -5.871 1.00 0.00 C ATOM 0 H MET A 19 -3.195 5.213 -7.845 1.00 0.00 H new ATOM 0 HA MET A 19 -3.285 5.339 -5.197 1.00 0.00 H new ATOM 0 HB2 MET A 19 -1.476 4.407 -6.830 1.00 0.00 H new ATOM 0 HB3 MET A 19 -0.680 5.953 -6.615 1.00 0.00 H new ATOM 0 HG2 MET A 19 -0.199 5.558 -4.364 1.00 0.00 H new ATOM 0 HG3 MET A 19 -1.503 4.403 -4.174 1.00 0.00 H new ATOM 0 HE1 MET A 19 2.200 3.696 -6.718 1.00 0.00 H new ATOM 0 HE2 MET A 19 1.479 5.243 -6.213 1.00 0.00 H new ATOM 0 HE3 MET A 19 2.602 4.389 -5.129 1.00 0.00 H new ATOM 272 N ASP A 20 -2.097 8.234 -6.260 1.00 0.00 N ATOM 273 CA ASP A 20 -1.872 9.621 -5.871 1.00 0.00 C ATOM 274 C ASP A 20 -2.923 10.080 -4.864 1.00 0.00 C ATOM 275 O ASP A 20 -2.590 10.585 -3.793 1.00 0.00 O ATOM 276 CB ASP A 20 -1.896 10.529 -7.101 1.00 0.00 C ATOM 277 CG ASP A 20 -3.210 10.452 -7.853 1.00 0.00 C ATOM 278 OD1 ASP A 20 -3.427 9.452 -8.569 1.00 0.00 O ATOM 279 OD2 ASP A 20 -4.023 11.391 -7.723 1.00 0.00 O ATOM 0 H ASP A 20 -1.904 8.035 -7.242 1.00 0.00 H new ATOM 0 HA ASP A 20 -0.891 9.686 -5.401 1.00 0.00 H new ATOM 0 HB2 ASP A 20 -1.718 11.559 -6.792 1.00 0.00 H new ATOM 0 HB3 ASP A 20 -1.081 10.251 -7.770 1.00 0.00 H new ATOM 284 N GLU A 21 -4.192 9.902 -5.218 1.00 0.00 N ATOM 285 CA GLU A 21 -5.290 10.300 -4.346 1.00 0.00 C ATOM 286 C GLU A 21 -5.304 9.461 -3.071 1.00 0.00 C ATOM 287 O GLU A 21 -5.135 9.983 -1.970 1.00 0.00 O ATOM 288 CB GLU A 21 -6.627 10.160 -5.076 1.00 0.00 C ATOM 289 CG GLU A 21 -6.808 11.153 -6.212 1.00 0.00 C ATOM 290 CD GLU A 21 -6.767 12.593 -5.739 1.00 0.00 C ATOM 291 OE1 GLU A 21 -7.447 12.909 -4.740 1.00 0.00 O ATOM 292 OE2 GLU A 21 -6.055 13.405 -6.367 1.00 0.00 O ATOM 0 H GLU A 21 -4.484 9.485 -6.102 1.00 0.00 H new ATOM 0 HA GLU A 21 -5.142 11.344 -4.072 1.00 0.00 H new ATOM 0 HB2 GLU A 21 -6.710 9.148 -5.473 1.00 0.00 H new ATOM 0 HB3 GLU A 21 -7.438 10.289 -4.359 1.00 0.00 H new ATOM 0 HG2 GLU A 21 -6.026 10.996 -6.955 1.00 0.00 H new ATOM 0 HG3 GLU A 21 -7.761 10.964 -6.707 1.00 0.00 H new ATOM 299 N ALA A 22 -5.509 8.158 -3.230 1.00 0.00 N ATOM 300 CA ALA A 22 -5.544 7.246 -2.093 1.00 0.00 C ATOM 301 C ALA A 22 -4.503 7.632 -1.047 1.00 0.00 C ATOM 302 O ALA A 22 -4.819 7.773 0.135 1.00 0.00 O ATOM 303 CB ALA A 22 -5.322 5.814 -2.558 1.00 0.00 C ATOM 0 H ALA A 22 -5.653 7.710 -4.135 1.00 0.00 H new ATOM 0 HA ALA A 22 -6.529 7.318 -1.631 1.00 0.00 H new ATOM 0 HB1 ALA A 22 -5.351 5.144 -1.699 1.00 0.00 H new ATOM 0 HB2 ALA A 22 -6.106 5.535 -3.262 1.00 0.00 H new ATOM 0 HB3 ALA A 22 -4.351 5.736 -3.046 1.00 0.00 H new ATOM 309 N LEU A 23 -3.262 7.801 -1.489 1.00 0.00 N ATOM 310 CA LEU A 23 -2.174 8.170 -0.591 1.00 0.00 C ATOM 311 C LEU A 23 -2.514 9.439 0.185 1.00 0.00 C ATOM 312 O LEU A 23 -2.499 9.450 1.416 1.00 0.00 O ATOM 313 CB LEU A 23 -0.880 8.374 -1.381 1.00 0.00 C ATOM 314 CG LEU A 23 -0.413 7.185 -2.222 1.00 0.00 C ATOM 315 CD1 LEU A 23 0.670 7.616 -3.199 1.00 0.00 C ATOM 316 CD2 LEU A 23 0.090 6.063 -1.326 1.00 0.00 C ATOM 0 H LEU A 23 -2.984 7.688 -2.464 1.00 0.00 H new ATOM 0 HA LEU A 23 -2.033 7.357 0.121 1.00 0.00 H new ATOM 0 HB2 LEU A 23 -1.012 9.231 -2.041 1.00 0.00 H new ATOM 0 HB3 LEU A 23 -0.086 8.632 -0.680 1.00 0.00 H new ATOM 0 HG LEU A 23 -1.263 6.812 -2.794 1.00 0.00 H new ATOM 0 HD11 LEU A 23 0.990 6.757 -3.789 1.00 0.00 H new ATOM 0 HD12 LEU A 23 0.276 8.386 -3.863 1.00 0.00 H new ATOM 0 HD13 LEU A 23 1.521 8.014 -2.646 1.00 0.00 H new ATOM 0 HD21 LEU A 23 0.418 5.225 -1.941 1.00 0.00 H new ATOM 0 HD22 LEU A 23 0.927 6.423 -0.727 1.00 0.00 H new ATOM 0 HD23 LEU A 23 -0.714 5.736 -0.667 1.00 0.00 H new ATOM 328 N LYS A 24 -2.824 10.506 -0.544 1.00 0.00 N ATOM 329 CA LYS A 24 -3.173 11.780 0.074 1.00 0.00 C ATOM 330 C LYS A 24 -4.008 11.564 1.332 1.00 0.00 C ATOM 331 O LYS A 24 -3.624 11.986 2.423 1.00 0.00 O ATOM 332 CB LYS A 24 -3.942 12.657 -0.917 1.00 0.00 C ATOM 333 CG LYS A 24 -3.045 13.437 -1.862 1.00 0.00 C ATOM 334 CD LYS A 24 -3.694 14.740 -2.299 1.00 0.00 C ATOM 335 CE LYS A 24 -3.145 15.215 -3.635 1.00 0.00 C ATOM 336 NZ LYS A 24 -1.721 15.639 -3.530 1.00 0.00 N ATOM 0 H LYS A 24 -2.841 10.514 -1.564 1.00 0.00 H new ATOM 0 HA LYS A 24 -2.249 12.284 0.355 1.00 0.00 H new ATOM 0 HB2 LYS A 24 -4.612 12.027 -1.502 1.00 0.00 H new ATOM 0 HB3 LYS A 24 -4.566 13.357 -0.361 1.00 0.00 H new ATOM 0 HG2 LYS A 24 -2.095 13.649 -1.371 1.00 0.00 H new ATOM 0 HG3 LYS A 24 -2.822 12.829 -2.739 1.00 0.00 H new ATOM 0 HD2 LYS A 24 -4.773 14.603 -2.376 1.00 0.00 H new ATOM 0 HD3 LYS A 24 -3.523 15.505 -1.541 1.00 0.00 H new ATOM 0 HE2 LYS A 24 -3.232 14.414 -4.369 1.00 0.00 H new ATOM 0 HE3 LYS A 24 -3.746 16.048 -3.999 1.00 0.00 H new ATOM 0 HZ1 LYS A 24 -1.384 15.956 -4.461 1.00 0.00 H new ATOM 0 HZ2 LYS A 24 -1.641 16.420 -2.848 1.00 0.00 H new ATOM 0 HZ3 LYS A 24 -1.143 14.837 -3.207 1.00 0.00 H new ATOM 350 N ASP A 25 -5.149 10.903 1.173 1.00 0.00 N ATOM 351 CA ASP A 25 -6.037 10.629 2.297 1.00 0.00 C ATOM 352 C ASP A 25 -5.441 9.564 3.213 1.00 0.00 C ATOM 353 O ASP A 25 -4.790 8.619 2.765 1.00 0.00 O ATOM 354 CB ASP A 25 -7.408 10.176 1.793 1.00 0.00 C ATOM 355 CG ASP A 25 -8.136 11.270 1.037 1.00 0.00 C ATOM 356 OD1 ASP A 25 -7.458 12.133 0.441 1.00 0.00 O ATOM 357 OD2 ASP A 25 -9.385 11.263 1.041 1.00 0.00 O ATOM 0 H ASP A 25 -5.481 10.547 0.277 1.00 0.00 H new ATOM 0 HA ASP A 25 -6.155 11.550 2.868 1.00 0.00 H new ATOM 0 HB2 ASP A 25 -7.285 9.309 1.144 1.00 0.00 H new ATOM 0 HB3 ASP A 25 -8.016 9.857 2.639 1.00 0.00 H new ATOM 362 N PRO A 26 -5.666 9.718 4.526 1.00 0.00 N ATOM 363 CA PRO A 26 -5.159 8.780 5.532 1.00 0.00 C ATOM 364 C PRO A 26 -5.863 7.429 5.471 1.00 0.00 C ATOM 365 O PRO A 26 -5.217 6.382 5.437 1.00 0.00 O ATOM 366 CB PRO A 26 -5.464 9.482 6.857 1.00 0.00 C ATOM 367 CG PRO A 26 -6.615 10.378 6.555 1.00 0.00 C ATOM 368 CD PRO A 26 -6.433 10.821 5.130 1.00 0.00 C ATOM 0 HA PRO A 26 -4.102 8.557 5.385 1.00 0.00 H new ATOM 0 HB2 PRO A 26 -5.716 8.763 7.637 1.00 0.00 H new ATOM 0 HB3 PRO A 26 -4.603 10.049 7.212 1.00 0.00 H new ATOM 0 HG2 PRO A 26 -7.562 9.853 6.682 1.00 0.00 H new ATOM 0 HG3 PRO A 26 -6.631 11.233 7.230 1.00 0.00 H new ATOM 0 HD2 PRO A 26 -7.390 10.967 4.629 1.00 0.00 H new ATOM 0 HD3 PRO A 26 -5.894 11.766 5.069 1.00 0.00 H new ATOM 376 N VAL A 27 -7.192 7.459 5.457 1.00 0.00 N ATOM 377 CA VAL A 27 -7.984 6.236 5.398 1.00 0.00 C ATOM 378 C VAL A 27 -7.668 5.436 4.140 1.00 0.00 C ATOM 379 O VAL A 27 -7.399 4.238 4.204 1.00 0.00 O ATOM 380 CB VAL A 27 -9.493 6.543 5.432 1.00 0.00 C ATOM 381 CG1 VAL A 27 -10.302 5.261 5.306 1.00 0.00 C ATOM 382 CG2 VAL A 27 -9.857 7.288 6.708 1.00 0.00 C ATOM 0 H VAL A 27 -7.743 8.317 5.486 1.00 0.00 H new ATOM 0 HA VAL A 27 -7.720 5.646 6.276 1.00 0.00 H new ATOM 0 HB VAL A 27 -9.734 7.182 4.583 1.00 0.00 H new ATOM 0 HG11 VAL A 27 -11.366 5.498 5.332 1.00 0.00 H new ATOM 0 HG12 VAL A 27 -10.062 4.771 4.362 1.00 0.00 H new ATOM 0 HG13 VAL A 27 -10.058 4.594 6.133 1.00 0.00 H new ATOM 0 HG21 VAL A 27 -10.927 7.497 6.715 1.00 0.00 H new ATOM 0 HG22 VAL A 27 -9.601 6.675 7.573 1.00 0.00 H new ATOM 0 HG23 VAL A 27 -9.304 8.226 6.752 1.00 0.00 H new ATOM 392 N GLY A 28 -7.700 6.109 2.993 1.00 0.00 N ATOM 393 CA GLY A 28 -7.414 5.445 1.735 1.00 0.00 C ATOM 394 C GLY A 28 -6.084 4.720 1.751 1.00 0.00 C ATOM 395 O GLY A 28 -5.909 3.715 1.062 1.00 0.00 O ATOM 0 H GLY A 28 -7.919 7.102 2.913 1.00 0.00 H new ATOM 0 HA2 GLY A 28 -8.210 4.733 1.515 1.00 0.00 H new ATOM 0 HA3 GLY A 28 -7.413 6.181 0.931 1.00 0.00 H new ATOM 399 N ARG A 29 -5.143 5.230 2.539 1.00 0.00 N ATOM 400 CA ARG A 29 -3.820 4.626 2.640 1.00 0.00 C ATOM 401 C ARG A 29 -3.897 3.259 3.315 1.00 0.00 C ATOM 402 O ARG A 29 -3.355 2.277 2.810 1.00 0.00 O ATOM 403 CB ARG A 29 -2.876 5.541 3.423 1.00 0.00 C ATOM 404 CG ARG A 29 -2.100 6.509 2.545 1.00 0.00 C ATOM 405 CD ARG A 29 -0.779 6.904 3.186 1.00 0.00 C ATOM 406 NE ARG A 29 0.093 7.612 2.251 1.00 0.00 N ATOM 407 CZ ARG A 29 1.028 8.476 2.629 1.00 0.00 C ATOM 408 NH1 ARG A 29 1.213 8.737 3.916 1.00 0.00 N ATOM 409 NH2 ARG A 29 1.782 9.080 1.719 1.00 0.00 N ATOM 0 H ARG A 29 -5.273 6.060 3.117 1.00 0.00 H new ATOM 0 HA ARG A 29 -3.431 4.493 1.631 1.00 0.00 H new ATOM 0 HB2 ARG A 29 -3.455 6.109 4.152 1.00 0.00 H new ATOM 0 HB3 ARG A 29 -2.171 4.927 3.984 1.00 0.00 H new ATOM 0 HG2 ARG A 29 -1.912 6.051 1.574 1.00 0.00 H new ATOM 0 HG3 ARG A 29 -2.700 7.401 2.366 1.00 0.00 H new ATOM 0 HD2 ARG A 29 -0.971 7.537 4.052 1.00 0.00 H new ATOM 0 HD3 ARG A 29 -0.271 6.011 3.550 1.00 0.00 H new ATOM 0 HE ARG A 29 -0.023 7.433 1.254 1.00 0.00 H new ATOM 0 HH11 ARG A 29 0.636 8.274 4.618 1.00 0.00 H new ATOM 0 HH12 ARG A 29 1.932 9.401 4.204 1.00 0.00 H new ATOM 0 HH21 ARG A 29 1.644 8.881 0.728 1.00 0.00 H new ATOM 0 HH22 ARG A 29 2.500 9.743 2.010 1.00 0.00 H new ATOM 423 N GLU A 30 -4.573 3.207 4.458 1.00 0.00 N ATOM 424 CA GLU A 30 -4.719 1.961 5.202 1.00 0.00 C ATOM 425 C GLU A 30 -5.668 1.006 4.483 1.00 0.00 C ATOM 426 O GLU A 30 -5.389 -0.187 4.362 1.00 0.00 O ATOM 427 CB GLU A 30 -5.235 2.242 6.615 1.00 0.00 C ATOM 428 CG GLU A 30 -6.751 2.295 6.710 1.00 0.00 C ATOM 429 CD GLU A 30 -7.236 2.634 8.106 1.00 0.00 C ATOM 430 OE1 GLU A 30 -6.783 1.978 9.068 1.00 0.00 O ATOM 431 OE2 GLU A 30 -8.068 3.555 8.237 1.00 0.00 O ATOM 0 H GLU A 30 -5.028 4.012 4.889 1.00 0.00 H new ATOM 0 HA GLU A 30 -3.738 1.490 5.268 1.00 0.00 H new ATOM 0 HB2 GLU A 30 -4.864 1.470 7.289 1.00 0.00 H new ATOM 0 HB3 GLU A 30 -4.824 3.191 6.961 1.00 0.00 H new ATOM 0 HG2 GLU A 30 -7.130 3.037 6.007 1.00 0.00 H new ATOM 0 HG3 GLU A 30 -7.164 1.332 6.410 1.00 0.00 H new ATOM 438 N GLN A 31 -6.789 1.540 4.009 1.00 0.00 N ATOM 439 CA GLN A 31 -7.780 0.735 3.304 1.00 0.00 C ATOM 440 C GLN A 31 -7.157 0.040 2.098 1.00 0.00 C ATOM 441 O GLN A 31 -7.162 -1.187 2.005 1.00 0.00 O ATOM 442 CB GLN A 31 -8.952 1.609 2.855 1.00 0.00 C ATOM 443 CG GLN A 31 -9.900 1.983 3.984 1.00 0.00 C ATOM 444 CD GLN A 31 -10.614 0.780 4.567 1.00 0.00 C ATOM 445 OE1 GLN A 31 -11.024 -0.126 3.841 1.00 0.00 O ATOM 446 NE2 GLN A 31 -10.768 0.765 5.886 1.00 0.00 N ATOM 0 H GLN A 31 -7.034 2.526 4.100 1.00 0.00 H new ATOM 0 HA GLN A 31 -8.147 -0.028 3.991 1.00 0.00 H new ATOM 0 HB2 GLN A 31 -8.562 2.521 2.402 1.00 0.00 H new ATOM 0 HB3 GLN A 31 -9.511 1.083 2.081 1.00 0.00 H new ATOM 0 HG2 GLN A 31 -9.340 2.486 4.772 1.00 0.00 H new ATOM 0 HG3 GLN A 31 -10.638 2.695 3.613 1.00 0.00 H new ATOM 0 HE21 GLN A 31 -10.412 1.537 6.450 1.00 0.00 H new ATOM 0 HE22 GLN A 31 -11.242 -0.019 6.335 1.00 0.00 H new ATOM 455 N PHE A 32 -6.622 0.833 1.175 1.00 0.00 N ATOM 456 CA PHE A 32 -5.996 0.294 -0.027 1.00 0.00 C ATOM 457 C PHE A 32 -4.942 -0.749 0.330 1.00 0.00 C ATOM 458 O PHE A 32 -4.759 -1.734 -0.386 1.00 0.00 O ATOM 459 CB PHE A 32 -5.360 1.420 -0.845 1.00 0.00 C ATOM 460 CG PHE A 32 -4.394 0.932 -1.886 1.00 0.00 C ATOM 461 CD1 PHE A 32 -4.829 0.134 -2.933 1.00 0.00 C ATOM 462 CD2 PHE A 32 -3.053 1.270 -1.819 1.00 0.00 C ATOM 463 CE1 PHE A 32 -3.942 -0.317 -3.893 1.00 0.00 C ATOM 464 CE2 PHE A 32 -2.161 0.822 -2.776 1.00 0.00 C ATOM 465 CZ PHE A 32 -2.607 0.029 -3.815 1.00 0.00 C ATOM 0 H PHE A 32 -6.609 1.851 1.237 1.00 0.00 H new ATOM 0 HA PHE A 32 -6.770 -0.187 -0.625 1.00 0.00 H new ATOM 0 HB2 PHE A 32 -6.148 1.994 -1.333 1.00 0.00 H new ATOM 0 HB3 PHE A 32 -4.841 2.101 -0.170 1.00 0.00 H new ATOM 0 HD1 PHE A 32 -5.872 -0.138 -2.999 1.00 0.00 H new ATOM 0 HD2 PHE A 32 -2.699 1.891 -1.009 1.00 0.00 H new ATOM 0 HE1 PHE A 32 -4.293 -0.939 -4.703 1.00 0.00 H new ATOM 0 HE2 PHE A 32 -1.117 1.092 -2.711 1.00 0.00 H new ATOM 0 HZ PHE A 32 -1.913 -0.320 -4.565 1.00 0.00 H new ATOM 475 N LEU A 33 -4.250 -0.526 1.442 1.00 0.00 N ATOM 476 CA LEU A 33 -3.212 -1.445 1.895 1.00 0.00 C ATOM 477 C LEU A 33 -3.807 -2.804 2.253 1.00 0.00 C ATOM 478 O LEU A 33 -3.372 -3.838 1.746 1.00 0.00 O ATOM 479 CB LEU A 33 -2.479 -0.862 3.105 1.00 0.00 C ATOM 480 CG LEU A 33 -1.752 -1.868 3.998 1.00 0.00 C ATOM 481 CD1 LEU A 33 -0.332 -2.094 3.501 1.00 0.00 C ATOM 482 CD2 LEU A 33 -1.744 -1.390 5.443 1.00 0.00 C ATOM 0 H LEU A 33 -4.389 0.284 2.047 1.00 0.00 H new ATOM 0 HA LEU A 33 -2.502 -1.583 1.080 1.00 0.00 H new ATOM 0 HB2 LEU A 33 -1.752 -0.132 2.748 1.00 0.00 H new ATOM 0 HB3 LEU A 33 -3.201 -0.320 3.716 1.00 0.00 H new ATOM 0 HG LEU A 33 -2.286 -2.817 3.953 1.00 0.00 H new ATOM 0 HD11 LEU A 33 0.170 -2.813 4.149 1.00 0.00 H new ATOM 0 HD12 LEU A 33 -0.360 -2.481 2.482 1.00 0.00 H new ATOM 0 HD13 LEU A 33 0.213 -1.150 3.515 1.00 0.00 H new ATOM 0 HD21 LEU A 33 -1.223 -2.118 6.064 1.00 0.00 H new ATOM 0 HD22 LEU A 33 -1.234 -0.429 5.505 1.00 0.00 H new ATOM 0 HD23 LEU A 33 -2.770 -1.280 5.796 1.00 0.00 H new ATOM 494 N LYS A 34 -4.806 -2.794 3.129 1.00 0.00 N ATOM 495 CA LYS A 34 -5.464 -4.024 3.553 1.00 0.00 C ATOM 496 C LYS A 34 -5.529 -5.029 2.408 1.00 0.00 C ATOM 497 O LYS A 34 -5.058 -6.160 2.534 1.00 0.00 O ATOM 498 CB LYS A 34 -6.876 -3.722 4.061 1.00 0.00 C ATOM 499 CG LYS A 34 -6.913 -2.701 5.185 1.00 0.00 C ATOM 500 CD LYS A 34 -8.141 -2.880 6.062 1.00 0.00 C ATOM 501 CE LYS A 34 -8.058 -2.027 7.318 1.00 0.00 C ATOM 502 NZ LYS A 34 -9.071 -2.432 8.332 1.00 0.00 N ATOM 0 H LYS A 34 -5.178 -1.947 3.559 1.00 0.00 H new ATOM 0 HA LYS A 34 -4.878 -4.459 4.362 1.00 0.00 H new ATOM 0 HB2 LYS A 34 -7.482 -3.358 3.231 1.00 0.00 H new ATOM 0 HB3 LYS A 34 -7.334 -4.648 4.408 1.00 0.00 H new ATOM 0 HG2 LYS A 34 -6.014 -2.796 5.793 1.00 0.00 H new ATOM 0 HG3 LYS A 34 -6.909 -1.695 4.764 1.00 0.00 H new ATOM 0 HD2 LYS A 34 -9.034 -2.613 5.498 1.00 0.00 H new ATOM 0 HD3 LYS A 34 -8.241 -3.929 6.340 1.00 0.00 H new ATOM 0 HE2 LYS A 34 -7.060 -2.111 7.748 1.00 0.00 H new ATOM 0 HE3 LYS A 34 -8.205 -0.979 7.056 1.00 0.00 H new ATOM 0 HZ1 LYS A 34 -8.982 -1.827 9.173 1.00 0.00 H new ATOM 0 HZ2 LYS A 34 -10.025 -2.328 7.931 1.00 0.00 H new ATOM 0 HZ3 LYS A 34 -8.915 -3.424 8.602 1.00 0.00 H new ATOM 516 N PHE A 35 -6.114 -4.610 1.291 1.00 0.00 N ATOM 517 CA PHE A 35 -6.240 -5.474 0.123 1.00 0.00 C ATOM 518 C PHE A 35 -4.878 -6.014 -0.303 1.00 0.00 C ATOM 519 O PHE A 35 -4.708 -7.219 -0.495 1.00 0.00 O ATOM 520 CB PHE A 35 -6.883 -4.710 -1.036 1.00 0.00 C ATOM 521 CG PHE A 35 -6.849 -5.457 -2.339 1.00 0.00 C ATOM 522 CD1 PHE A 35 -7.823 -6.396 -2.639 1.00 0.00 C ATOM 523 CD2 PHE A 35 -5.843 -5.221 -3.262 1.00 0.00 C ATOM 524 CE1 PHE A 35 -7.795 -7.085 -3.837 1.00 0.00 C ATOM 525 CE2 PHE A 35 -5.811 -5.907 -4.462 1.00 0.00 C ATOM 526 CZ PHE A 35 -6.787 -6.841 -4.749 1.00 0.00 C ATOM 0 H PHE A 35 -6.508 -3.677 1.170 1.00 0.00 H new ATOM 0 HA PHE A 35 -6.878 -6.316 0.392 1.00 0.00 H new ATOM 0 HB2 PHE A 35 -7.919 -4.485 -0.782 1.00 0.00 H new ATOM 0 HB3 PHE A 35 -6.371 -3.756 -1.160 1.00 0.00 H new ATOM 0 HD1 PHE A 35 -8.613 -6.592 -1.929 1.00 0.00 H new ATOM 0 HD2 PHE A 35 -5.076 -4.494 -3.042 1.00 0.00 H new ATOM 0 HE1 PHE A 35 -8.561 -7.813 -4.060 1.00 0.00 H new ATOM 0 HE2 PHE A 35 -5.023 -5.713 -5.175 1.00 0.00 H new ATOM 0 HZ PHE A 35 -6.762 -7.380 -5.685 1.00 0.00 H new ATOM 536 N LEU A 36 -3.911 -5.116 -0.449 1.00 0.00 N ATOM 537 CA LEU A 36 -2.563 -5.501 -0.852 1.00 0.00 C ATOM 538 C LEU A 36 -2.110 -6.755 -0.112 1.00 0.00 C ATOM 539 O LEU A 36 -1.718 -7.744 -0.730 1.00 0.00 O ATOM 540 CB LEU A 36 -1.583 -4.356 -0.586 1.00 0.00 C ATOM 541 CG LEU A 36 -1.913 -3.021 -1.255 1.00 0.00 C ATOM 542 CD1 LEU A 36 -0.769 -2.036 -1.072 1.00 0.00 C ATOM 543 CD2 LEU A 36 -2.214 -3.225 -2.733 1.00 0.00 C ATOM 0 H LEU A 36 -4.035 -4.115 -0.294 1.00 0.00 H new ATOM 0 HA LEU A 36 -2.578 -5.718 -1.920 1.00 0.00 H new ATOM 0 HB2 LEU A 36 -1.526 -4.196 0.491 1.00 0.00 H new ATOM 0 HB3 LEU A 36 -0.592 -4.669 -0.914 1.00 0.00 H new ATOM 0 HG LEU A 36 -2.801 -2.607 -0.778 1.00 0.00 H new ATOM 0 HD11 LEU A 36 -1.021 -1.092 -1.554 1.00 0.00 H new ATOM 0 HD12 LEU A 36 -0.601 -1.867 -0.008 1.00 0.00 H new ATOM 0 HD13 LEU A 36 0.137 -2.443 -1.522 1.00 0.00 H new ATOM 0 HD21 LEU A 36 -2.447 -2.265 -3.193 1.00 0.00 H new ATOM 0 HD22 LEU A 36 -1.345 -3.662 -3.225 1.00 0.00 H new ATOM 0 HD23 LEU A 36 -3.067 -3.895 -2.842 1.00 0.00 H new ATOM 555 N GLU A 37 -2.171 -6.707 1.215 1.00 0.00 N ATOM 556 CA GLU A 37 -1.768 -7.841 2.039 1.00 0.00 C ATOM 557 C GLU A 37 -2.307 -9.148 1.466 1.00 0.00 C ATOM 558 O GLU A 37 -1.592 -10.148 1.392 1.00 0.00 O ATOM 559 CB GLU A 37 -2.263 -7.658 3.475 1.00 0.00 C ATOM 560 CG GLU A 37 -1.752 -6.390 4.138 1.00 0.00 C ATOM 561 CD GLU A 37 -1.708 -6.499 5.650 1.00 0.00 C ATOM 562 OE1 GLU A 37 -2.648 -7.083 6.230 1.00 0.00 O ATOM 563 OE2 GLU A 37 -0.736 -6.000 6.254 1.00 0.00 O ATOM 0 H GLU A 37 -2.495 -5.896 1.742 1.00 0.00 H new ATOM 0 HA GLU A 37 -0.679 -7.887 2.041 1.00 0.00 H new ATOM 0 HB2 GLU A 37 -3.353 -7.644 3.476 1.00 0.00 H new ATOM 0 HB3 GLU A 37 -1.955 -8.518 4.069 1.00 0.00 H new ATOM 0 HG2 GLU A 37 -0.753 -6.167 3.764 1.00 0.00 H new ATOM 0 HG3 GLU A 37 -2.392 -5.554 3.856 1.00 0.00 H new ATOM 570 N SER A 38 -3.574 -9.133 1.063 1.00 0.00 N ATOM 571 CA SER A 38 -4.212 -10.318 0.501 1.00 0.00 C ATOM 572 C SER A 38 -3.439 -10.827 -0.711 1.00 0.00 C ATOM 573 O SER A 38 -3.163 -12.021 -0.828 1.00 0.00 O ATOM 574 CB SER A 38 -5.656 -10.006 0.106 1.00 0.00 C ATOM 575 OG SER A 38 -6.276 -11.132 -0.491 1.00 0.00 O ATOM 0 H SER A 38 -4.179 -8.313 1.115 1.00 0.00 H new ATOM 0 HA SER A 38 -4.212 -11.097 1.263 1.00 0.00 H new ATOM 0 HB2 SER A 38 -6.220 -9.701 0.988 1.00 0.00 H new ATOM 0 HB3 SER A 38 -5.673 -9.166 -0.589 1.00 0.00 H new ATOM 0 HG SER A 38 -7.199 -10.907 -0.733 1.00 0.00 H new ATOM 581 N GLU A 39 -3.092 -9.912 -1.611 1.00 0.00 N ATOM 582 CA GLU A 39 -2.351 -10.268 -2.816 1.00 0.00 C ATOM 583 C GLU A 39 -0.851 -10.309 -2.540 1.00 0.00 C ATOM 584 O GLU A 39 -0.041 -10.397 -3.463 1.00 0.00 O ATOM 585 CB GLU A 39 -2.648 -9.271 -3.938 1.00 0.00 C ATOM 586 CG GLU A 39 -2.213 -7.850 -3.620 1.00 0.00 C ATOM 587 CD GLU A 39 -2.023 -7.006 -4.865 1.00 0.00 C ATOM 588 OE1 GLU A 39 -1.103 -7.310 -5.653 1.00 0.00 O ATOM 589 OE2 GLU A 39 -2.794 -6.042 -5.052 1.00 0.00 O ATOM 0 H GLU A 39 -3.312 -8.919 -1.529 1.00 0.00 H new ATOM 0 HA GLU A 39 -2.672 -11.261 -3.129 1.00 0.00 H new ATOM 0 HB2 GLU A 39 -2.146 -9.601 -4.848 1.00 0.00 H new ATOM 0 HB3 GLU A 39 -3.718 -9.277 -4.144 1.00 0.00 H new ATOM 0 HG2 GLU A 39 -2.958 -7.381 -2.978 1.00 0.00 H new ATOM 0 HG3 GLU A 39 -1.280 -7.877 -3.058 1.00 0.00 H new ATOM 596 N PHE A 40 -0.488 -10.243 -1.264 1.00 0.00 N ATOM 597 CA PHE A 40 0.915 -10.270 -0.865 1.00 0.00 C ATOM 598 C PHE A 40 1.714 -9.210 -1.617 1.00 0.00 C ATOM 599 O PHE A 40 2.852 -9.448 -2.024 1.00 0.00 O ATOM 600 CB PHE A 40 1.513 -11.654 -1.122 1.00 0.00 C ATOM 601 CG PHE A 40 0.843 -12.751 -0.345 1.00 0.00 C ATOM 602 CD1 PHE A 40 -0.332 -13.324 -0.803 1.00 0.00 C ATOM 603 CD2 PHE A 40 1.388 -13.208 0.844 1.00 0.00 C ATOM 604 CE1 PHE A 40 -0.951 -14.333 -0.090 1.00 0.00 C ATOM 605 CE2 PHE A 40 0.773 -14.217 1.562 1.00 0.00 C ATOM 606 CZ PHE A 40 -0.397 -14.781 1.094 1.00 0.00 C ATOM 0 H PHE A 40 -1.146 -10.170 -0.488 1.00 0.00 H new ATOM 0 HA PHE A 40 0.969 -10.051 0.201 1.00 0.00 H new ATOM 0 HB2 PHE A 40 1.443 -11.879 -2.186 1.00 0.00 H new ATOM 0 HB3 PHE A 40 2.573 -11.636 -0.869 1.00 0.00 H new ATOM 0 HD1 PHE A 40 -0.769 -12.978 -1.728 1.00 0.00 H new ATOM 0 HD2 PHE A 40 2.304 -12.771 1.214 1.00 0.00 H new ATOM 0 HE1 PHE A 40 -1.867 -14.771 -0.458 1.00 0.00 H new ATOM 0 HE2 PHE A 40 1.207 -14.564 2.488 1.00 0.00 H new ATOM 0 HZ PHE A 40 -0.878 -15.571 1.652 1.00 0.00 H new ATOM 616 N SER A 41 1.111 -8.040 -1.798 1.00 0.00 N ATOM 617 CA SER A 41 1.764 -6.944 -2.505 1.00 0.00 C ATOM 618 C SER A 41 2.042 -5.778 -1.562 1.00 0.00 C ATOM 619 O SER A 41 2.902 -4.939 -1.830 1.00 0.00 O ATOM 620 CB SER A 41 0.896 -6.474 -3.674 1.00 0.00 C ATOM 621 OG SER A 41 -0.265 -5.806 -3.210 1.00 0.00 O ATOM 0 H SER A 41 0.171 -7.826 -1.465 1.00 0.00 H new ATOM 0 HA SER A 41 2.715 -7.310 -2.892 1.00 0.00 H new ATOM 0 HB2 SER A 41 1.473 -5.806 -4.314 1.00 0.00 H new ATOM 0 HB3 SER A 41 0.608 -7.330 -4.284 1.00 0.00 H new ATOM 0 HG SER A 41 -0.608 -5.218 -3.915 1.00 0.00 H new ATOM 627 N SER A 42 1.307 -5.732 -0.455 1.00 0.00 N ATOM 628 CA SER A 42 1.471 -4.667 0.528 1.00 0.00 C ATOM 629 C SER A 42 2.939 -4.278 0.668 1.00 0.00 C ATOM 630 O SER A 42 3.280 -3.096 0.676 1.00 0.00 O ATOM 631 CB SER A 42 0.916 -5.107 1.884 1.00 0.00 C ATOM 632 OG SER A 42 1.564 -6.280 2.344 1.00 0.00 O ATOM 0 H SER A 42 0.592 -6.420 -0.217 1.00 0.00 H new ATOM 0 HA SER A 42 0.915 -3.796 0.181 1.00 0.00 H new ATOM 0 HB2 SER A 42 1.048 -4.306 2.612 1.00 0.00 H new ATOM 0 HB3 SER A 42 -0.155 -5.289 1.800 1.00 0.00 H new ATOM 0 HG SER A 42 1.441 -6.363 3.313 1.00 0.00 H new ATOM 638 N GLU A 43 3.803 -5.283 0.778 1.00 0.00 N ATOM 639 CA GLU A 43 5.235 -5.046 0.919 1.00 0.00 C ATOM 640 C GLU A 43 5.688 -3.899 0.019 1.00 0.00 C ATOM 641 O GLU A 43 6.434 -3.019 0.446 1.00 0.00 O ATOM 642 CB GLU A 43 6.020 -6.315 0.580 1.00 0.00 C ATOM 643 CG GLU A 43 5.670 -6.904 -0.776 1.00 0.00 C ATOM 644 CD GLU A 43 6.538 -8.094 -1.137 1.00 0.00 C ATOM 645 OE1 GLU A 43 6.489 -9.106 -0.407 1.00 0.00 O ATOM 646 OE2 GLU A 43 7.265 -8.013 -2.149 1.00 0.00 O ATOM 0 H GLU A 43 3.536 -6.268 0.772 1.00 0.00 H new ATOM 0 HA GLU A 43 5.432 -4.771 1.955 1.00 0.00 H new ATOM 0 HB2 GLU A 43 7.086 -6.090 0.604 1.00 0.00 H new ATOM 0 HB3 GLU A 43 5.835 -7.063 1.350 1.00 0.00 H new ATOM 0 HG2 GLU A 43 4.624 -7.209 -0.776 1.00 0.00 H new ATOM 0 HG3 GLU A 43 5.778 -6.135 -1.541 1.00 0.00 H new ATOM 653 N ASN A 44 5.231 -3.918 -1.229 1.00 0.00 N ATOM 654 CA ASN A 44 5.589 -2.881 -2.190 1.00 0.00 C ATOM 655 C ASN A 44 5.287 -1.494 -1.631 1.00 0.00 C ATOM 656 O ASN A 44 6.128 -0.595 -1.683 1.00 0.00 O ATOM 657 CB ASN A 44 4.832 -3.090 -3.503 1.00 0.00 C ATOM 658 CG ASN A 44 5.227 -4.378 -4.199 1.00 0.00 C ATOM 659 OD1 ASN A 44 5.868 -5.246 -3.606 1.00 0.00 O ATOM 660 ND2 ASN A 44 4.844 -4.508 -5.464 1.00 0.00 N ATOM 0 H ASN A 44 4.612 -4.640 -1.598 1.00 0.00 H new ATOM 0 HA ASN A 44 6.660 -2.951 -2.381 1.00 0.00 H new ATOM 0 HB2 ASN A 44 3.760 -3.102 -3.304 1.00 0.00 H new ATOM 0 HB3 ASN A 44 5.023 -2.248 -4.168 1.00 0.00 H new ATOM 0 HD21 ASN A 44 5.080 -5.353 -5.984 1.00 0.00 H new ATOM 0 HD22 ASN A 44 4.314 -3.763 -5.916 1.00 0.00 H new ATOM 667 N LEU A 45 4.083 -1.327 -1.097 1.00 0.00 N ATOM 668 CA LEU A 45 3.669 -0.049 -0.527 1.00 0.00 C ATOM 669 C LEU A 45 4.372 0.208 0.802 1.00 0.00 C ATOM 670 O LEU A 45 4.986 1.256 0.998 1.00 0.00 O ATOM 671 CB LEU A 45 2.152 -0.024 -0.328 1.00 0.00 C ATOM 672 CG LEU A 45 1.611 1.093 0.564 1.00 0.00 C ATOM 673 CD1 LEU A 45 1.686 2.432 -0.152 1.00 0.00 C ATOM 674 CD2 LEU A 45 0.181 0.792 0.988 1.00 0.00 C ATOM 0 H LEU A 45 3.376 -2.060 -1.046 1.00 0.00 H new ATOM 0 HA LEU A 45 3.951 0.740 -1.224 1.00 0.00 H new ATOM 0 HB2 LEU A 45 1.679 0.058 -1.306 1.00 0.00 H new ATOM 0 HB3 LEU A 45 1.845 -0.980 0.095 1.00 0.00 H new ATOM 0 HG LEU A 45 2.230 1.148 1.459 1.00 0.00 H new ATOM 0 HD11 LEU A 45 1.296 3.215 0.499 1.00 0.00 H new ATOM 0 HD12 LEU A 45 2.723 2.652 -0.404 1.00 0.00 H new ATOM 0 HD13 LEU A 45 1.092 2.390 -1.065 1.00 0.00 H new ATOM 0 HD21 LEU A 45 -0.188 1.598 1.623 1.00 0.00 H new ATOM 0 HD22 LEU A 45 -0.451 0.708 0.104 1.00 0.00 H new ATOM 0 HD23 LEU A 45 0.156 -0.146 1.542 1.00 0.00 H new ATOM 686 N ARG A 46 4.279 -0.758 1.711 1.00 0.00 N ATOM 687 CA ARG A 46 4.907 -0.637 3.021 1.00 0.00 C ATOM 688 C ARG A 46 6.246 0.088 2.917 1.00 0.00 C ATOM 689 O ARG A 46 6.525 1.011 3.682 1.00 0.00 O ATOM 690 CB ARG A 46 5.110 -2.020 3.643 1.00 0.00 C ATOM 691 CG ARG A 46 3.828 -2.647 4.164 1.00 0.00 C ATOM 692 CD ARG A 46 3.570 -2.266 5.614 1.00 0.00 C ATOM 693 NE ARG A 46 2.391 -2.936 6.155 1.00 0.00 N ATOM 694 CZ ARG A 46 1.878 -2.668 7.350 1.00 0.00 C ATOM 695 NH1 ARG A 46 2.436 -1.748 8.125 1.00 0.00 N ATOM 696 NH2 ARG A 46 0.802 -3.321 7.773 1.00 0.00 N ATOM 0 H ARG A 46 3.775 -1.632 1.564 1.00 0.00 H new ATOM 0 HA ARG A 46 4.246 -0.053 3.661 1.00 0.00 H new ATOM 0 HB2 ARG A 46 5.552 -2.682 2.899 1.00 0.00 H new ATOM 0 HB3 ARG A 46 5.824 -1.939 4.462 1.00 0.00 H new ATOM 0 HG2 ARG A 46 2.988 -2.326 3.548 1.00 0.00 H new ATOM 0 HG3 ARG A 46 3.891 -3.732 4.077 1.00 0.00 H new ATOM 0 HD2 ARG A 46 4.441 -2.523 6.217 1.00 0.00 H new ATOM 0 HD3 ARG A 46 3.439 -1.186 5.687 1.00 0.00 H new ATOM 0 HE ARG A 46 1.937 -3.649 5.584 1.00 0.00 H new ATOM 0 HH11 ARG A 46 3.262 -1.243 7.804 1.00 0.00 H new ATOM 0 HH12 ARG A 46 2.039 -1.545 9.042 1.00 0.00 H new ATOM 0 HH21 ARG A 46 0.369 -4.029 7.180 1.00 0.00 H new ATOM 0 HH22 ARG A 46 0.408 -3.115 8.691 1.00 0.00 H new ATOM 710 N PHE A 47 7.071 -0.338 1.966 1.00 0.00 N ATOM 711 CA PHE A 47 8.381 0.269 1.763 1.00 0.00 C ATOM 712 C PHE A 47 8.245 1.727 1.335 1.00 0.00 C ATOM 713 O PHE A 47 8.888 2.613 1.898 1.00 0.00 O ATOM 714 CB PHE A 47 9.171 -0.511 0.711 1.00 0.00 C ATOM 715 CG PHE A 47 10.244 0.300 0.043 1.00 0.00 C ATOM 716 CD1 PHE A 47 11.197 0.966 0.797 1.00 0.00 C ATOM 717 CD2 PHE A 47 10.301 0.395 -1.338 1.00 0.00 C ATOM 718 CE1 PHE A 47 12.186 1.713 0.184 1.00 0.00 C ATOM 719 CE2 PHE A 47 11.287 1.141 -1.956 1.00 0.00 C ATOM 720 CZ PHE A 47 12.231 1.800 -1.193 1.00 0.00 C ATOM 0 H PHE A 47 6.855 -1.101 1.324 1.00 0.00 H new ATOM 0 HA PHE A 47 8.919 0.235 2.710 1.00 0.00 H new ATOM 0 HB2 PHE A 47 9.626 -1.382 1.182 1.00 0.00 H new ATOM 0 HB3 PHE A 47 8.482 -0.882 -0.048 1.00 0.00 H new ATOM 0 HD1 PHE A 47 11.167 0.901 1.875 1.00 0.00 H new ATOM 0 HD2 PHE A 47 9.566 -0.120 -1.939 1.00 0.00 H new ATOM 0 HE1 PHE A 47 12.923 2.228 0.782 1.00 0.00 H new ATOM 0 HE2 PHE A 47 11.319 1.208 -3.033 1.00 0.00 H new ATOM 0 HZ PHE A 47 13.003 2.383 -1.673 1.00 0.00 H new ATOM 730 N TRP A 48 7.404 1.968 0.335 1.00 0.00 N ATOM 731 CA TRP A 48 7.184 3.318 -0.170 1.00 0.00 C ATOM 732 C TRP A 48 6.947 4.296 0.976 1.00 0.00 C ATOM 733 O TRP A 48 7.703 5.252 1.155 1.00 0.00 O ATOM 734 CB TRP A 48 5.991 3.338 -1.128 1.00 0.00 C ATOM 735 CG TRP A 48 5.857 4.626 -1.882 1.00 0.00 C ATOM 736 CD1 TRP A 48 6.581 5.017 -2.972 1.00 0.00 C ATOM 737 CD2 TRP A 48 4.944 5.692 -1.601 1.00 0.00 C ATOM 738 NE1 TRP A 48 6.173 6.262 -3.385 1.00 0.00 N ATOM 739 CE2 TRP A 48 5.169 6.698 -2.562 1.00 0.00 C ATOM 740 CE3 TRP A 48 3.956 5.895 -0.634 1.00 0.00 C ATOM 741 CZ2 TRP A 48 4.444 7.886 -2.579 1.00 0.00 C ATOM 742 CZ3 TRP A 48 3.237 7.075 -0.652 1.00 0.00 C ATOM 743 CH2 TRP A 48 3.483 8.058 -1.620 1.00 0.00 C ATOM 0 H TRP A 48 6.864 1.246 -0.142 1.00 0.00 H new ATOM 0 HA TRP A 48 8.079 3.628 -0.709 1.00 0.00 H new ATOM 0 HB2 TRP A 48 6.091 2.518 -1.839 1.00 0.00 H new ATOM 0 HB3 TRP A 48 5.077 3.160 -0.562 1.00 0.00 H new ATOM 0 HD1 TRP A 48 7.360 4.433 -3.440 1.00 0.00 H new ATOM 0 HE1 TRP A 48 6.556 6.778 -4.177 1.00 0.00 H new ATOM 0 HE3 TRP A 48 3.758 5.142 0.115 1.00 0.00 H new ATOM 0 HZ2 TRP A 48 4.633 8.646 -3.323 1.00 0.00 H new ATOM 0 HZ3 TRP A 48 2.473 7.242 0.092 1.00 0.00 H new ATOM 0 HH2 TRP A 48 2.903 8.969 -1.609 1.00 0.00 H new ATOM 754 N LEU A 49 5.896 4.051 1.750 1.00 0.00 N ATOM 755 CA LEU A 49 5.560 4.910 2.880 1.00 0.00 C ATOM 756 C LEU A 49 6.755 5.075 3.813 1.00 0.00 C ATOM 757 O LEU A 49 7.061 6.181 4.257 1.00 0.00 O ATOM 758 CB LEU A 49 4.372 4.332 3.651 1.00 0.00 C ATOM 759 CG LEU A 49 3.019 4.390 2.941 1.00 0.00 C ATOM 760 CD1 LEU A 49 2.057 3.378 3.543 1.00 0.00 C ATOM 761 CD2 LEU A 49 2.436 5.794 3.018 1.00 0.00 C ATOM 0 H LEU A 49 5.261 3.264 1.616 1.00 0.00 H new ATOM 0 HA LEU A 49 5.289 5.891 2.490 1.00 0.00 H new ATOM 0 HB2 LEU A 49 4.591 3.291 3.889 1.00 0.00 H new ATOM 0 HB3 LEU A 49 4.286 4.864 4.598 1.00 0.00 H new ATOM 0 HG LEU A 49 3.170 4.138 1.891 1.00 0.00 H new ATOM 0 HD11 LEU A 49 1.099 3.434 3.025 1.00 0.00 H new ATOM 0 HD12 LEU A 49 2.470 2.375 3.436 1.00 0.00 H new ATOM 0 HD13 LEU A 49 1.911 3.599 4.600 1.00 0.00 H new ATOM 0 HD21 LEU A 49 1.473 5.817 2.508 1.00 0.00 H new ATOM 0 HD22 LEU A 49 2.300 6.075 4.062 1.00 0.00 H new ATOM 0 HD23 LEU A 49 3.117 6.498 2.539 1.00 0.00 H new ATOM 773 N ALA A 50 7.429 3.966 4.103 1.00 0.00 N ATOM 774 CA ALA A 50 8.594 3.988 4.980 1.00 0.00 C ATOM 775 C ALA A 50 9.541 5.124 4.606 1.00 0.00 C ATOM 776 O ALA A 50 10.050 5.832 5.475 1.00 0.00 O ATOM 777 CB ALA A 50 9.320 2.653 4.925 1.00 0.00 C ATOM 0 H ALA A 50 7.188 3.042 3.744 1.00 0.00 H new ATOM 0 HA ALA A 50 8.248 4.159 5.999 1.00 0.00 H new ATOM 0 HB1 ALA A 50 10.188 2.683 5.584 1.00 0.00 H new ATOM 0 HB2 ALA A 50 8.647 1.859 5.248 1.00 0.00 H new ATOM 0 HB3 ALA A 50 9.647 2.459 3.904 1.00 0.00 H new ATOM 783 N VAL A 51 9.773 5.292 3.308 1.00 0.00 N ATOM 784 CA VAL A 51 10.659 6.342 2.820 1.00 0.00 C ATOM 785 C VAL A 51 10.085 7.724 3.111 1.00 0.00 C ATOM 786 O VAL A 51 10.786 8.605 3.609 1.00 0.00 O ATOM 787 CB VAL A 51 10.906 6.208 1.306 1.00 0.00 C ATOM 788 CG1 VAL A 51 11.792 7.340 0.807 1.00 0.00 C ATOM 789 CG2 VAL A 51 11.523 4.856 0.984 1.00 0.00 C ATOM 0 H VAL A 51 9.360 4.715 2.576 1.00 0.00 H new ATOM 0 HA VAL A 51 11.607 6.228 3.346 1.00 0.00 H new ATOM 0 HB VAL A 51 9.947 6.275 0.792 1.00 0.00 H new ATOM 0 HG11 VAL A 51 11.956 7.229 -0.265 1.00 0.00 H new ATOM 0 HG12 VAL A 51 11.306 8.296 1.002 1.00 0.00 H new ATOM 0 HG13 VAL A 51 12.750 7.308 1.326 1.00 0.00 H new ATOM 0 HG21 VAL A 51 11.690 4.779 -0.090 1.00 0.00 H new ATOM 0 HG22 VAL A 51 12.474 4.756 1.508 1.00 0.00 H new ATOM 0 HG23 VAL A 51 10.848 4.062 1.304 1.00 0.00 H new ATOM 799 N GLU A 52 8.807 7.906 2.796 1.00 0.00 N ATOM 800 CA GLU A 52 8.139 9.182 3.024 1.00 0.00 C ATOM 801 C GLU A 52 8.359 9.664 4.455 1.00 0.00 C ATOM 802 O GLU A 52 8.594 10.849 4.693 1.00 0.00 O ATOM 803 CB GLU A 52 6.640 9.057 2.741 1.00 0.00 C ATOM 804 CG GLU A 52 6.305 8.975 1.261 1.00 0.00 C ATOM 805 CD GLU A 52 6.314 10.333 0.585 1.00 0.00 C ATOM 806 OE1 GLU A 52 7.417 10.857 0.323 1.00 0.00 O ATOM 807 OE2 GLU A 52 5.219 10.871 0.319 1.00 0.00 O ATOM 0 H GLU A 52 8.214 7.187 2.382 1.00 0.00 H new ATOM 0 HA GLU A 52 8.570 9.915 2.342 1.00 0.00 H new ATOM 0 HB2 GLU A 52 6.257 8.168 3.241 1.00 0.00 H new ATOM 0 HB3 GLU A 52 6.124 9.914 3.175 1.00 0.00 H new ATOM 0 HG2 GLU A 52 7.023 8.322 0.765 1.00 0.00 H new ATOM 0 HG3 GLU A 52 5.322 8.519 1.139 1.00 0.00 H new ATOM 814 N ASP A 53 8.281 8.737 5.403 1.00 0.00 N ATOM 815 CA ASP A 53 8.472 9.066 6.811 1.00 0.00 C ATOM 816 C ASP A 53 9.956 9.184 7.145 1.00 0.00 C ATOM 817 O ASP A 53 10.366 10.075 7.890 1.00 0.00 O ATOM 818 CB ASP A 53 7.820 8.003 7.698 1.00 0.00 C ATOM 819 CG ASP A 53 6.331 8.229 7.872 1.00 0.00 C ATOM 820 OD1 ASP A 53 5.955 9.221 8.532 1.00 0.00 O ATOM 821 OD2 ASP A 53 5.543 7.415 7.349 1.00 0.00 O ATOM 0 H ASP A 53 8.087 7.752 5.222 1.00 0.00 H new ATOM 0 HA ASP A 53 7.997 10.029 7.002 1.00 0.00 H new ATOM 0 HB2 ASP A 53 7.987 7.018 7.262 1.00 0.00 H new ATOM 0 HB3 ASP A 53 8.302 8.004 8.676 1.00 0.00 H new ATOM 826 N LEU A 54 10.756 8.280 6.591 1.00 0.00 N ATOM 827 CA LEU A 54 12.195 8.282 6.830 1.00 0.00 C ATOM 828 C LEU A 54 12.725 9.707 6.947 1.00 0.00 C ATOM 829 O LEU A 54 13.252 10.102 7.988 1.00 0.00 O ATOM 830 CB LEU A 54 12.920 7.547 5.702 1.00 0.00 C ATOM 831 CG LEU A 54 14.448 7.620 5.727 1.00 0.00 C ATOM 832 CD1 LEU A 54 14.995 6.934 6.968 1.00 0.00 C ATOM 833 CD2 LEU A 54 15.032 6.995 4.468 1.00 0.00 C ATOM 0 H LEU A 54 10.433 7.536 5.973 1.00 0.00 H new ATOM 0 HA LEU A 54 12.383 7.766 7.771 1.00 0.00 H new ATOM 0 HB2 LEU A 54 12.626 6.498 5.731 1.00 0.00 H new ATOM 0 HB3 LEU A 54 12.572 7.950 4.751 1.00 0.00 H new ATOM 0 HG LEU A 54 14.742 8.669 5.758 1.00 0.00 H new ATOM 0 HD11 LEU A 54 16.083 6.996 6.968 1.00 0.00 H new ATOM 0 HD12 LEU A 54 14.603 7.426 7.858 1.00 0.00 H new ATOM 0 HD13 LEU A 54 14.691 5.887 6.969 1.00 0.00 H new ATOM 0 HD21 LEU A 54 16.120 7.056 4.503 1.00 0.00 H new ATOM 0 HD22 LEU A 54 14.729 5.950 4.406 1.00 0.00 H new ATOM 0 HD23 LEU A 54 14.666 7.531 3.592 1.00 0.00 H new ATOM 845 N LYS A 55 12.581 10.477 5.873 1.00 0.00 N ATOM 846 CA LYS A 55 13.042 11.860 5.855 1.00 0.00 C ATOM 847 C LYS A 55 12.546 12.615 7.084 1.00 0.00 C ATOM 848 O LYS A 55 13.284 13.395 7.686 1.00 0.00 O ATOM 849 CB LYS A 55 12.561 12.563 4.584 1.00 0.00 C ATOM 850 CG LYS A 55 11.053 12.529 4.403 1.00 0.00 C ATOM 851 CD LYS A 55 10.659 12.793 2.960 1.00 0.00 C ATOM 852 CE LYS A 55 10.757 11.531 2.115 1.00 0.00 C ATOM 853 NZ LYS A 55 12.107 11.376 1.505 1.00 0.00 N ATOM 0 H LYS A 55 12.148 10.166 5.003 1.00 0.00 H new ATOM 0 HA LYS A 55 14.132 11.853 5.869 1.00 0.00 H new ATOM 0 HB2 LYS A 55 12.893 13.601 4.606 1.00 0.00 H new ATOM 0 HB3 LYS A 55 13.033 12.096 3.720 1.00 0.00 H new ATOM 0 HG2 LYS A 55 10.670 11.557 4.714 1.00 0.00 H new ATOM 0 HG3 LYS A 55 10.591 13.275 5.050 1.00 0.00 H new ATOM 0 HD2 LYS A 55 9.640 13.177 2.925 1.00 0.00 H new ATOM 0 HD3 LYS A 55 11.305 13.564 2.541 1.00 0.00 H new ATOM 0 HE2 LYS A 55 10.536 10.661 2.734 1.00 0.00 H new ATOM 0 HE3 LYS A 55 10.004 11.562 1.328 1.00 0.00 H new ATOM 0 HZ1 LYS A 55 12.007 11.106 0.506 1.00 0.00 H new ATOM 0 HZ2 LYS A 55 12.623 12.277 1.570 1.00 0.00 H new ATOM 0 HZ3 LYS A 55 12.635 10.637 2.012 1.00 0.00 H new ATOM 867 N LYS A 56 11.292 12.377 7.453 1.00 0.00 N ATOM 868 CA LYS A 56 10.698 13.031 8.613 1.00 0.00 C ATOM 869 C LYS A 56 11.467 12.690 9.885 1.00 0.00 C ATOM 870 O LYS A 56 11.685 13.549 10.739 1.00 0.00 O ATOM 871 CB LYS A 56 9.233 12.616 8.763 1.00 0.00 C ATOM 872 CG LYS A 56 8.381 12.938 7.547 1.00 0.00 C ATOM 873 CD LYS A 56 7.996 14.408 7.510 1.00 0.00 C ATOM 874 CE LYS A 56 9.024 15.234 6.752 1.00 0.00 C ATOM 875 NZ LYS A 56 8.408 16.424 6.102 1.00 0.00 N ATOM 0 H LYS A 56 10.667 11.735 6.965 1.00 0.00 H new ATOM 0 HA LYS A 56 10.750 14.109 8.457 1.00 0.00 H new ATOM 0 HB2 LYS A 56 9.186 11.544 8.956 1.00 0.00 H new ATOM 0 HB3 LYS A 56 8.810 13.115 9.635 1.00 0.00 H new ATOM 0 HG2 LYS A 56 8.928 12.681 6.640 1.00 0.00 H new ATOM 0 HG3 LYS A 56 7.480 12.325 7.560 1.00 0.00 H new ATOM 0 HD2 LYS A 56 7.020 14.518 7.038 1.00 0.00 H new ATOM 0 HD3 LYS A 56 7.902 14.787 8.528 1.00 0.00 H new ATOM 0 HE2 LYS A 56 9.806 15.559 7.438 1.00 0.00 H new ATOM 0 HE3 LYS A 56 9.502 14.613 5.994 1.00 0.00 H new ATOM 0 HZ1 LYS A 56 9.141 16.961 5.596 1.00 0.00 H new ATOM 0 HZ2 LYS A 56 7.679 16.113 5.429 1.00 0.00 H new ATOM 0 HZ3 LYS A 56 7.974 17.030 6.827 1.00 0.00 H new ATOM 889 N ARG A 57 11.878 11.431 10.002 1.00 0.00 N ATOM 890 CA ARG A 57 12.623 10.977 11.170 1.00 0.00 C ATOM 891 C ARG A 57 13.835 11.869 11.423 1.00 0.00 C ATOM 892 O ARG A 57 14.425 12.433 10.501 1.00 0.00 O ATOM 893 CB ARG A 57 13.075 9.527 10.981 1.00 0.00 C ATOM 894 CG ARG A 57 11.940 8.520 11.065 1.00 0.00 C ATOM 895 CD ARG A 57 11.345 8.467 12.464 1.00 0.00 C ATOM 896 NE ARG A 57 10.270 9.439 12.638 1.00 0.00 N ATOM 897 CZ ARG A 57 9.836 9.850 13.825 1.00 0.00 C ATOM 898 NH1 ARG A 57 10.383 9.376 14.935 1.00 0.00 N ATOM 899 NH2 ARG A 57 8.853 10.738 13.902 1.00 0.00 N ATOM 0 H ARG A 57 11.708 10.708 9.303 1.00 0.00 H new ATOM 0 HA ARG A 57 11.963 11.036 12.036 1.00 0.00 H new ATOM 0 HB2 ARG A 57 13.564 9.431 10.011 1.00 0.00 H new ATOM 0 HB3 ARG A 57 13.820 9.286 11.739 1.00 0.00 H new ATOM 0 HG2 ARG A 57 11.163 8.785 10.348 1.00 0.00 H new ATOM 0 HG3 ARG A 57 12.307 7.532 10.787 1.00 0.00 H new ATOM 0 HD2 ARG A 57 10.962 7.465 12.658 1.00 0.00 H new ATOM 0 HD3 ARG A 57 12.128 8.657 13.198 1.00 0.00 H new ATOM 0 HE ARG A 57 9.828 9.824 11.803 1.00 0.00 H new ATOM 0 HH11 ARG A 57 11.139 8.694 14.880 1.00 0.00 H new ATOM 0 HH12 ARG A 57 10.048 9.693 15.845 1.00 0.00 H new ATOM 0 HH21 ARG A 57 8.430 11.106 13.050 1.00 0.00 H new ATOM 0 HH22 ARG A 57 8.520 11.053 14.813 1.00 0.00 H new ATOM 913 N PRO A 58 14.215 12.003 12.702 1.00 0.00 N ATOM 914 CA PRO A 58 15.359 12.826 13.106 1.00 0.00 C ATOM 915 C PRO A 58 16.690 12.222 12.671 1.00 0.00 C ATOM 916 O PRO A 58 16.765 11.040 12.334 1.00 0.00 O ATOM 917 CB PRO A 58 15.256 12.850 14.633 1.00 0.00 C ATOM 918 CG PRO A 58 14.518 11.605 14.983 1.00 0.00 C ATOM 919 CD PRO A 58 13.558 11.360 13.853 1.00 0.00 C ATOM 0 HA PRO A 58 15.333 13.815 12.648 1.00 0.00 H new ATOM 0 HB2 PRO A 58 16.243 12.869 15.096 1.00 0.00 H new ATOM 0 HB3 PRO A 58 14.724 13.736 14.980 1.00 0.00 H new ATOM 0 HG2 PRO A 58 15.203 10.766 15.102 1.00 0.00 H new ATOM 0 HG3 PRO A 58 13.987 11.719 15.928 1.00 0.00 H new ATOM 0 HD2 PRO A 58 13.401 10.295 13.683 1.00 0.00 H new ATOM 0 HD3 PRO A 58 12.580 11.798 14.054 1.00 0.00 H new ATOM 927 N ILE A 59 17.737 13.040 12.681 1.00 0.00 N ATOM 928 CA ILE A 59 19.065 12.585 12.289 1.00 0.00 C ATOM 929 C ILE A 59 19.500 11.381 13.117 1.00 0.00 C ATOM 930 O ILE A 59 20.259 10.532 12.649 1.00 0.00 O ATOM 931 CB ILE A 59 20.111 13.704 12.442 1.00 0.00 C ATOM 932 CG1 ILE A 59 21.473 13.233 11.929 1.00 0.00 C ATOM 933 CG2 ILE A 59 20.210 14.142 13.896 1.00 0.00 C ATOM 934 CD1 ILE A 59 21.546 13.121 10.422 1.00 0.00 C ATOM 0 H ILE A 59 17.691 14.021 12.956 1.00 0.00 H new ATOM 0 HA ILE A 59 19.003 12.298 11.239 1.00 0.00 H new ATOM 0 HB ILE A 59 19.795 14.560 11.845 1.00 0.00 H new ATOM 0 HG12 ILE A 59 22.241 13.927 12.271 1.00 0.00 H new ATOM 0 HG13 ILE A 59 21.702 12.262 12.369 1.00 0.00 H new ATOM 0 HG21 ILE A 59 20.954 14.934 13.988 1.00 0.00 H new ATOM 0 HG22 ILE A 59 19.241 14.513 14.231 1.00 0.00 H new ATOM 0 HG23 ILE A 59 20.506 13.293 14.512 1.00 0.00 H new ATOM 0 HD11 ILE A 59 22.540 12.782 10.130 1.00 0.00 H new ATOM 0 HD12 ILE A 59 20.802 12.405 10.074 1.00 0.00 H new ATOM 0 HD13 ILE A 59 21.349 14.095 9.975 1.00 0.00 H new ATOM 946 N LYS A 60 19.012 11.311 14.351 1.00 0.00 N ATOM 947 CA LYS A 60 19.347 10.209 15.246 1.00 0.00 C ATOM 948 C LYS A 60 18.733 8.903 14.753 1.00 0.00 C ATOM 949 O LYS A 60 19.294 7.827 14.958 1.00 0.00 O ATOM 950 CB LYS A 60 18.860 10.511 16.665 1.00 0.00 C ATOM 951 CG LYS A 60 17.353 10.661 16.772 1.00 0.00 C ATOM 952 CD LYS A 60 16.955 11.420 18.026 1.00 0.00 C ATOM 953 CE LYS A 60 17.189 12.915 17.871 1.00 0.00 C ATOM 954 NZ LYS A 60 17.185 13.616 19.185 1.00 0.00 N ATOM 0 H LYS A 60 18.383 12.005 14.755 1.00 0.00 H new ATOM 0 HA LYS A 60 20.431 10.099 15.257 1.00 0.00 H new ATOM 0 HB2 LYS A 60 19.185 9.711 17.330 1.00 0.00 H new ATOM 0 HB3 LYS A 60 19.334 11.428 17.015 1.00 0.00 H new ATOM 0 HG2 LYS A 60 16.976 11.185 15.894 1.00 0.00 H new ATOM 0 HG3 LYS A 60 16.888 9.675 16.780 1.00 0.00 H new ATOM 0 HD2 LYS A 60 15.903 11.236 18.245 1.00 0.00 H new ATOM 0 HD3 LYS A 60 17.528 11.047 18.875 1.00 0.00 H new ATOM 0 HE2 LYS A 60 18.144 13.083 17.372 1.00 0.00 H new ATOM 0 HE3 LYS A 60 16.416 13.339 17.231 1.00 0.00 H new ATOM 0 HZ1 LYS A 60 17.348 14.632 19.037 1.00 0.00 H new ATOM 0 HZ2 LYS A 60 16.265 13.477 19.650 1.00 0.00 H new ATOM 0 HZ3 LYS A 60 17.939 13.229 19.787 1.00 0.00 H new ATOM 968 N GLU A 61 17.578 9.005 14.102 1.00 0.00 N ATOM 969 CA GLU A 61 16.889 7.830 13.581 1.00 0.00 C ATOM 970 C GLU A 61 16.858 7.851 12.055 1.00 0.00 C ATOM 971 O GLU A 61 16.146 7.067 11.427 1.00 0.00 O ATOM 972 CB GLU A 61 15.463 7.763 14.130 1.00 0.00 C ATOM 973 CG GLU A 61 15.391 7.333 15.586 1.00 0.00 C ATOM 974 CD GLU A 61 15.634 5.848 15.769 1.00 0.00 C ATOM 975 OE1 GLU A 61 16.366 5.260 14.946 1.00 0.00 O ATOM 976 OE2 GLU A 61 15.092 5.273 16.736 1.00 0.00 O ATOM 0 H GLU A 61 17.100 9.888 13.923 1.00 0.00 H new ATOM 0 HA GLU A 61 17.437 6.945 13.904 1.00 0.00 H new ATOM 0 HB2 GLU A 61 14.996 8.742 14.026 1.00 0.00 H new ATOM 0 HB3 GLU A 61 14.882 7.067 13.525 1.00 0.00 H new ATOM 0 HG2 GLU A 61 16.128 7.892 16.163 1.00 0.00 H new ATOM 0 HG3 GLU A 61 14.411 7.589 15.988 1.00 0.00 H new ATOM 983 N VAL A 62 17.636 8.753 11.465 1.00 0.00 N ATOM 984 CA VAL A 62 17.699 8.876 10.014 1.00 0.00 C ATOM 985 C VAL A 62 18.503 7.736 9.400 1.00 0.00 C ATOM 986 O VAL A 62 18.009 6.971 8.571 1.00 0.00 O ATOM 987 CB VAL A 62 18.326 10.218 9.591 1.00 0.00 C ATOM 988 CG1 VAL A 62 19.097 10.060 8.290 1.00 0.00 C ATOM 989 CG2 VAL A 62 17.254 11.289 9.459 1.00 0.00 C ATOM 0 H VAL A 62 18.231 9.409 11.970 1.00 0.00 H new ATOM 0 HA VAL A 62 16.673 8.831 9.648 1.00 0.00 H new ATOM 0 HB VAL A 62 19.027 10.532 10.365 1.00 0.00 H new ATOM 0 HG11 VAL A 62 19.533 11.018 8.007 1.00 0.00 H new ATOM 0 HG12 VAL A 62 19.891 9.326 8.425 1.00 0.00 H new ATOM 0 HG13 VAL A 62 18.420 9.723 7.505 1.00 0.00 H new ATOM 0 HG21 VAL A 62 17.715 12.230 9.160 1.00 0.00 H new ATOM 0 HG22 VAL A 62 16.527 10.985 8.706 1.00 0.00 H new ATOM 0 HG23 VAL A 62 16.751 11.420 10.417 1.00 0.00 H new ATOM 999 N PRO A 63 19.773 7.617 9.815 1.00 0.00 N ATOM 1000 CA PRO A 63 20.673 6.572 9.319 1.00 0.00 C ATOM 1001 C PRO A 63 20.278 5.184 9.814 1.00 0.00 C ATOM 1002 O PRO A 63 20.118 4.255 9.023 1.00 0.00 O ATOM 1003 CB PRO A 63 22.034 6.976 9.890 1.00 0.00 C ATOM 1004 CG PRO A 63 21.713 7.776 11.105 1.00 0.00 C ATOM 1005 CD PRO A 63 20.428 8.494 10.800 1.00 0.00 C ATOM 0 HA PRO A 63 20.656 6.501 8.231 1.00 0.00 H new ATOM 0 HB2 PRO A 63 22.634 6.101 10.139 1.00 0.00 H new ATOM 0 HB3 PRO A 63 22.607 7.561 9.171 1.00 0.00 H new ATOM 0 HG2 PRO A 63 21.603 7.133 11.978 1.00 0.00 H new ATOM 0 HG3 PRO A 63 22.512 8.483 11.329 1.00 0.00 H new ATOM 0 HD2 PRO A 63 19.817 8.621 11.694 1.00 0.00 H new ATOM 0 HD3 PRO A 63 20.610 9.489 10.394 1.00 0.00 H new ATOM 1013 N SER A 64 20.123 5.052 11.128 1.00 0.00 N ATOM 1014 CA SER A 64 19.750 3.776 11.728 1.00 0.00 C ATOM 1015 C SER A 64 18.645 3.099 10.923 1.00 0.00 C ATOM 1016 O SER A 64 18.609 1.874 10.807 1.00 0.00 O ATOM 1017 CB SER A 64 19.291 3.984 13.173 1.00 0.00 C ATOM 1018 OG SER A 64 20.387 4.281 14.019 1.00 0.00 O ATOM 0 H SER A 64 20.250 5.812 11.796 1.00 0.00 H new ATOM 0 HA SER A 64 20.627 3.129 11.722 1.00 0.00 H new ATOM 0 HB2 SER A 64 18.566 4.797 13.214 1.00 0.00 H new ATOM 0 HB3 SER A 64 18.785 3.087 13.530 1.00 0.00 H new ATOM 0 HG SER A 64 20.067 4.411 14.936 1.00 0.00 H new ATOM 1024 N ARG A 65 17.747 3.906 10.369 1.00 0.00 N ATOM 1025 CA ARG A 65 16.639 3.386 9.576 1.00 0.00 C ATOM 1026 C ARG A 65 17.103 3.021 8.168 1.00 0.00 C ATOM 1027 O ARG A 65 16.679 2.011 7.606 1.00 0.00 O ATOM 1028 CB ARG A 65 15.510 4.414 9.501 1.00 0.00 C ATOM 1029 CG ARG A 65 14.499 4.292 10.630 1.00 0.00 C ATOM 1030 CD ARG A 65 13.513 3.163 10.375 1.00 0.00 C ATOM 1031 NE ARG A 65 12.250 3.371 11.078 1.00 0.00 N ATOM 1032 CZ ARG A 65 12.050 3.031 12.346 1.00 0.00 C ATOM 1033 NH1 ARG A 65 13.025 2.469 13.047 1.00 0.00 N ATOM 1034 NH2 ARG A 65 10.872 3.252 12.916 1.00 0.00 N ATOM 0 H ARG A 65 17.764 4.922 10.454 1.00 0.00 H new ATOM 0 HA ARG A 65 16.268 2.485 10.064 1.00 0.00 H new ATOM 0 HB2 ARG A 65 15.940 5.415 9.517 1.00 0.00 H new ATOM 0 HB3 ARG A 65 14.993 4.304 8.548 1.00 0.00 H new ATOM 0 HG2 ARG A 65 15.021 4.115 11.570 1.00 0.00 H new ATOM 0 HG3 ARG A 65 13.958 5.232 10.738 1.00 0.00 H new ATOM 0 HD2 ARG A 65 13.323 3.082 9.305 1.00 0.00 H new ATOM 0 HD3 ARG A 65 13.954 2.218 10.693 1.00 0.00 H new ATOM 0 HE ARG A 65 11.479 3.801 10.567 1.00 0.00 H new ATOM 0 HH11 ARG A 65 13.932 2.297 12.613 1.00 0.00 H new ATOM 0 HH12 ARG A 65 12.868 2.209 14.021 1.00 0.00 H new ATOM 0 HH21 ARG A 65 10.119 3.683 12.380 1.00 0.00 H new ATOM 0 HH22 ARG A 65 10.720 2.990 13.890 1.00 0.00 H new ATOM 1048 N VAL A 66 17.976 3.850 7.605 1.00 0.00 N ATOM 1049 CA VAL A 66 18.498 3.616 6.264 1.00 0.00 C ATOM 1050 C VAL A 66 18.623 2.124 5.977 1.00 0.00 C ATOM 1051 O VAL A 66 17.891 1.578 5.151 1.00 0.00 O ATOM 1052 CB VAL A 66 19.874 4.281 6.073 1.00 0.00 C ATOM 1053 CG1 VAL A 66 20.520 3.810 4.779 1.00 0.00 C ATOM 1054 CG2 VAL A 66 19.739 5.796 6.090 1.00 0.00 C ATOM 0 H VAL A 66 18.337 4.690 8.057 1.00 0.00 H new ATOM 0 HA VAL A 66 17.788 4.060 5.566 1.00 0.00 H new ATOM 0 HB VAL A 66 20.519 3.986 6.901 1.00 0.00 H new ATOM 0 HG11 VAL A 66 21.491 4.291 4.661 1.00 0.00 H new ATOM 0 HG12 VAL A 66 20.652 2.728 4.811 1.00 0.00 H new ATOM 0 HG13 VAL A 66 19.881 4.073 3.936 1.00 0.00 H new ATOM 0 HG21 VAL A 66 20.720 6.250 5.954 1.00 0.00 H new ATOM 0 HG22 VAL A 66 19.078 6.111 5.283 1.00 0.00 H new ATOM 0 HG23 VAL A 66 19.322 6.113 7.046 1.00 0.00 H new ATOM 1064 N GLN A 67 19.554 1.470 6.664 1.00 0.00 N ATOM 1065 CA GLN A 67 19.775 0.040 6.482 1.00 0.00 C ATOM 1066 C GLN A 67 18.503 -0.748 6.773 1.00 0.00 C ATOM 1067 O GLN A 67 18.101 -1.607 5.988 1.00 0.00 O ATOM 1068 CB GLN A 67 20.907 -0.442 7.390 1.00 0.00 C ATOM 1069 CG GLN A 67 20.523 -0.509 8.859 1.00 0.00 C ATOM 1070 CD GLN A 67 21.711 -0.773 9.762 1.00 0.00 C ATOM 1071 OE1 GLN A 67 22.796 -1.122 9.294 1.00 0.00 O ATOM 1072 NE2 GLN A 67 21.513 -0.608 11.065 1.00 0.00 N ATOM 0 H GLN A 67 20.167 1.907 7.352 1.00 0.00 H new ATOM 0 HA GLN A 67 20.056 -0.130 5.443 1.00 0.00 H new ATOM 0 HB2 GLN A 67 21.229 -1.430 7.062 1.00 0.00 H new ATOM 0 HB3 GLN A 67 21.761 0.225 7.277 1.00 0.00 H new ATOM 0 HG2 GLN A 67 20.052 0.430 9.150 1.00 0.00 H new ATOM 0 HG3 GLN A 67 19.782 -1.295 9.001 1.00 0.00 H new ATOM 0 HE21 GLN A 67 20.598 -0.318 11.409 1.00 0.00 H new ATOM 0 HE22 GLN A 67 22.276 -0.771 11.722 1.00 0.00 H new ATOM 1081 N GLU A 68 17.874 -0.451 7.906 1.00 0.00 N ATOM 1082 CA GLU A 68 16.648 -1.134 8.300 1.00 0.00 C ATOM 1083 C GLU A 68 15.693 -1.265 7.117 1.00 0.00 C ATOM 1084 O GLU A 68 15.370 -2.372 6.686 1.00 0.00 O ATOM 1085 CB GLU A 68 15.962 -0.380 9.441 1.00 0.00 C ATOM 1086 CG GLU A 68 16.534 -0.699 10.812 1.00 0.00 C ATOM 1087 CD GLU A 68 16.454 -2.176 11.148 1.00 0.00 C ATOM 1088 OE1 GLU A 68 15.335 -2.730 11.123 1.00 0.00 O ATOM 1089 OE2 GLU A 68 17.510 -2.778 11.436 1.00 0.00 O ATOM 0 H GLU A 68 18.193 0.258 8.567 1.00 0.00 H new ATOM 0 HA GLU A 68 16.914 -2.134 8.642 1.00 0.00 H new ATOM 0 HB2 GLU A 68 16.049 0.692 9.261 1.00 0.00 H new ATOM 0 HB3 GLU A 68 14.899 -0.619 9.436 1.00 0.00 H new ATOM 0 HG2 GLU A 68 17.575 -0.377 10.851 1.00 0.00 H new ATOM 0 HG3 GLU A 68 15.995 -0.128 11.568 1.00 0.00 H new ATOM 1096 N ILE A 69 15.245 -0.127 6.597 1.00 0.00 N ATOM 1097 CA ILE A 69 14.329 -0.114 5.463 1.00 0.00 C ATOM 1098 C ILE A 69 14.820 -1.032 4.349 1.00 0.00 C ATOM 1099 O ILE A 69 14.043 -1.789 3.768 1.00 0.00 O ATOM 1100 CB ILE A 69 14.150 1.308 4.900 1.00 0.00 C ATOM 1101 CG1 ILE A 69 13.569 2.235 5.971 1.00 0.00 C ATOM 1102 CG2 ILE A 69 13.253 1.282 3.672 1.00 0.00 C ATOM 1103 CD1 ILE A 69 13.941 3.688 5.778 1.00 0.00 C ATOM 0 H ILE A 69 15.501 0.798 6.943 1.00 0.00 H new ATOM 0 HA ILE A 69 13.368 -0.474 5.830 1.00 0.00 H new ATOM 0 HB ILE A 69 15.127 1.692 4.605 1.00 0.00 H new ATOM 0 HG12 ILE A 69 12.483 2.143 5.969 1.00 0.00 H new ATOM 0 HG13 ILE A 69 13.915 1.907 6.951 1.00 0.00 H new ATOM 0 HG21 ILE A 69 13.136 2.294 3.285 1.00 0.00 H new ATOM 0 HG22 ILE A 69 13.703 0.651 2.906 1.00 0.00 H new ATOM 0 HG23 ILE A 69 12.276 0.882 3.943 1.00 0.00 H new ATOM 0 HD11 ILE A 69 13.495 4.286 6.573 1.00 0.00 H new ATOM 0 HD12 ILE A 69 15.025 3.793 5.809 1.00 0.00 H new ATOM 0 HD13 ILE A 69 13.571 4.033 4.813 1.00 0.00 H new ATOM 1115 N TRP A 70 16.113 -0.960 4.058 1.00 0.00 N ATOM 1116 CA TRP A 70 16.709 -1.786 3.013 1.00 0.00 C ATOM 1117 C TRP A 70 16.805 -3.241 3.459 1.00 0.00 C ATOM 1118 O TRP A 70 16.916 -4.145 2.632 1.00 0.00 O ATOM 1119 CB TRP A 70 18.097 -1.259 2.647 1.00 0.00 C ATOM 1120 CG TRP A 70 19.110 -2.344 2.446 1.00 0.00 C ATOM 1121 CD1 TRP A 70 19.678 -3.124 3.413 1.00 0.00 C ATOM 1122 CD2 TRP A 70 19.677 -2.768 1.201 1.00 0.00 C ATOM 1123 NE1 TRP A 70 20.564 -4.008 2.844 1.00 0.00 N ATOM 1124 CE2 TRP A 70 20.581 -3.810 1.488 1.00 0.00 C ATOM 1125 CE3 TRP A 70 19.508 -2.371 -0.128 1.00 0.00 C ATOM 1126 CZ2 TRP A 70 21.311 -4.456 0.494 1.00 0.00 C ATOM 1127 CZ3 TRP A 70 20.234 -3.012 -1.113 1.00 0.00 C ATOM 1128 CH2 TRP A 70 21.126 -4.046 -0.798 1.00 0.00 C ATOM 0 H TRP A 70 16.770 -0.339 4.530 1.00 0.00 H new ATOM 0 HA TRP A 70 16.066 -1.736 2.134 1.00 0.00 H new ATOM 0 HB2 TRP A 70 18.024 -0.667 1.735 1.00 0.00 H new ATOM 0 HB3 TRP A 70 18.443 -0.590 3.435 1.00 0.00 H new ATOM 0 HD1 TRP A 70 19.463 -3.056 4.469 1.00 0.00 H new ATOM 0 HE1 TRP A 70 21.119 -4.699 3.349 1.00 0.00 H new ATOM 0 HE3 TRP A 70 18.821 -1.577 -0.381 1.00 0.00 H new ATOM 0 HZ2 TRP A 70 21.999 -5.253 0.734 1.00 0.00 H new ATOM 0 HZ3 TRP A 70 20.112 -2.711 -2.143 1.00 0.00 H new ATOM 0 HH2 TRP A 70 21.678 -4.529 -1.591 1.00 0.00 H new ATOM 1139 N GLN A 71 16.761 -3.458 4.770 1.00 0.00 N ATOM 1140 CA GLN A 71 16.844 -4.804 5.323 1.00 0.00 C ATOM 1141 C GLN A 71 15.453 -5.402 5.511 1.00 0.00 C ATOM 1142 O GLN A 71 15.314 -6.561 5.901 1.00 0.00 O ATOM 1143 CB GLN A 71 17.588 -4.784 6.660 1.00 0.00 C ATOM 1144 CG GLN A 71 19.077 -4.510 6.523 1.00 0.00 C ATOM 1145 CD GLN A 71 19.879 -5.050 7.690 1.00 0.00 C ATOM 1146 OE1 GLN A 71 19.789 -4.542 8.808 1.00 0.00 O ATOM 1147 NE2 GLN A 71 20.671 -6.086 7.437 1.00 0.00 N ATOM 0 H GLN A 71 16.668 -2.720 5.468 1.00 0.00 H new ATOM 0 HA GLN A 71 17.395 -5.426 4.618 1.00 0.00 H new ATOM 0 HB2 GLN A 71 17.144 -4.023 7.302 1.00 0.00 H new ATOM 0 HB3 GLN A 71 17.448 -5.743 7.159 1.00 0.00 H new ATOM 0 HG2 GLN A 71 19.441 -4.958 5.598 1.00 0.00 H new ATOM 0 HG3 GLN A 71 19.239 -3.435 6.442 1.00 0.00 H new ATOM 0 HE21 GLN A 71 20.715 -6.476 6.496 1.00 0.00 H new ATOM 0 HE22 GLN A 71 21.235 -6.491 8.184 1.00 0.00 H new ATOM 1156 N GLU A 72 14.428 -4.603 5.232 1.00 0.00 N ATOM 1157 CA GLU A 72 13.049 -5.054 5.371 1.00 0.00 C ATOM 1158 C GLU A 72 12.494 -5.532 4.032 1.00 0.00 C ATOM 1159 O GLU A 72 11.886 -6.600 3.945 1.00 0.00 O ATOM 1160 CB GLU A 72 12.174 -3.928 5.925 1.00 0.00 C ATOM 1161 CG GLU A 72 10.822 -4.401 6.432 1.00 0.00 C ATOM 1162 CD GLU A 72 10.844 -4.761 7.905 1.00 0.00 C ATOM 1163 OE1 GLU A 72 11.912 -5.182 8.397 1.00 0.00 O ATOM 1164 OE2 GLU A 72 9.793 -4.622 8.565 1.00 0.00 O ATOM 0 H GLU A 72 14.527 -3.641 4.909 1.00 0.00 H new ATOM 0 HA GLU A 72 13.037 -5.891 6.069 1.00 0.00 H new ATOM 0 HB2 GLU A 72 12.705 -3.433 6.738 1.00 0.00 H new ATOM 0 HB3 GLU A 72 12.020 -3.182 5.145 1.00 0.00 H new ATOM 0 HG2 GLU A 72 10.081 -3.619 6.264 1.00 0.00 H new ATOM 0 HG3 GLU A 72 10.505 -5.269 5.854 1.00 0.00 H new ATOM 1171 N PHE A 73 12.708 -4.734 2.992 1.00 0.00 N ATOM 1172 CA PHE A 73 12.229 -5.074 1.657 1.00 0.00 C ATOM 1173 C PHE A 73 13.394 -5.231 0.684 1.00 0.00 C ATOM 1174 O PHE A 73 13.391 -6.120 -0.168 1.00 0.00 O ATOM 1175 CB PHE A 73 11.267 -3.998 1.148 1.00 0.00 C ATOM 1176 CG PHE A 73 10.439 -3.373 2.234 1.00 0.00 C ATOM 1177 CD1 PHE A 73 10.996 -2.448 3.102 1.00 0.00 C ATOM 1178 CD2 PHE A 73 9.103 -3.709 2.386 1.00 0.00 C ATOM 1179 CE1 PHE A 73 10.237 -1.871 4.103 1.00 0.00 C ATOM 1180 CE2 PHE A 73 8.339 -3.135 3.385 1.00 0.00 C ATOM 1181 CZ PHE A 73 8.906 -2.214 4.243 1.00 0.00 C ATOM 0 H PHE A 73 13.210 -3.848 3.047 1.00 0.00 H new ATOM 0 HA PHE A 73 11.700 -6.025 1.720 1.00 0.00 H new ATOM 0 HB2 PHE A 73 11.839 -3.219 0.644 1.00 0.00 H new ATOM 0 HB3 PHE A 73 10.603 -4.438 0.403 1.00 0.00 H new ATOM 0 HD1 PHE A 73 12.035 -2.174 2.995 1.00 0.00 H new ATOM 0 HD2 PHE A 73 8.654 -4.427 1.716 1.00 0.00 H new ATOM 0 HE1 PHE A 73 10.684 -1.153 4.775 1.00 0.00 H new ATOM 0 HE2 PHE A 73 7.299 -3.407 3.494 1.00 0.00 H new ATOM 0 HZ PHE A 73 8.310 -1.762 5.022 1.00 0.00 H new ATOM 1191 N LEU A 74 14.389 -4.361 0.818 1.00 0.00 N ATOM 1192 CA LEU A 74 15.562 -4.402 -0.049 1.00 0.00 C ATOM 1193 C LEU A 74 16.565 -5.441 0.441 1.00 0.00 C ATOM 1194 O LEU A 74 17.736 -5.413 0.064 1.00 0.00 O ATOM 1195 CB LEU A 74 16.225 -3.024 -0.108 1.00 0.00 C ATOM 1196 CG LEU A 74 15.281 -1.832 -0.266 1.00 0.00 C ATOM 1197 CD1 LEU A 74 16.053 -0.524 -0.173 1.00 0.00 C ATOM 1198 CD2 LEU A 74 14.530 -1.917 -1.587 1.00 0.00 C ATOM 0 H LEU A 74 14.407 -3.619 1.518 1.00 0.00 H new ATOM 0 HA LEU A 74 15.234 -4.684 -1.050 1.00 0.00 H new ATOM 0 HB2 LEU A 74 16.806 -2.883 0.803 1.00 0.00 H new ATOM 0 HB3 LEU A 74 16.929 -3.017 -0.940 1.00 0.00 H new ATOM 0 HG LEU A 74 14.553 -1.860 0.545 1.00 0.00 H new ATOM 0 HD11 LEU A 74 15.365 0.314 -0.288 1.00 0.00 H new ATOM 0 HD12 LEU A 74 16.544 -0.460 0.798 1.00 0.00 H new ATOM 0 HD13 LEU A 74 16.804 -0.488 -0.963 1.00 0.00 H new ATOM 0 HD21 LEU A 74 13.863 -1.060 -1.682 1.00 0.00 H new ATOM 0 HD22 LEU A 74 15.243 -1.915 -2.412 1.00 0.00 H new ATOM 0 HD23 LEU A 74 13.946 -2.837 -1.615 1.00 0.00 H new ATOM 1210 N ALA A 75 16.097 -6.358 1.280 1.00 0.00 N ATOM 1211 CA ALA A 75 16.952 -7.409 1.818 1.00 0.00 C ATOM 1212 C ALA A 75 16.509 -8.783 1.326 1.00 0.00 C ATOM 1213 O ALA A 75 15.335 -9.015 1.033 1.00 0.00 O ATOM 1214 CB ALA A 75 16.949 -7.365 3.339 1.00 0.00 C ATOM 0 H ALA A 75 15.130 -6.395 1.602 1.00 0.00 H new ATOM 0 HA ALA A 75 17.967 -7.235 1.462 1.00 0.00 H new ATOM 0 HB1 ALA A 75 17.592 -8.155 3.727 1.00 0.00 H new ATOM 0 HB2 ALA A 75 17.320 -6.397 3.676 1.00 0.00 H new ATOM 0 HB3 ALA A 75 15.933 -7.511 3.705 1.00 0.00 H new ATOM 1220 N PRO A 76 17.467 -9.716 1.231 1.00 0.00 N ATOM 1221 CA PRO A 76 17.199 -11.083 0.774 1.00 0.00 C ATOM 1222 C PRO A 76 16.384 -11.883 1.785 1.00 0.00 C ATOM 1223 O PRO A 76 15.346 -12.452 1.449 1.00 0.00 O ATOM 1224 CB PRO A 76 18.597 -11.686 0.618 1.00 0.00 C ATOM 1225 CG PRO A 76 19.454 -10.902 1.552 1.00 0.00 C ATOM 1226 CD PRO A 76 18.887 -9.509 1.563 1.00 0.00 C ATOM 0 HA PRO A 76 16.609 -11.098 -0.142 1.00 0.00 H new ATOM 0 HB2 PRO A 76 18.602 -12.746 0.872 1.00 0.00 H new ATOM 0 HB3 PRO A 76 18.952 -11.603 -0.409 1.00 0.00 H new ATOM 0 HG2 PRO A 76 19.441 -11.337 2.552 1.00 0.00 H new ATOM 0 HG3 PRO A 76 20.492 -10.898 1.219 1.00 0.00 H new ATOM 0 HD2 PRO A 76 19.007 -9.034 2.537 1.00 0.00 H new ATOM 0 HD3 PRO A 76 19.381 -8.868 0.833 1.00 0.00 H new ATOM 1234 N GLY A 77 16.861 -11.921 3.025 1.00 0.00 N ATOM 1235 CA GLY A 77 16.163 -12.654 4.066 1.00 0.00 C ATOM 1236 C GLY A 77 15.195 -11.781 4.840 1.00 0.00 C ATOM 1237 O GLY A 77 15.221 -11.755 6.070 1.00 0.00 O ATOM 0 H GLY A 77 17.718 -11.458 3.328 1.00 0.00 H new ATOM 0 HA2 GLY A 77 15.619 -13.486 3.618 1.00 0.00 H new ATOM 0 HA3 GLY A 77 16.891 -13.083 4.755 1.00 0.00 H new ATOM 1241 N ALA A 78 14.341 -11.063 4.118 1.00 0.00 N ATOM 1242 CA ALA A 78 13.361 -10.186 4.745 1.00 0.00 C ATOM 1243 C ALA A 78 11.939 -10.623 4.410 1.00 0.00 C ATOM 1244 O ALA A 78 11.689 -11.291 3.407 1.00 0.00 O ATOM 1245 CB ALA A 78 13.588 -8.745 4.311 1.00 0.00 C ATOM 0 H ALA A 78 14.308 -11.072 3.099 1.00 0.00 H new ATOM 0 HA ALA A 78 13.489 -10.253 5.825 1.00 0.00 H new ATOM 0 HB1 ALA A 78 12.849 -8.101 4.787 1.00 0.00 H new ATOM 0 HB2 ALA A 78 14.588 -8.429 4.607 1.00 0.00 H new ATOM 0 HB3 ALA A 78 13.490 -8.671 3.228 1.00 0.00 H new ATOM 1251 N PRO A 79 10.983 -10.240 5.270 1.00 0.00 N ATOM 1252 CA PRO A 79 9.569 -10.582 5.086 1.00 0.00 C ATOM 1253 C PRO A 79 8.943 -9.844 3.907 1.00 0.00 C ATOM 1254 O PRO A 79 8.346 -10.459 3.024 1.00 0.00 O ATOM 1255 CB PRO A 79 8.923 -10.137 6.400 1.00 0.00 C ATOM 1256 CG PRO A 79 9.818 -9.066 6.919 1.00 0.00 C ATOM 1257 CD PRO A 79 11.208 -9.442 6.487 1.00 0.00 C ATOM 0 HA PRO A 79 9.431 -11.640 4.864 1.00 0.00 H new ATOM 0 HB2 PRO A 79 7.912 -9.764 6.237 1.00 0.00 H new ATOM 0 HB3 PRO A 79 8.847 -10.965 7.104 1.00 0.00 H new ATOM 0 HG2 PRO A 79 9.535 -8.093 6.518 1.00 0.00 H new ATOM 0 HG3 PRO A 79 9.753 -8.995 8.005 1.00 0.00 H new ATOM 0 HD2 PRO A 79 11.817 -8.562 6.283 1.00 0.00 H new ATOM 0 HD3 PRO A 79 11.726 -10.017 7.255 1.00 0.00 H new ATOM 1265 N SER A 80 9.084 -8.522 3.900 1.00 0.00 N ATOM 1266 CA SER A 80 8.528 -7.700 2.831 1.00 0.00 C ATOM 1267 C SER A 80 9.513 -7.579 1.672 1.00 0.00 C ATOM 1268 O SER A 80 9.391 -6.689 0.831 1.00 0.00 O ATOM 1269 CB SER A 80 8.173 -6.310 3.361 1.00 0.00 C ATOM 1270 OG SER A 80 7.434 -6.397 4.567 1.00 0.00 O ATOM 0 H SER A 80 9.578 -7.998 4.622 1.00 0.00 H new ATOM 0 HA SER A 80 7.622 -8.184 2.466 1.00 0.00 H new ATOM 0 HB2 SER A 80 9.085 -5.738 3.530 1.00 0.00 H new ATOM 0 HB3 SER A 80 7.592 -5.770 2.613 1.00 0.00 H new ATOM 0 HG SER A 80 7.274 -5.496 4.918 1.00 0.00 H new ATOM 1276 N ALA A 81 10.488 -8.481 1.635 1.00 0.00 N ATOM 1277 CA ALA A 81 11.492 -8.478 0.579 1.00 0.00 C ATOM 1278 C ALA A 81 10.852 -8.260 -0.787 1.00 0.00 C ATOM 1279 O ALA A 81 10.249 -9.172 -1.353 1.00 0.00 O ATOM 1280 CB ALA A 81 12.279 -9.780 0.594 1.00 0.00 C ATOM 0 H ALA A 81 10.604 -9.223 2.325 1.00 0.00 H new ATOM 0 HA ALA A 81 12.177 -7.651 0.766 1.00 0.00 H new ATOM 0 HB1 ALA A 81 13.025 -9.763 -0.200 1.00 0.00 H new ATOM 0 HB2 ALA A 81 12.777 -9.893 1.557 1.00 0.00 H new ATOM 0 HB3 ALA A 81 11.600 -10.618 0.436 1.00 0.00 H new ATOM 1286 N ILE A 82 10.985 -7.046 -1.311 1.00 0.00 N ATOM 1287 CA ILE A 82 10.419 -6.709 -2.612 1.00 0.00 C ATOM 1288 C ILE A 82 11.429 -6.947 -3.729 1.00 0.00 C ATOM 1289 O ILE A 82 12.547 -7.397 -3.483 1.00 0.00 O ATOM 1290 CB ILE A 82 9.953 -5.242 -2.660 1.00 0.00 C ATOM 1291 CG1 ILE A 82 11.140 -4.300 -2.451 1.00 0.00 C ATOM 1292 CG2 ILE A 82 8.880 -4.992 -1.611 1.00 0.00 C ATOM 1293 CD1 ILE A 82 10.999 -2.980 -3.176 1.00 0.00 C ATOM 0 H ILE A 82 11.480 -6.279 -0.855 1.00 0.00 H new ATOM 0 HA ILE A 82 9.557 -7.360 -2.760 1.00 0.00 H new ATOM 0 HB ILE A 82 9.525 -5.044 -3.643 1.00 0.00 H new ATOM 0 HG12 ILE A 82 11.258 -4.109 -1.384 1.00 0.00 H new ATOM 0 HG13 ILE A 82 12.050 -4.795 -2.789 1.00 0.00 H new ATOM 0 HG21 ILE A 82 8.561 -3.951 -1.658 1.00 0.00 H new ATOM 0 HG22 ILE A 82 8.026 -5.642 -1.802 1.00 0.00 H new ATOM 0 HG23 ILE A 82 9.283 -5.204 -0.621 1.00 0.00 H new ATOM 0 HD11 ILE A 82 11.877 -2.363 -2.983 1.00 0.00 H new ATOM 0 HD12 ILE A 82 10.912 -3.161 -4.247 1.00 0.00 H new ATOM 0 HD13 ILE A 82 10.107 -2.464 -2.821 1.00 0.00 H new ATOM 1305 N ASN A 83 11.027 -6.641 -4.958 1.00 0.00 N ATOM 1306 CA ASN A 83 11.897 -6.820 -6.115 1.00 0.00 C ATOM 1307 C ASN A 83 11.935 -5.556 -6.968 1.00 0.00 C ATOM 1308 O ASN A 83 10.919 -4.882 -7.144 1.00 0.00 O ATOM 1309 CB ASN A 83 11.422 -8.005 -6.958 1.00 0.00 C ATOM 1310 CG ASN A 83 12.391 -8.345 -8.074 1.00 0.00 C ATOM 1311 OD1 ASN A 83 13.488 -8.846 -7.828 1.00 0.00 O ATOM 1312 ND2 ASN A 83 11.987 -8.075 -9.310 1.00 0.00 N ATOM 0 H ASN A 83 10.104 -6.268 -5.179 1.00 0.00 H new ATOM 0 HA ASN A 83 12.905 -7.022 -5.753 1.00 0.00 H new ATOM 0 HB2 ASN A 83 11.292 -8.876 -6.315 1.00 0.00 H new ATOM 0 HB3 ASN A 83 10.446 -7.776 -7.385 1.00 0.00 H new ATOM 0 HD21 ASN A 83 12.595 -8.283 -10.102 1.00 0.00 H new ATOM 0 HD22 ASN A 83 11.069 -7.659 -9.467 1.00 0.00 H new ATOM 1319 N LEU A 84 13.112 -5.241 -7.497 1.00 0.00 N ATOM 1320 CA LEU A 84 13.283 -4.059 -8.334 1.00 0.00 C ATOM 1321 C LEU A 84 14.065 -4.395 -9.600 1.00 0.00 C ATOM 1322 O LEU A 84 14.535 -5.520 -9.770 1.00 0.00 O ATOM 1323 CB LEU A 84 14.003 -2.957 -7.554 1.00 0.00 C ATOM 1324 CG LEU A 84 13.324 -2.494 -6.265 1.00 0.00 C ATOM 1325 CD1 LEU A 84 14.346 -1.911 -5.302 1.00 0.00 C ATOM 1326 CD2 LEU A 84 12.235 -1.476 -6.571 1.00 0.00 C ATOM 0 H LEU A 84 13.962 -5.788 -7.361 1.00 0.00 H new ATOM 0 HA LEU A 84 12.294 -3.704 -8.624 1.00 0.00 H new ATOM 0 HB2 LEU A 84 15.005 -3.309 -7.307 1.00 0.00 H new ATOM 0 HB3 LEU A 84 14.121 -2.094 -8.209 1.00 0.00 H new ATOM 0 HG LEU A 84 12.861 -3.359 -5.791 1.00 0.00 H new ATOM 0 HD11 LEU A 84 13.844 -1.587 -4.391 1.00 0.00 H new ATOM 0 HD12 LEU A 84 15.089 -2.670 -5.057 1.00 0.00 H new ATOM 0 HD13 LEU A 84 14.839 -1.058 -5.767 1.00 0.00 H new ATOM 0 HD21 LEU A 84 11.763 -1.158 -5.642 1.00 0.00 H new ATOM 0 HD22 LEU A 84 12.674 -0.612 -7.069 1.00 0.00 H new ATOM 0 HD23 LEU A 84 11.487 -1.928 -7.222 1.00 0.00 H new ATOM 1338 N ASP A 85 14.201 -3.413 -10.483 1.00 0.00 N ATOM 1339 CA ASP A 85 14.929 -3.604 -11.733 1.00 0.00 C ATOM 1340 C ASP A 85 16.435 -3.593 -11.491 1.00 0.00 C ATOM 1341 O ASP A 85 16.899 -3.204 -10.419 1.00 0.00 O ATOM 1342 CB ASP A 85 14.554 -2.514 -12.738 1.00 0.00 C ATOM 1343 CG ASP A 85 14.803 -2.939 -14.172 1.00 0.00 C ATOM 1344 OD1 ASP A 85 14.198 -3.941 -14.608 1.00 0.00 O ATOM 1345 OD2 ASP A 85 15.601 -2.268 -14.859 1.00 0.00 O ATOM 0 H ASP A 85 13.817 -2.476 -10.357 1.00 0.00 H new ATOM 0 HA ASP A 85 14.651 -4.575 -12.142 1.00 0.00 H new ATOM 0 HB2 ASP A 85 13.502 -2.257 -12.616 1.00 0.00 H new ATOM 0 HB3 ASP A 85 15.129 -1.613 -12.524 1.00 0.00 H new ATOM 1350 N SER A 86 17.194 -4.025 -12.493 1.00 0.00 N ATOM 1351 CA SER A 86 18.647 -4.070 -12.388 1.00 0.00 C ATOM 1352 C SER A 86 19.232 -2.662 -12.325 1.00 0.00 C ATOM 1353 O SER A 86 20.155 -2.394 -11.556 1.00 0.00 O ATOM 1354 CB SER A 86 19.243 -4.829 -13.575 1.00 0.00 C ATOM 1355 OG SER A 86 18.799 -4.281 -14.805 1.00 0.00 O ATOM 0 H SER A 86 16.826 -4.349 -13.387 1.00 0.00 H new ATOM 0 HA SER A 86 18.903 -4.593 -11.466 1.00 0.00 H new ATOM 0 HB2 SER A 86 20.331 -4.789 -13.527 1.00 0.00 H new ATOM 0 HB3 SER A 86 18.960 -5.880 -13.518 1.00 0.00 H new ATOM 0 HG SER A 86 19.195 -4.782 -15.548 1.00 0.00 H new ATOM 1361 N LYS A 87 18.687 -1.766 -13.140 1.00 0.00 N ATOM 1362 CA LYS A 87 19.151 -0.384 -13.178 1.00 0.00 C ATOM 1363 C LYS A 87 18.863 0.324 -11.858 1.00 0.00 C ATOM 1364 O LYS A 87 19.692 1.081 -11.355 1.00 0.00 O ATOM 1365 CB LYS A 87 18.481 0.369 -14.330 1.00 0.00 C ATOM 1366 CG LYS A 87 16.987 0.570 -14.138 1.00 0.00 C ATOM 1367 CD LYS A 87 16.388 1.404 -15.258 1.00 0.00 C ATOM 1368 CE LYS A 87 15.093 2.073 -14.823 1.00 0.00 C ATOM 1369 NZ LYS A 87 14.039 1.076 -14.486 1.00 0.00 N ATOM 0 H LYS A 87 17.923 -1.972 -13.784 1.00 0.00 H new ATOM 0 HA LYS A 87 20.229 -0.394 -13.336 1.00 0.00 H new ATOM 0 HB2 LYS A 87 18.958 1.342 -14.443 1.00 0.00 H new ATOM 0 HB3 LYS A 87 18.649 -0.178 -15.257 1.00 0.00 H new ATOM 0 HG2 LYS A 87 16.491 -0.400 -14.100 1.00 0.00 H new ATOM 0 HG3 LYS A 87 16.805 1.059 -13.181 1.00 0.00 H new ATOM 0 HD2 LYS A 87 17.104 2.164 -15.570 1.00 0.00 H new ATOM 0 HD3 LYS A 87 16.198 0.770 -16.124 1.00 0.00 H new ATOM 0 HE2 LYS A 87 15.285 2.706 -13.956 1.00 0.00 H new ATOM 0 HE3 LYS A 87 14.735 2.724 -15.620 1.00 0.00 H new ATOM 0 HZ1 LYS A 87 13.157 1.571 -14.244 1.00 0.00 H new ATOM 0 HZ2 LYS A 87 13.874 0.456 -15.304 1.00 0.00 H new ATOM 0 HZ3 LYS A 87 14.349 0.504 -13.675 1.00 0.00 H new ATOM 1383 N SER A 88 17.682 0.071 -11.302 1.00 0.00 N ATOM 1384 CA SER A 88 17.284 0.685 -10.041 1.00 0.00 C ATOM 1385 C SER A 88 17.995 0.023 -8.865 1.00 0.00 C ATOM 1386 O SER A 88 18.662 0.689 -8.072 1.00 0.00 O ATOM 1387 CB SER A 88 15.769 0.586 -9.857 1.00 0.00 C ATOM 1388 OG SER A 88 15.307 -0.725 -10.129 1.00 0.00 O ATOM 0 H SER A 88 16.985 -0.555 -11.705 1.00 0.00 H new ATOM 0 HA SER A 88 17.571 1.736 -10.071 1.00 0.00 H new ATOM 0 HB2 SER A 88 15.505 0.864 -8.837 1.00 0.00 H new ATOM 0 HB3 SER A 88 15.272 1.295 -10.519 1.00 0.00 H new ATOM 0 HG SER A 88 14.501 -0.679 -10.685 1.00 0.00 H new ATOM 1394 N TYR A 89 17.848 -1.293 -8.758 1.00 0.00 N ATOM 1395 CA TYR A 89 18.473 -2.047 -7.678 1.00 0.00 C ATOM 1396 C TYR A 89 19.946 -1.675 -7.535 1.00 0.00 C ATOM 1397 O TYR A 89 20.401 -1.300 -6.455 1.00 0.00 O ATOM 1398 CB TYR A 89 18.338 -3.550 -7.932 1.00 0.00 C ATOM 1399 CG TYR A 89 18.501 -4.392 -6.687 1.00 0.00 C ATOM 1400 CD1 TYR A 89 17.608 -4.280 -5.628 1.00 0.00 C ATOM 1401 CD2 TYR A 89 19.548 -5.297 -6.569 1.00 0.00 C ATOM 1402 CE1 TYR A 89 17.753 -5.047 -4.488 1.00 0.00 C ATOM 1403 CE2 TYR A 89 19.700 -6.069 -5.433 1.00 0.00 C ATOM 1404 CZ TYR A 89 18.800 -5.940 -4.395 1.00 0.00 C ATOM 1405 OH TYR A 89 18.949 -6.706 -3.262 1.00 0.00 O ATOM 0 H TYR A 89 17.301 -1.860 -9.406 1.00 0.00 H new ATOM 0 HA TYR A 89 17.961 -1.794 -6.750 1.00 0.00 H new ATOM 0 HB2 TYR A 89 17.360 -3.749 -8.370 1.00 0.00 H new ATOM 0 HB3 TYR A 89 19.084 -3.854 -8.666 1.00 0.00 H new ATOM 0 HD1 TYR A 89 16.787 -3.582 -5.697 1.00 0.00 H new ATOM 0 HD2 TYR A 89 20.255 -5.399 -7.379 1.00 0.00 H new ATOM 0 HE1 TYR A 89 17.050 -4.948 -3.674 1.00 0.00 H new ATOM 0 HE2 TYR A 89 20.519 -6.769 -5.358 1.00 0.00 H new ATOM 0 HH TYR A 89 19.735 -7.283 -3.358 1.00 0.00 H new ATOM 1415 N ASP A 90 20.685 -1.781 -8.634 1.00 0.00 N ATOM 1416 CA ASP A 90 22.106 -1.454 -8.633 1.00 0.00 C ATOM 1417 C ASP A 90 22.345 -0.067 -8.043 1.00 0.00 C ATOM 1418 O ASP A 90 23.279 0.137 -7.268 1.00 0.00 O ATOM 1419 CB ASP A 90 22.667 -1.520 -10.055 1.00 0.00 C ATOM 1420 CG ASP A 90 24.155 -1.810 -10.077 1.00 0.00 C ATOM 1421 OD1 ASP A 90 24.549 -2.919 -9.659 1.00 0.00 O ATOM 1422 OD2 ASP A 90 24.925 -0.929 -10.513 1.00 0.00 O ATOM 0 H ASP A 90 20.324 -2.091 -9.536 1.00 0.00 H new ATOM 0 HA ASP A 90 22.622 -2.187 -8.012 1.00 0.00 H new ATOM 0 HB2 ASP A 90 22.141 -2.293 -10.615 1.00 0.00 H new ATOM 0 HB3 ASP A 90 22.477 -0.574 -10.562 1.00 0.00 H new ATOM 1427 N LYS A 91 21.494 0.883 -8.416 1.00 0.00 N ATOM 1428 CA LYS A 91 21.611 2.251 -7.924 1.00 0.00 C ATOM 1429 C LYS A 91 21.378 2.309 -6.418 1.00 0.00 C ATOM 1430 O LYS A 91 22.239 2.761 -5.662 1.00 0.00 O ATOM 1431 CB LYS A 91 20.610 3.159 -8.641 1.00 0.00 C ATOM 1432 CG LYS A 91 20.600 4.585 -8.118 1.00 0.00 C ATOM 1433 CD LYS A 91 21.848 5.342 -8.538 1.00 0.00 C ATOM 1434 CE LYS A 91 21.757 5.809 -9.983 1.00 0.00 C ATOM 1435 NZ LYS A 91 22.883 6.715 -10.345 1.00 0.00 N ATOM 0 H LYS A 91 20.716 0.731 -9.057 1.00 0.00 H new ATOM 0 HA LYS A 91 22.623 2.600 -8.131 1.00 0.00 H new ATOM 0 HB2 LYS A 91 20.843 3.173 -9.706 1.00 0.00 H new ATOM 0 HB3 LYS A 91 19.611 2.736 -8.539 1.00 0.00 H new ATOM 0 HG2 LYS A 91 19.716 5.104 -8.490 1.00 0.00 H new ATOM 0 HG3 LYS A 91 20.529 4.574 -7.030 1.00 0.00 H new ATOM 0 HD2 LYS A 91 21.990 6.203 -7.885 1.00 0.00 H new ATOM 0 HD3 LYS A 91 22.722 4.702 -8.416 1.00 0.00 H new ATOM 0 HE2 LYS A 91 21.760 4.943 -10.645 1.00 0.00 H new ATOM 0 HE3 LYS A 91 20.810 6.326 -10.139 1.00 0.00 H new ATOM 0 HZ1 LYS A 91 22.785 7.011 -11.337 1.00 0.00 H new ATOM 0 HZ2 LYS A 91 22.865 7.553 -9.730 1.00 0.00 H new ATOM 0 HZ3 LYS A 91 23.786 6.214 -10.221 1.00 0.00 H new ATOM 1449 N THR A 92 20.209 1.847 -5.986 1.00 0.00 N ATOM 1450 CA THR A 92 19.863 1.847 -4.570 1.00 0.00 C ATOM 1451 C THR A 92 20.933 1.143 -3.743 1.00 0.00 C ATOM 1452 O THR A 92 21.558 1.749 -2.872 1.00 0.00 O ATOM 1453 CB THR A 92 18.506 1.160 -4.323 1.00 0.00 C ATOM 1454 OG1 THR A 92 17.488 1.792 -5.108 1.00 0.00 O ATOM 1455 CG2 THR A 92 18.129 1.221 -2.851 1.00 0.00 C ATOM 0 H THR A 92 19.485 1.468 -6.597 1.00 0.00 H new ATOM 0 HA THR A 92 19.796 2.890 -4.261 1.00 0.00 H new ATOM 0 HB THR A 92 18.594 0.114 -4.616 1.00 0.00 H new ATOM 0 HG1 THR A 92 16.886 1.110 -5.473 1.00 0.00 H new ATOM 0 HG21 THR A 92 17.168 0.730 -2.701 1.00 0.00 H new ATOM 0 HG22 THR A 92 18.891 0.715 -2.259 1.00 0.00 H new ATOM 0 HG23 THR A 92 18.057 2.262 -2.537 1.00 0.00 H new ATOM 1463 N THR A 93 21.140 -0.140 -4.020 1.00 0.00 N ATOM 1464 CA THR A 93 22.135 -0.926 -3.302 1.00 0.00 C ATOM 1465 C THR A 93 23.394 -0.109 -3.035 1.00 0.00 C ATOM 1466 O THR A 93 23.946 -0.142 -1.935 1.00 0.00 O ATOM 1467 CB THR A 93 22.518 -2.198 -4.083 1.00 0.00 C ATOM 1468 OG1 THR A 93 21.341 -2.825 -4.604 1.00 0.00 O ATOM 1469 CG2 THR A 93 23.267 -3.176 -3.191 1.00 0.00 C ATOM 0 H THR A 93 20.631 -0.657 -4.737 1.00 0.00 H new ATOM 0 HA THR A 93 21.684 -1.214 -2.352 1.00 0.00 H new ATOM 0 HB THR A 93 23.171 -1.909 -4.907 1.00 0.00 H new ATOM 0 HG1 THR A 93 21.177 -2.506 -5.516 1.00 0.00 H new ATOM 0 HG21 THR A 93 23.527 -4.066 -3.764 1.00 0.00 H new ATOM 0 HG22 THR A 93 24.177 -2.706 -2.819 1.00 0.00 H new ATOM 0 HG23 THR A 93 22.635 -3.458 -2.349 1.00 0.00 H new ATOM 1477 N HIS A 94 23.844 0.624 -4.049 1.00 0.00 N ATOM 1478 CA HIS A 94 25.038 1.452 -3.923 1.00 0.00 C ATOM 1479 C HIS A 94 24.776 2.649 -3.015 1.00 0.00 C ATOM 1480 O HIS A 94 25.543 2.920 -2.092 1.00 0.00 O ATOM 1481 CB HIS A 94 25.499 1.932 -5.299 1.00 0.00 C ATOM 1482 CG HIS A 94 26.592 2.954 -5.242 1.00 0.00 C ATOM 1483 ND1 HIS A 94 27.859 2.676 -4.774 1.00 0.00 N ATOM 1484 CD2 HIS A 94 26.602 4.260 -5.599 1.00 0.00 C ATOM 1485 CE1 HIS A 94 28.601 3.767 -4.844 1.00 0.00 C ATOM 1486 NE2 HIS A 94 27.862 4.742 -5.342 1.00 0.00 N ATOM 0 H HIS A 94 23.400 0.661 -4.966 1.00 0.00 H new ATOM 0 HA HIS A 94 25.825 0.845 -3.476 1.00 0.00 H new ATOM 0 HB2 HIS A 94 25.844 1.075 -5.877 1.00 0.00 H new ATOM 0 HB3 HIS A 94 24.647 2.353 -5.832 1.00 0.00 H new ATOM 0 HD2 HIS A 94 25.774 4.818 -6.009 1.00 0.00 H new ATOM 0 HE1 HIS A 94 29.636 3.848 -4.545 1.00 0.00 H new ATOM 0 HE2 HIS A 94 28.176 5.698 -5.509 1.00 0.00 H new ATOM 1494 N ASN A 95 23.687 3.363 -3.284 1.00 0.00 N ATOM 1495 CA ASN A 95 23.325 4.532 -2.492 1.00 0.00 C ATOM 1496 C ASN A 95 23.280 4.190 -1.006 1.00 0.00 C ATOM 1497 O ASN A 95 23.836 4.908 -0.175 1.00 0.00 O ATOM 1498 CB ASN A 95 21.969 5.079 -2.942 1.00 0.00 C ATOM 1499 CG ASN A 95 22.073 5.915 -4.203 1.00 0.00 C ATOM 1500 OD1 ASN A 95 23.071 6.600 -4.427 1.00 0.00 O ATOM 1501 ND2 ASN A 95 21.038 5.864 -5.033 1.00 0.00 N ATOM 0 H ASN A 95 23.041 3.152 -4.044 1.00 0.00 H new ATOM 0 HA ASN A 95 24.087 5.295 -2.648 1.00 0.00 H new ATOM 0 HB2 ASN A 95 21.285 4.249 -3.115 1.00 0.00 H new ATOM 0 HB3 ASN A 95 21.541 5.684 -2.143 1.00 0.00 H new ATOM 0 HD21 ASN A 95 21.050 6.406 -5.897 1.00 0.00 H new ATOM 0 HD22 ASN A 95 20.231 5.282 -4.807 1.00 0.00 H new ATOM 1508 N VAL A 96 22.614 3.087 -0.678 1.00 0.00 N ATOM 1509 CA VAL A 96 22.497 2.648 0.708 1.00 0.00 C ATOM 1510 C VAL A 96 23.791 2.898 1.474 1.00 0.00 C ATOM 1511 O VAL A 96 23.771 3.374 2.610 1.00 0.00 O ATOM 1512 CB VAL A 96 22.142 1.152 0.794 1.00 0.00 C ATOM 1513 CG1 VAL A 96 22.052 0.707 2.246 1.00 0.00 C ATOM 1514 CG2 VAL A 96 20.840 0.870 0.060 1.00 0.00 C ATOM 0 H VAL A 96 22.147 2.481 -1.353 1.00 0.00 H new ATOM 0 HA VAL A 96 21.694 3.231 1.159 1.00 0.00 H new ATOM 0 HB VAL A 96 22.935 0.580 0.312 1.00 0.00 H new ATOM 0 HG11 VAL A 96 21.800 -0.353 2.287 1.00 0.00 H new ATOM 0 HG12 VAL A 96 23.011 0.871 2.737 1.00 0.00 H new ATOM 0 HG13 VAL A 96 21.280 1.283 2.756 1.00 0.00 H new ATOM 0 HG21 VAL A 96 20.605 -0.192 0.131 1.00 0.00 H new ATOM 0 HG22 VAL A 96 20.035 1.451 0.510 1.00 0.00 H new ATOM 0 HG23 VAL A 96 20.946 1.149 -0.988 1.00 0.00 H new ATOM 1524 N LYS A 97 24.916 2.574 0.846 1.00 0.00 N ATOM 1525 CA LYS A 97 26.221 2.764 1.467 1.00 0.00 C ATOM 1526 C LYS A 97 26.242 4.033 2.313 1.00 0.00 C ATOM 1527 O LYS A 97 26.750 4.034 3.434 1.00 0.00 O ATOM 1528 CB LYS A 97 27.313 2.834 0.397 1.00 0.00 C ATOM 1529 CG LYS A 97 27.401 1.587 -0.465 1.00 0.00 C ATOM 1530 CD LYS A 97 28.343 0.558 0.138 1.00 0.00 C ATOM 1531 CE LYS A 97 28.183 -0.801 -0.526 1.00 0.00 C ATOM 1532 NZ LYS A 97 29.319 -1.710 -0.210 1.00 0.00 N ATOM 0 H LYS A 97 24.950 2.178 -0.093 1.00 0.00 H new ATOM 0 HA LYS A 97 26.413 1.911 2.118 1.00 0.00 H new ATOM 0 HB2 LYS A 97 27.127 3.696 -0.244 1.00 0.00 H new ATOM 0 HB3 LYS A 97 28.275 2.999 0.882 1.00 0.00 H new ATOM 0 HG2 LYS A 97 26.408 1.151 -0.578 1.00 0.00 H new ATOM 0 HG3 LYS A 97 27.746 1.857 -1.463 1.00 0.00 H new ATOM 0 HD2 LYS A 97 29.373 0.898 0.029 1.00 0.00 H new ATOM 0 HD3 LYS A 97 28.148 0.467 1.207 1.00 0.00 H new ATOM 0 HE2 LYS A 97 27.250 -1.258 -0.197 1.00 0.00 H new ATOM 0 HE3 LYS A 97 28.111 -0.671 -1.606 1.00 0.00 H new ATOM 0 HZ1 LYS A 97 29.172 -2.626 -0.681 1.00 0.00 H new ATOM 0 HZ2 LYS A 97 30.207 -1.286 -0.546 1.00 0.00 H new ATOM 0 HZ3 LYS A 97 29.372 -1.855 0.819 1.00 0.00 H new ATOM 1546 N GLU A 98 25.684 5.111 1.769 1.00 0.00 N ATOM 1547 CA GLU A 98 25.639 6.385 2.476 1.00 0.00 C ATOM 1548 C GLU A 98 24.249 6.638 3.054 1.00 0.00 C ATOM 1549 O GLU A 98 23.262 6.766 2.329 1.00 0.00 O ATOM 1550 CB GLU A 98 26.029 7.528 1.537 1.00 0.00 C ATOM 1551 CG GLU A 98 25.217 7.564 0.253 1.00 0.00 C ATOM 1552 CD GLU A 98 25.558 8.757 -0.619 1.00 0.00 C ATOM 1553 OE1 GLU A 98 25.115 9.878 -0.292 1.00 0.00 O ATOM 1554 OE2 GLU A 98 26.268 8.570 -1.629 1.00 0.00 O ATOM 0 H GLU A 98 25.258 5.127 0.842 1.00 0.00 H new ATOM 0 HA GLU A 98 26.353 6.341 3.299 1.00 0.00 H new ATOM 0 HB2 GLU A 98 25.906 8.476 2.061 1.00 0.00 H new ATOM 0 HB3 GLU A 98 27.086 7.437 1.286 1.00 0.00 H new ATOM 0 HG2 GLU A 98 25.391 6.646 -0.309 1.00 0.00 H new ATOM 0 HG3 GLU A 98 24.156 7.590 0.499 1.00 0.00 H new ATOM 1561 N PRO A 99 24.169 6.711 4.390 1.00 0.00 N ATOM 1562 CA PRO A 99 22.906 6.949 5.095 1.00 0.00 C ATOM 1563 C PRO A 99 22.384 8.367 4.889 1.00 0.00 C ATOM 1564 O PRO A 99 22.990 9.334 5.346 1.00 0.00 O ATOM 1565 CB PRO A 99 23.272 6.723 6.565 1.00 0.00 C ATOM 1566 CG PRO A 99 24.733 7.002 6.638 1.00 0.00 C ATOM 1567 CD PRO A 99 25.304 6.568 5.316 1.00 0.00 C ATOM 0 HA PRO A 99 22.110 6.298 4.734 1.00 0.00 H new ATOM 0 HB2 PRO A 99 22.709 7.388 7.220 1.00 0.00 H new ATOM 0 HB3 PRO A 99 23.048 5.703 6.877 1.00 0.00 H new ATOM 0 HG2 PRO A 99 24.920 8.061 6.815 1.00 0.00 H new ATOM 0 HG3 PRO A 99 25.194 6.455 7.461 1.00 0.00 H new ATOM 0 HD2 PRO A 99 26.147 7.192 5.018 1.00 0.00 H new ATOM 0 HD3 PRO A 99 25.666 5.540 5.353 1.00 0.00 H new ATOM 1575 N GLY A 100 21.255 8.482 4.196 1.00 0.00 N ATOM 1576 CA GLY A 100 20.671 9.786 3.941 1.00 0.00 C ATOM 1577 C GLY A 100 19.157 9.766 4.007 1.00 0.00 C ATOM 1578 O GLY A 100 18.564 8.813 4.513 1.00 0.00 O ATOM 0 H GLY A 100 20.735 7.696 3.807 1.00 0.00 H new ATOM 0 HA2 GLY A 100 21.054 10.501 4.669 1.00 0.00 H new ATOM 0 HA3 GLY A 100 20.984 10.135 2.957 1.00 0.00 H new ATOM 1582 N ARG A 101 18.530 10.821 3.497 1.00 0.00 N ATOM 1583 CA ARG A 101 17.076 10.922 3.503 1.00 0.00 C ATOM 1584 C ARG A 101 16.495 10.496 2.157 1.00 0.00 C ATOM 1585 O ARG A 101 15.615 9.638 2.093 1.00 0.00 O ATOM 1586 CB ARG A 101 16.644 12.353 3.826 1.00 0.00 C ATOM 1587 CG ARG A 101 16.858 12.740 5.281 1.00 0.00 C ATOM 1588 CD ARG A 101 16.875 14.250 5.459 1.00 0.00 C ATOM 1589 NE ARG A 101 17.543 14.648 6.695 1.00 0.00 N ATOM 1590 CZ ARG A 101 18.813 15.034 6.753 1.00 0.00 C ATOM 1591 NH1 ARG A 101 19.547 15.075 5.650 1.00 0.00 N ATOM 1592 NH2 ARG A 101 19.349 15.381 7.916 1.00 0.00 N ATOM 0 H ARG A 101 19.006 11.618 3.074 1.00 0.00 H new ATOM 0 HA ARG A 101 16.694 10.252 4.273 1.00 0.00 H new ATOM 0 HB2 ARG A 101 17.198 13.043 3.190 1.00 0.00 H new ATOM 0 HB3 ARG A 101 15.589 12.469 3.579 1.00 0.00 H new ATOM 0 HG2 ARG A 101 16.066 12.309 5.893 1.00 0.00 H new ATOM 0 HG3 ARG A 101 17.799 12.320 5.636 1.00 0.00 H new ATOM 0 HD2 ARG A 101 17.381 14.709 4.610 1.00 0.00 H new ATOM 0 HD3 ARG A 101 15.852 14.626 5.463 1.00 0.00 H new ATOM 0 HE ARG A 101 17.005 14.629 7.561 1.00 0.00 H new ATOM 0 HH11 ARG A 101 19.137 14.810 4.754 1.00 0.00 H new ATOM 0 HH12 ARG A 101 20.522 15.372 5.697 1.00 0.00 H new ATOM 0 HH21 ARG A 101 18.786 15.351 8.766 1.00 0.00 H new ATOM 0 HH22 ARG A 101 20.324 15.677 7.960 1.00 0.00 H new ATOM 1606 N TYR A 102 16.994 11.102 1.086 1.00 0.00 N ATOM 1607 CA TYR A 102 16.523 10.788 -0.258 1.00 0.00 C ATOM 1608 C TYR A 102 17.317 9.632 -0.858 1.00 0.00 C ATOM 1609 O TYR A 102 17.309 9.419 -2.071 1.00 0.00 O ATOM 1610 CB TYR A 102 16.633 12.019 -1.160 1.00 0.00 C ATOM 1611 CG TYR A 102 16.086 13.281 -0.532 1.00 0.00 C ATOM 1612 CD1 TYR A 102 14.782 13.336 -0.057 1.00 0.00 C ATOM 1613 CD2 TYR A 102 16.875 14.419 -0.413 1.00 0.00 C ATOM 1614 CE1 TYR A 102 14.278 14.487 0.517 1.00 0.00 C ATOM 1615 CE2 TYR A 102 16.380 15.574 0.161 1.00 0.00 C ATOM 1616 CZ TYR A 102 15.081 15.603 0.624 1.00 0.00 C ATOM 1617 OH TYR A 102 14.584 16.751 1.196 1.00 0.00 O ATOM 0 H TYR A 102 17.724 11.813 1.122 1.00 0.00 H new ATOM 0 HA TYR A 102 15.477 10.489 -0.188 1.00 0.00 H new ATOM 0 HB2 TYR A 102 17.680 12.177 -1.419 1.00 0.00 H new ATOM 0 HB3 TYR A 102 16.100 11.826 -2.091 1.00 0.00 H new ATOM 0 HD1 TYR A 102 14.151 12.463 -0.138 1.00 0.00 H new ATOM 0 HD2 TYR A 102 17.892 14.400 -0.775 1.00 0.00 H new ATOM 0 HE1 TYR A 102 13.261 14.513 0.880 1.00 0.00 H new ATOM 0 HE2 TYR A 102 17.007 16.449 0.247 1.00 0.00 H new ATOM 0 HH TYR A 102 15.278 17.443 1.196 1.00 0.00 H new ATOM 1627 N THR A 103 18.004 8.886 0.002 1.00 0.00 N ATOM 1628 CA THR A 103 18.804 7.751 -0.440 1.00 0.00 C ATOM 1629 C THR A 103 17.969 6.776 -1.263 1.00 0.00 C ATOM 1630 O THR A 103 18.376 6.355 -2.345 1.00 0.00 O ATOM 1631 CB THR A 103 19.421 6.999 0.755 1.00 0.00 C ATOM 1632 OG1 THR A 103 20.266 7.879 1.504 1.00 0.00 O ATOM 1633 CG2 THR A 103 20.225 5.797 0.281 1.00 0.00 C ATOM 0 H THR A 103 18.022 9.048 1.009 1.00 0.00 H new ATOM 0 HA THR A 103 19.605 8.152 -1.061 1.00 0.00 H new ATOM 0 HB THR A 103 18.610 6.646 1.392 1.00 0.00 H new ATOM 0 HG1 THR A 103 21.132 7.448 1.659 1.00 0.00 H new ATOM 0 HG21 THR A 103 20.651 5.282 1.142 1.00 0.00 H new ATOM 0 HG22 THR A 103 19.572 5.115 -0.264 1.00 0.00 H new ATOM 0 HG23 THR A 103 21.028 6.132 -0.375 1.00 0.00 H new ATOM 1641 N PHE A 104 16.799 6.421 -0.742 1.00 0.00 N ATOM 1642 CA PHE A 104 15.906 5.495 -1.429 1.00 0.00 C ATOM 1643 C PHE A 104 14.884 6.251 -2.274 1.00 0.00 C ATOM 1644 O PHE A 104 13.868 5.691 -2.683 1.00 0.00 O ATOM 1645 CB PHE A 104 15.187 4.601 -0.417 1.00 0.00 C ATOM 1646 CG PHE A 104 16.120 3.867 0.503 1.00 0.00 C ATOM 1647 CD1 PHE A 104 16.725 2.687 0.101 1.00 0.00 C ATOM 1648 CD2 PHE A 104 16.392 4.356 1.770 1.00 0.00 C ATOM 1649 CE1 PHE A 104 17.584 2.009 0.945 1.00 0.00 C ATOM 1650 CE2 PHE A 104 17.251 3.683 2.618 1.00 0.00 C ATOM 1651 CZ PHE A 104 17.847 2.507 2.206 1.00 0.00 C ATOM 0 H PHE A 104 16.447 6.760 0.153 1.00 0.00 H new ATOM 0 HA PHE A 104 16.508 4.872 -2.090 1.00 0.00 H new ATOM 0 HB2 PHE A 104 14.509 5.212 0.178 1.00 0.00 H new ATOM 0 HB3 PHE A 104 14.575 3.877 -0.954 1.00 0.00 H new ATOM 0 HD1 PHE A 104 16.523 2.292 -0.884 1.00 0.00 H new ATOM 0 HD2 PHE A 104 15.927 5.274 2.099 1.00 0.00 H new ATOM 0 HE1 PHE A 104 18.049 1.091 0.619 1.00 0.00 H new ATOM 0 HE2 PHE A 104 17.456 4.076 3.603 1.00 0.00 H new ATOM 0 HZ PHE A 104 18.517 1.978 2.868 1.00 0.00 H new ATOM 1661 N GLU A 105 15.162 7.526 -2.529 1.00 0.00 N ATOM 1662 CA GLU A 105 14.266 8.358 -3.323 1.00 0.00 C ATOM 1663 C GLU A 105 13.984 7.715 -4.678 1.00 0.00 C ATOM 1664 O GLU A 105 12.831 7.599 -5.094 1.00 0.00 O ATOM 1665 CB GLU A 105 14.870 9.750 -3.522 1.00 0.00 C ATOM 1666 CG GLU A 105 13.879 10.773 -4.051 1.00 0.00 C ATOM 1667 CD GLU A 105 14.559 11.944 -4.735 1.00 0.00 C ATOM 1668 OE1 GLU A 105 15.489 12.523 -4.136 1.00 0.00 O ATOM 1669 OE2 GLU A 105 14.160 12.279 -5.870 1.00 0.00 O ATOM 0 H GLU A 105 16.000 8.004 -2.198 1.00 0.00 H new ATOM 0 HA GLU A 105 13.324 8.452 -2.782 1.00 0.00 H new ATOM 0 HB2 GLU A 105 15.271 10.102 -2.572 1.00 0.00 H new ATOM 0 HB3 GLU A 105 15.709 9.677 -4.214 1.00 0.00 H new ATOM 0 HG2 GLU A 105 13.203 10.288 -4.755 1.00 0.00 H new ATOM 0 HG3 GLU A 105 13.269 11.143 -3.227 1.00 0.00 H new ATOM 1676 N ASP A 106 15.045 7.300 -5.361 1.00 0.00 N ATOM 1677 CA ASP A 106 14.913 6.668 -6.669 1.00 0.00 C ATOM 1678 C ASP A 106 13.970 5.471 -6.601 1.00 0.00 C ATOM 1679 O ASP A 106 12.943 5.438 -7.278 1.00 0.00 O ATOM 1680 CB ASP A 106 16.283 6.226 -7.186 1.00 0.00 C ATOM 1681 CG ASP A 106 17.218 7.396 -7.420 1.00 0.00 C ATOM 1682 OD1 ASP A 106 17.327 8.258 -6.523 1.00 0.00 O ATOM 1683 OD2 ASP A 106 17.842 7.450 -8.500 1.00 0.00 O ATOM 0 H ASP A 106 16.006 7.390 -5.031 1.00 0.00 H new ATOM 0 HA ASP A 106 14.492 7.400 -7.359 1.00 0.00 H new ATOM 0 HB2 ASP A 106 16.735 5.541 -6.469 1.00 0.00 H new ATOM 0 HB3 ASP A 106 16.156 5.674 -8.117 1.00 0.00 H new ATOM 1688 N ALA A 107 14.328 4.488 -5.781 1.00 0.00 N ATOM 1689 CA ALA A 107 13.514 3.289 -5.624 1.00 0.00 C ATOM 1690 C ALA A 107 12.055 3.647 -5.360 1.00 0.00 C ATOM 1691 O ALA A 107 11.147 3.048 -5.935 1.00 0.00 O ATOM 1692 CB ALA A 107 14.060 2.424 -4.497 1.00 0.00 C ATOM 0 H ALA A 107 15.177 4.499 -5.215 1.00 0.00 H new ATOM 0 HA ALA A 107 13.559 2.724 -6.555 1.00 0.00 H new ATOM 0 HB1 ALA A 107 13.442 1.532 -4.391 1.00 0.00 H new ATOM 0 HB2 ALA A 107 15.084 2.131 -4.727 1.00 0.00 H new ATOM 0 HB3 ALA A 107 14.045 2.989 -3.565 1.00 0.00 H new ATOM 1698 N GLN A 108 11.839 4.625 -4.486 1.00 0.00 N ATOM 1699 CA GLN A 108 10.490 5.060 -4.145 1.00 0.00 C ATOM 1700 C GLN A 108 9.689 5.384 -5.402 1.00 0.00 C ATOM 1701 O GLN A 108 8.487 5.129 -5.466 1.00 0.00 O ATOM 1702 CB GLN A 108 10.542 6.284 -3.230 1.00 0.00 C ATOM 1703 CG GLN A 108 9.181 6.710 -2.705 1.00 0.00 C ATOM 1704 CD GLN A 108 9.263 7.894 -1.761 1.00 0.00 C ATOM 1705 OE1 GLN A 108 8.786 7.709 -0.536 1.00 0.00 O flip ATOM 1706 NE2 GLN A 108 9.749 8.963 -2.130 1.00 0.00 N flip ATOM 0 H GLN A 108 12.581 5.131 -4.002 1.00 0.00 H new ATOM 0 HA GLN A 108 9.994 4.244 -3.620 1.00 0.00 H new ATOM 0 HB2 GLN A 108 11.196 6.068 -2.386 1.00 0.00 H new ATOM 0 HB3 GLN A 108 10.988 7.116 -3.775 1.00 0.00 H new ATOM 0 HG2 GLN A 108 8.535 6.965 -3.545 1.00 0.00 H new ATOM 0 HG3 GLN A 108 8.716 5.870 -2.189 1.00 0.00 H new ATOM 0 HE21 GLN A 108 10.104 9.061 -3.081 1.00 0.00 H new ATOM 0 HE22 GLN A 108 9.797 9.751 -1.484 1.00 0.00 H new ATOM 1715 N GLU A 109 10.364 5.948 -6.399 1.00 0.00 N ATOM 1716 CA GLU A 109 9.713 6.308 -7.654 1.00 0.00 C ATOM 1717 C GLU A 109 9.393 5.063 -8.477 1.00 0.00 C ATOM 1718 O GLU A 109 8.307 4.943 -9.045 1.00 0.00 O ATOM 1719 CB GLU A 109 10.604 7.253 -8.463 1.00 0.00 C ATOM 1720 CG GLU A 109 10.268 7.285 -9.945 1.00 0.00 C ATOM 1721 CD GLU A 109 11.199 8.186 -10.734 1.00 0.00 C ATOM 1722 OE1 GLU A 109 11.510 9.292 -10.243 1.00 0.00 O ATOM 1723 OE2 GLU A 109 11.615 7.786 -11.841 1.00 0.00 O ATOM 0 H GLU A 109 11.360 6.165 -6.362 1.00 0.00 H new ATOM 0 HA GLU A 109 8.778 6.816 -7.417 1.00 0.00 H new ATOM 0 HB2 GLU A 109 10.514 8.260 -8.057 1.00 0.00 H new ATOM 0 HB3 GLU A 109 11.644 6.952 -8.341 1.00 0.00 H new ATOM 0 HG2 GLU A 109 10.320 6.273 -10.348 1.00 0.00 H new ATOM 0 HG3 GLU A 109 9.241 7.627 -10.074 1.00 0.00 H new ATOM 1730 N HIS A 110 10.347 4.139 -8.538 1.00 0.00 N ATOM 1731 CA HIS A 110 10.168 2.904 -9.291 1.00 0.00 C ATOM 1732 C HIS A 110 8.904 2.174 -8.845 1.00 0.00 C ATOM 1733 O HIS A 110 8.014 1.906 -9.652 1.00 0.00 O ATOM 1734 CB HIS A 110 11.384 1.994 -9.117 1.00 0.00 C ATOM 1735 CG HIS A 110 11.421 0.851 -10.084 1.00 0.00 C ATOM 1736 ND1 HIS A 110 11.852 0.981 -11.387 1.00 0.00 N ATOM 1737 CD2 HIS A 110 11.079 -0.450 -9.931 1.00 0.00 C ATOM 1738 CE1 HIS A 110 11.772 -0.189 -11.995 1.00 0.00 C ATOM 1739 NE2 HIS A 110 11.306 -1.075 -11.132 1.00 0.00 N ATOM 0 H HIS A 110 11.252 4.223 -8.075 1.00 0.00 H new ATOM 0 HA HIS A 110 10.065 3.162 -10.345 1.00 0.00 H new ATOM 0 HB2 HIS A 110 12.291 2.587 -9.234 1.00 0.00 H new ATOM 0 HB3 HIS A 110 11.390 1.600 -8.101 1.00 0.00 H new ATOM 0 HD2 HIS A 110 10.698 -0.911 -9.031 1.00 0.00 H new ATOM 0 HE1 HIS A 110 12.041 -0.388 -13.022 1.00 0.00 H new ATOM 0 HE2 HIS A 110 11.142 -2.063 -11.327 1.00 0.00 H new ATOM 1747 N ILE A 111 8.834 1.855 -7.557 1.00 0.00 N ATOM 1748 CA ILE A 111 7.680 1.157 -7.005 1.00 0.00 C ATOM 1749 C ILE A 111 6.396 1.946 -7.241 1.00 0.00 C ATOM 1750 O ILE A 111 5.360 1.377 -7.584 1.00 0.00 O ATOM 1751 CB ILE A 111 7.844 0.904 -5.495 1.00 0.00 C ATOM 1752 CG1 ILE A 111 9.075 0.034 -5.232 1.00 0.00 C ATOM 1753 CG2 ILE A 111 6.594 0.248 -4.929 1.00 0.00 C ATOM 1754 CD1 ILE A 111 8.961 -1.362 -5.805 1.00 0.00 C ATOM 0 H ILE A 111 9.563 2.069 -6.876 1.00 0.00 H new ATOM 0 HA ILE A 111 7.615 0.199 -7.520 1.00 0.00 H new ATOM 0 HB ILE A 111 7.986 1.862 -4.994 1.00 0.00 H new ATOM 0 HG12 ILE A 111 9.952 0.522 -5.657 1.00 0.00 H new ATOM 0 HG13 ILE A 111 9.238 -0.035 -4.156 1.00 0.00 H new ATOM 0 HG21 ILE A 111 6.725 0.076 -3.861 1.00 0.00 H new ATOM 0 HG22 ILE A 111 5.736 0.901 -5.088 1.00 0.00 H new ATOM 0 HG23 ILE A 111 6.423 -0.704 -5.432 1.00 0.00 H new ATOM 0 HD11 ILE A 111 9.869 -1.922 -5.581 1.00 0.00 H new ATOM 0 HD12 ILE A 111 8.103 -1.868 -5.362 1.00 0.00 H new ATOM 0 HD13 ILE A 111 8.829 -1.302 -6.885 1.00 0.00 H new ATOM 1766 N TYR A 112 6.473 3.259 -7.056 1.00 0.00 N ATOM 1767 CA TYR A 112 5.317 4.127 -7.248 1.00 0.00 C ATOM 1768 C TYR A 112 4.712 3.930 -8.635 1.00 0.00 C ATOM 1769 O TYR A 112 3.542 3.571 -8.770 1.00 0.00 O ATOM 1770 CB TYR A 112 5.715 5.591 -7.056 1.00 0.00 C ATOM 1771 CG TYR A 112 4.627 6.569 -7.437 1.00 0.00 C ATOM 1772 CD1 TYR A 112 4.362 6.860 -8.769 1.00 0.00 C ATOM 1773 CD2 TYR A 112 3.863 7.202 -6.464 1.00 0.00 C ATOM 1774 CE1 TYR A 112 3.369 7.753 -9.122 1.00 0.00 C ATOM 1775 CE2 TYR A 112 2.867 8.096 -6.807 1.00 0.00 C ATOM 1776 CZ TYR A 112 2.624 8.369 -8.137 1.00 0.00 C ATOM 1777 OH TYR A 112 1.633 9.258 -8.484 1.00 0.00 O ATOM 0 H TYR A 112 7.324 3.746 -6.773 1.00 0.00 H new ATOM 0 HA TYR A 112 4.567 3.861 -6.503 1.00 0.00 H new ATOM 0 HB2 TYR A 112 5.987 5.751 -6.013 1.00 0.00 H new ATOM 0 HB3 TYR A 112 6.604 5.798 -7.652 1.00 0.00 H new ATOM 0 HD1 TYR A 112 4.943 6.380 -9.543 1.00 0.00 H new ATOM 0 HD2 TYR A 112 4.051 6.991 -5.422 1.00 0.00 H new ATOM 0 HE1 TYR A 112 3.177 7.968 -10.163 1.00 0.00 H new ATOM 0 HE2 TYR A 112 2.282 8.578 -6.038 1.00 0.00 H new ATOM 0 HH TYR A 112 1.203 9.602 -7.673 1.00 0.00 H new ATOM 1787 N LYS A 113 5.519 4.167 -9.664 1.00 0.00 N ATOM 1788 CA LYS A 113 5.066 4.015 -11.041 1.00 0.00 C ATOM 1789 C LYS A 113 4.486 2.624 -11.273 1.00 0.00 C ATOM 1790 O LYS A 113 3.773 2.393 -12.251 1.00 0.00 O ATOM 1791 CB LYS A 113 6.225 4.264 -12.010 1.00 0.00 C ATOM 1792 CG LYS A 113 6.851 5.640 -11.869 1.00 0.00 C ATOM 1793 CD LYS A 113 8.126 5.759 -12.687 1.00 0.00 C ATOM 1794 CE LYS A 113 9.167 4.740 -12.249 1.00 0.00 C ATOM 1795 NZ LYS A 113 10.499 5.010 -12.858 1.00 0.00 N ATOM 0 H LYS A 113 6.490 4.465 -9.570 1.00 0.00 H new ATOM 0 HA LYS A 113 4.282 4.751 -11.223 1.00 0.00 H new ATOM 0 HB2 LYS A 113 6.992 3.507 -11.848 1.00 0.00 H new ATOM 0 HB3 LYS A 113 5.866 4.140 -13.032 1.00 0.00 H new ATOM 0 HG2 LYS A 113 6.139 6.400 -12.191 1.00 0.00 H new ATOM 0 HG3 LYS A 113 7.071 5.835 -10.819 1.00 0.00 H new ATOM 0 HD2 LYS A 113 7.897 5.615 -13.743 1.00 0.00 H new ATOM 0 HD3 LYS A 113 8.534 6.765 -12.583 1.00 0.00 H new ATOM 0 HE2 LYS A 113 9.255 4.755 -11.163 1.00 0.00 H new ATOM 0 HE3 LYS A 113 8.836 3.740 -12.529 1.00 0.00 H new ATOM 0 HZ1 LYS A 113 11.163 4.256 -12.589 1.00 0.00 H new ATOM 0 HZ2 LYS A 113 10.408 5.038 -13.894 1.00 0.00 H new ATOM 0 HZ3 LYS A 113 10.858 5.925 -12.517 1.00 0.00 H new ATOM 1809 N LEU A 114 4.794 1.701 -10.368 1.00 0.00 N ATOM 1810 CA LEU A 114 4.300 0.332 -10.473 1.00 0.00 C ATOM 1811 C LEU A 114 2.983 0.169 -9.723 1.00 0.00 C ATOM 1812 O LEU A 114 1.933 -0.040 -10.330 1.00 0.00 O ATOM 1813 CB LEU A 114 5.338 -0.648 -9.924 1.00 0.00 C ATOM 1814 CG LEU A 114 4.821 -2.041 -9.563 1.00 0.00 C ATOM 1815 CD1 LEU A 114 4.933 -2.978 -10.755 1.00 0.00 C ATOM 1816 CD2 LEU A 114 5.582 -2.600 -8.369 1.00 0.00 C ATOM 0 H LEU A 114 5.383 1.876 -9.554 1.00 0.00 H new ATOM 0 HA LEU A 114 4.125 0.115 -11.527 1.00 0.00 H new ATOM 0 HB2 LEU A 114 6.132 -0.757 -10.663 1.00 0.00 H new ATOM 0 HB3 LEU A 114 5.789 -0.208 -9.035 1.00 0.00 H new ATOM 0 HG LEU A 114 3.769 -1.957 -9.291 1.00 0.00 H new ATOM 0 HD11 LEU A 114 4.560 -3.964 -10.479 1.00 0.00 H new ATOM 0 HD12 LEU A 114 4.342 -2.586 -11.583 1.00 0.00 H new ATOM 0 HD13 LEU A 114 5.977 -3.057 -11.059 1.00 0.00 H new ATOM 0 HD21 LEU A 114 5.201 -3.592 -8.126 1.00 0.00 H new ATOM 0 HD22 LEU A 114 6.642 -2.669 -8.613 1.00 0.00 H new ATOM 0 HD23 LEU A 114 5.449 -1.940 -7.512 1.00 0.00 H new ATOM 1828 N MET A 115 3.046 0.268 -8.399 1.00 0.00 N ATOM 1829 CA MET A 115 1.856 0.135 -7.566 1.00 0.00 C ATOM 1830 C MET A 115 0.693 0.932 -8.147 1.00 0.00 C ATOM 1831 O MET A 115 -0.457 0.496 -8.101 1.00 0.00 O ATOM 1832 CB MET A 115 2.151 0.606 -6.140 1.00 0.00 C ATOM 1833 CG MET A 115 3.253 -0.185 -5.455 1.00 0.00 C ATOM 1834 SD MET A 115 3.529 0.340 -3.752 1.00 0.00 S ATOM 1835 CE MET A 115 3.785 2.099 -3.978 1.00 0.00 C ATOM 0 H MET A 115 3.907 0.440 -7.880 1.00 0.00 H new ATOM 0 HA MET A 115 1.575 -0.918 -7.543 1.00 0.00 H new ATOM 0 HB2 MET A 115 2.432 1.659 -6.165 1.00 0.00 H new ATOM 0 HB3 MET A 115 1.240 0.533 -5.546 1.00 0.00 H new ATOM 0 HG2 MET A 115 2.996 -1.244 -5.467 1.00 0.00 H new ATOM 0 HG3 MET A 115 4.179 -0.075 -6.020 1.00 0.00 H new ATOM 0 HE1 MET A 115 4.586 2.437 -3.321 1.00 0.00 H new ATOM 0 HE2 MET A 115 4.058 2.297 -5.015 1.00 0.00 H new ATOM 0 HE3 MET A 115 2.867 2.634 -3.736 1.00 0.00 H new ATOM 1845 N LYS A 116 1.000 2.104 -8.693 1.00 0.00 N ATOM 1846 CA LYS A 116 -0.020 2.963 -9.285 1.00 0.00 C ATOM 1847 C LYS A 116 -0.873 2.187 -10.283 1.00 0.00 C ATOM 1848 O LYS A 116 -2.101 2.256 -10.250 1.00 0.00 O ATOM 1849 CB LYS A 116 0.633 4.161 -9.978 1.00 0.00 C ATOM 1850 CG LYS A 116 1.387 3.794 -11.245 1.00 0.00 C ATOM 1851 CD LYS A 116 1.952 5.025 -11.934 1.00 0.00 C ATOM 1852 CE LYS A 116 0.917 5.685 -12.833 1.00 0.00 C ATOM 1853 NZ LYS A 116 0.566 4.826 -13.998 1.00 0.00 N ATOM 0 H LYS A 116 1.947 2.481 -8.738 1.00 0.00 H new ATOM 0 HA LYS A 116 -0.667 3.322 -8.484 1.00 0.00 H new ATOM 0 HB2 LYS A 116 -0.137 4.893 -10.222 1.00 0.00 H new ATOM 0 HB3 LYS A 116 1.321 4.642 -9.282 1.00 0.00 H new ATOM 0 HG2 LYS A 116 2.198 3.108 -11.001 1.00 0.00 H new ATOM 0 HG3 LYS A 116 0.719 3.268 -11.927 1.00 0.00 H new ATOM 0 HD2 LYS A 116 2.292 5.739 -11.184 1.00 0.00 H new ATOM 0 HD3 LYS A 116 2.823 4.744 -12.526 1.00 0.00 H new ATOM 0 HE2 LYS A 116 0.018 5.899 -12.255 1.00 0.00 H new ATOM 0 HE3 LYS A 116 1.302 6.641 -13.189 1.00 0.00 H new ATOM 0 HZ1 LYS A 116 0.157 5.414 -14.752 1.00 0.00 H new ATOM 0 HZ2 LYS A 116 1.423 4.354 -14.352 1.00 0.00 H new ATOM 0 HZ3 LYS A 116 -0.128 4.109 -13.704 1.00 0.00 H new ATOM 1867 N SER A 117 -0.213 1.448 -11.170 1.00 0.00 N ATOM 1868 CA SER A 117 -0.911 0.661 -12.179 1.00 0.00 C ATOM 1869 C SER A 117 -0.642 -0.829 -11.988 1.00 0.00 C ATOM 1870 O SER A 117 -0.895 -1.636 -12.883 1.00 0.00 O ATOM 1871 CB SER A 117 -0.479 1.092 -13.582 1.00 0.00 C ATOM 1872 OG SER A 117 -1.140 2.283 -13.975 1.00 0.00 O ATOM 0 H SER A 117 0.804 1.378 -11.210 1.00 0.00 H new ATOM 0 HA SER A 117 -1.981 0.838 -12.065 1.00 0.00 H new ATOM 0 HB2 SER A 117 0.600 1.247 -13.602 1.00 0.00 H new ATOM 0 HB3 SER A 117 -0.700 0.297 -14.294 1.00 0.00 H new ATOM 0 HG SER A 117 -0.846 2.539 -14.874 1.00 0.00 H new ATOM 1878 N ASP A 118 -0.129 -1.185 -10.816 1.00 0.00 N ATOM 1879 CA ASP A 118 0.174 -2.577 -10.505 1.00 0.00 C ATOM 1880 C ASP A 118 -0.859 -3.156 -9.543 1.00 0.00 C ATOM 1881 O ASP A 118 -1.544 -4.128 -9.863 1.00 0.00 O ATOM 1882 CB ASP A 118 1.574 -2.695 -9.901 1.00 0.00 C ATOM 1883 CG ASP A 118 1.783 -4.009 -9.174 1.00 0.00 C ATOM 1884 OD1 ASP A 118 1.374 -4.109 -7.999 1.00 0.00 O ATOM 1885 OD2 ASP A 118 2.355 -4.937 -9.782 1.00 0.00 O ATOM 0 H ASP A 118 0.086 -0.529 -10.065 1.00 0.00 H new ATOM 0 HA ASP A 118 0.139 -3.146 -11.434 1.00 0.00 H new ATOM 0 HB2 ASP A 118 2.317 -2.599 -10.693 1.00 0.00 H new ATOM 0 HB3 ASP A 118 1.738 -1.870 -9.208 1.00 0.00 H new ATOM 1890 N SER A 119 -0.964 -2.554 -8.363 1.00 0.00 N ATOM 1891 CA SER A 119 -1.910 -3.012 -7.352 1.00 0.00 C ATOM 1892 C SER A 119 -3.208 -2.215 -7.421 1.00 0.00 C ATOM 1893 O SER A 119 -4.294 -2.784 -7.540 1.00 0.00 O ATOM 1894 CB SER A 119 -1.296 -2.889 -5.956 1.00 0.00 C ATOM 1895 OG SER A 119 -0.562 -4.053 -5.616 1.00 0.00 O ATOM 0 H SER A 119 -0.406 -1.748 -8.083 1.00 0.00 H new ATOM 0 HA SER A 119 -2.137 -4.059 -7.551 1.00 0.00 H new ATOM 0 HB2 SER A 119 -0.641 -2.019 -5.919 1.00 0.00 H new ATOM 0 HB3 SER A 119 -2.085 -2.726 -5.222 1.00 0.00 H new ATOM 0 HG SER A 119 0.131 -4.211 -6.290 1.00 0.00 H new ATOM 1901 N TYR A 120 -3.089 -0.894 -7.346 1.00 0.00 N ATOM 1902 CA TYR A 120 -4.252 -0.017 -7.398 1.00 0.00 C ATOM 1903 C TYR A 120 -5.309 -0.569 -8.350 1.00 0.00 C ATOM 1904 O TYR A 120 -6.492 -0.657 -8.022 1.00 0.00 O ATOM 1905 CB TYR A 120 -3.839 1.388 -7.837 1.00 0.00 C ATOM 1906 CG TYR A 120 -4.939 2.152 -8.538 1.00 0.00 C ATOM 1907 CD1 TYR A 120 -5.167 1.987 -9.899 1.00 0.00 C ATOM 1908 CD2 TYR A 120 -5.750 3.039 -7.841 1.00 0.00 C ATOM 1909 CE1 TYR A 120 -6.171 2.683 -10.545 1.00 0.00 C ATOM 1910 CE2 TYR A 120 -6.757 3.738 -8.478 1.00 0.00 C ATOM 1911 CZ TYR A 120 -6.963 3.557 -9.830 1.00 0.00 C ATOM 1912 OH TYR A 120 -7.964 4.252 -10.469 1.00 0.00 O ATOM 0 H TYR A 120 -2.198 -0.407 -7.249 1.00 0.00 H new ATOM 0 HA TYR A 120 -4.681 0.034 -6.397 1.00 0.00 H new ATOM 0 HB2 TYR A 120 -3.517 1.953 -6.962 1.00 0.00 H new ATOM 0 HB3 TYR A 120 -2.979 1.313 -8.503 1.00 0.00 H new ATOM 0 HD1 TYR A 120 -4.549 1.303 -10.462 1.00 0.00 H new ATOM 0 HD2 TYR A 120 -5.590 3.185 -6.783 1.00 0.00 H new ATOM 0 HE1 TYR A 120 -6.335 2.543 -11.603 1.00 0.00 H new ATOM 0 HE2 TYR A 120 -7.379 4.422 -7.921 1.00 0.00 H new ATOM 0 HH TYR A 120 -8.563 4.649 -9.803 1.00 0.00 H new ATOM 1922 N PRO A 121 -4.872 -0.952 -9.559 1.00 0.00 N ATOM 1923 CA PRO A 121 -5.763 -1.504 -10.584 1.00 0.00 C ATOM 1924 C PRO A 121 -6.674 -2.595 -10.034 1.00 0.00 C ATOM 1925 O PRO A 121 -7.898 -2.457 -10.041 1.00 0.00 O ATOM 1926 CB PRO A 121 -4.796 -2.086 -11.618 1.00 0.00 C ATOM 1927 CG PRO A 121 -3.545 -1.294 -11.455 1.00 0.00 C ATOM 1928 CD PRO A 121 -3.475 -0.876 -10.018 1.00 0.00 C ATOM 0 HA PRO A 121 -6.437 -0.748 -10.988 1.00 0.00 H new ATOM 0 HB2 PRO A 121 -4.619 -3.147 -11.441 1.00 0.00 H new ATOM 0 HB3 PRO A 121 -5.194 -1.994 -12.628 1.00 0.00 H new ATOM 0 HG2 PRO A 121 -2.673 -1.890 -11.726 1.00 0.00 H new ATOM 0 HG3 PRO A 121 -3.552 -0.423 -12.110 1.00 0.00 H new ATOM 0 HD2 PRO A 121 -2.828 -1.537 -9.441 1.00 0.00 H new ATOM 0 HD3 PRO A 121 -3.075 0.132 -9.914 1.00 0.00 H new ATOM 1936 N ARG A 122 -6.071 -3.679 -9.557 1.00 0.00 N ATOM 1937 CA ARG A 122 -6.829 -4.794 -9.003 1.00 0.00 C ATOM 1938 C ARG A 122 -7.705 -4.333 -7.842 1.00 0.00 C ATOM 1939 O ARG A 122 -8.894 -4.647 -7.784 1.00 0.00 O ATOM 1940 CB ARG A 122 -5.882 -5.900 -8.533 1.00 0.00 C ATOM 1941 CG ARG A 122 -5.494 -6.877 -9.632 1.00 0.00 C ATOM 1942 CD ARG A 122 -5.014 -8.200 -9.056 1.00 0.00 C ATOM 1943 NE ARG A 122 -3.586 -8.177 -8.749 1.00 0.00 N ATOM 1944 CZ ARG A 122 -3.019 -8.953 -7.833 1.00 0.00 C ATOM 1945 NH1 ARG A 122 -3.755 -9.810 -7.138 1.00 0.00 N ATOM 1946 NH2 ARG A 122 -1.713 -8.875 -7.610 1.00 0.00 N ATOM 0 H ARG A 122 -5.059 -3.809 -9.543 1.00 0.00 H new ATOM 0 HA ARG A 122 -7.474 -5.187 -9.789 1.00 0.00 H new ATOM 0 HB2 ARG A 122 -4.978 -5.445 -8.127 1.00 0.00 H new ATOM 0 HB3 ARG A 122 -6.355 -6.450 -7.719 1.00 0.00 H new ATOM 0 HG2 ARG A 122 -6.350 -7.052 -10.284 1.00 0.00 H new ATOM 0 HG3 ARG A 122 -4.708 -6.440 -10.248 1.00 0.00 H new ATOM 0 HD2 ARG A 122 -5.576 -8.426 -8.150 1.00 0.00 H new ATOM 0 HD3 ARG A 122 -5.219 -9.001 -9.767 1.00 0.00 H new ATOM 0 HE ARG A 122 -2.992 -7.529 -9.267 1.00 0.00 H new ATOM 0 HH11 ARG A 122 -4.759 -9.874 -7.307 1.00 0.00 H new ATOM 0 HH12 ARG A 122 -3.317 -10.405 -6.435 1.00 0.00 H new ATOM 0 HH21 ARG A 122 -1.143 -8.218 -8.143 1.00 0.00 H new ATOM 0 HH22 ARG A 122 -1.279 -9.472 -6.906 1.00 0.00 H new ATOM 1960 N PHE A 123 -7.109 -3.587 -6.918 1.00 0.00 N ATOM 1961 CA PHE A 123 -7.834 -3.083 -5.757 1.00 0.00 C ATOM 1962 C PHE A 123 -9.230 -2.611 -6.150 1.00 0.00 C ATOM 1963 O PHE A 123 -10.208 -2.883 -5.453 1.00 0.00 O ATOM 1964 CB PHE A 123 -7.060 -1.936 -5.104 1.00 0.00 C ATOM 1965 CG PHE A 123 -7.726 -1.387 -3.875 1.00 0.00 C ATOM 1966 CD1 PHE A 123 -7.999 -2.208 -2.793 1.00 0.00 C ATOM 1967 CD2 PHE A 123 -8.080 -0.049 -3.802 1.00 0.00 C ATOM 1968 CE1 PHE A 123 -8.611 -1.706 -1.660 1.00 0.00 C ATOM 1969 CE2 PHE A 123 -8.692 0.459 -2.671 1.00 0.00 C ATOM 1970 CZ PHE A 123 -8.959 -0.371 -1.600 1.00 0.00 C ATOM 0 H PHE A 123 -6.126 -3.318 -6.950 1.00 0.00 H new ATOM 0 HA PHE A 123 -7.934 -3.898 -5.041 1.00 0.00 H new ATOM 0 HB2 PHE A 123 -6.062 -2.285 -4.841 1.00 0.00 H new ATOM 0 HB3 PHE A 123 -6.936 -1.132 -5.830 1.00 0.00 H new ATOM 0 HD1 PHE A 123 -7.730 -3.253 -2.835 1.00 0.00 H new ATOM 0 HD2 PHE A 123 -7.876 0.604 -4.638 1.00 0.00 H new ATOM 0 HE1 PHE A 123 -8.817 -2.357 -0.823 1.00 0.00 H new ATOM 0 HE2 PHE A 123 -8.961 1.504 -2.625 1.00 0.00 H new ATOM 0 HZ PHE A 123 -9.439 0.023 -0.717 1.00 0.00 H new ATOM 1980 N ILE A 124 -9.315 -1.903 -7.271 1.00 0.00 N ATOM 1981 CA ILE A 124 -10.591 -1.393 -7.758 1.00 0.00 C ATOM 1982 C ILE A 124 -11.513 -2.533 -8.178 1.00 0.00 C ATOM 1983 O ILE A 124 -12.714 -2.503 -7.910 1.00 0.00 O ATOM 1984 CB ILE A 124 -10.398 -0.437 -8.950 1.00 0.00 C ATOM 1985 CG1 ILE A 124 -9.443 0.697 -8.572 1.00 0.00 C ATOM 1986 CG2 ILE A 124 -11.738 0.121 -9.404 1.00 0.00 C ATOM 1987 CD1 ILE A 124 -9.879 1.472 -7.349 1.00 0.00 C ATOM 0 H ILE A 124 -8.515 -1.669 -7.859 1.00 0.00 H new ATOM 0 HA ILE A 124 -11.047 -0.844 -6.934 1.00 0.00 H new ATOM 0 HB ILE A 124 -9.960 -0.995 -9.778 1.00 0.00 H new ATOM 0 HG12 ILE A 124 -8.451 0.282 -8.394 1.00 0.00 H new ATOM 0 HG13 ILE A 124 -9.355 1.383 -9.414 1.00 0.00 H new ATOM 0 HG21 ILE A 124 -11.585 0.795 -10.247 1.00 0.00 H new ATOM 0 HG22 ILE A 124 -12.389 -0.698 -9.708 1.00 0.00 H new ATOM 0 HG23 ILE A 124 -12.202 0.667 -8.583 1.00 0.00 H new ATOM 0 HD11 ILE A 124 -9.155 2.260 -7.140 1.00 0.00 H new ATOM 0 HD12 ILE A 124 -10.857 1.917 -7.530 1.00 0.00 H new ATOM 0 HD13 ILE A 124 -9.939 0.799 -6.494 1.00 0.00 H new ATOM 1999 N ARG A 125 -10.943 -3.536 -8.837 1.00 0.00 N ATOM 2000 CA ARG A 125 -11.713 -4.686 -9.295 1.00 0.00 C ATOM 2001 C ARG A 125 -12.392 -5.387 -8.121 1.00 0.00 C ATOM 2002 O ARG A 125 -13.590 -5.665 -8.160 1.00 0.00 O ATOM 2003 CB ARG A 125 -10.808 -5.670 -10.037 1.00 0.00 C ATOM 2004 CG ARG A 125 -10.012 -5.035 -11.165 1.00 0.00 C ATOM 2005 CD ARG A 125 -10.919 -4.574 -12.296 1.00 0.00 C ATOM 2006 NE ARG A 125 -11.197 -5.647 -13.246 1.00 0.00 N ATOM 2007 CZ ARG A 125 -10.594 -5.759 -14.425 1.00 0.00 C ATOM 2008 NH1 ARG A 125 -9.685 -4.868 -14.796 1.00 0.00 N ATOM 2009 NH2 ARG A 125 -10.901 -6.764 -15.236 1.00 0.00 N ATOM 0 H ARG A 125 -9.950 -3.576 -9.066 1.00 0.00 H new ATOM 0 HA ARG A 125 -12.484 -4.328 -9.977 1.00 0.00 H new ATOM 0 HB2 ARG A 125 -10.117 -6.122 -9.326 1.00 0.00 H new ATOM 0 HB3 ARG A 125 -11.419 -6.476 -10.444 1.00 0.00 H new ATOM 0 HG2 ARG A 125 -9.448 -4.185 -10.780 1.00 0.00 H new ATOM 0 HG3 ARG A 125 -9.286 -5.752 -11.548 1.00 0.00 H new ATOM 0 HD2 ARG A 125 -11.857 -4.205 -11.881 1.00 0.00 H new ATOM 0 HD3 ARG A 125 -10.451 -3.739 -12.818 1.00 0.00 H new ATOM 0 HE ARG A 125 -11.892 -6.349 -12.991 1.00 0.00 H new ATOM 0 HH11 ARG A 125 -9.447 -4.094 -14.176 1.00 0.00 H new ATOM 0 HH12 ARG A 125 -9.224 -4.957 -15.701 1.00 0.00 H new ATOM 0 HH21 ARG A 125 -11.600 -7.451 -14.955 1.00 0.00 H new ATOM 0 HH22 ARG A 125 -10.438 -6.849 -16.141 1.00 0.00 H new ATOM 2023 N SER A 126 -11.617 -5.670 -7.080 1.00 0.00 N ATOM 2024 CA SER A 126 -12.141 -6.343 -5.897 1.00 0.00 C ATOM 2025 C SER A 126 -13.345 -5.593 -5.335 1.00 0.00 C ATOM 2026 O SER A 126 -13.628 -4.464 -5.734 1.00 0.00 O ATOM 2027 CB SER A 126 -11.054 -6.461 -4.827 1.00 0.00 C ATOM 2028 OG SER A 126 -11.468 -7.310 -3.771 1.00 0.00 O ATOM 0 H SER A 126 -10.624 -5.444 -7.031 1.00 0.00 H new ATOM 0 HA SER A 126 -12.461 -7.343 -6.190 1.00 0.00 H new ATOM 0 HB2 SER A 126 -10.140 -6.851 -5.274 1.00 0.00 H new ATOM 0 HB3 SER A 126 -10.819 -5.473 -4.432 1.00 0.00 H new ATOM 0 HG SER A 126 -10.755 -7.370 -3.101 1.00 0.00 H new ATOM 2034 N SER A 127 -14.050 -6.230 -4.405 1.00 0.00 N ATOM 2035 CA SER A 127 -15.226 -5.627 -3.790 1.00 0.00 C ATOM 2036 C SER A 127 -14.843 -4.850 -2.534 1.00 0.00 C ATOM 2037 O SER A 127 -15.420 -3.804 -2.238 1.00 0.00 O ATOM 2038 CB SER A 127 -16.256 -6.703 -3.443 1.00 0.00 C ATOM 2039 OG SER A 127 -17.566 -6.164 -3.411 1.00 0.00 O ATOM 0 H SER A 127 -13.827 -7.164 -4.061 1.00 0.00 H new ATOM 0 HA SER A 127 -15.665 -4.933 -4.507 1.00 0.00 H new ATOM 0 HB2 SER A 127 -16.208 -7.507 -4.178 1.00 0.00 H new ATOM 0 HB3 SER A 127 -16.016 -7.142 -2.474 1.00 0.00 H new ATOM 0 HG SER A 127 -18.206 -6.872 -3.189 1.00 0.00 H new ATOM 2045 N ALA A 128 -13.866 -5.370 -1.799 1.00 0.00 N ATOM 2046 CA ALA A 128 -13.404 -4.725 -0.576 1.00 0.00 C ATOM 2047 C ALA A 128 -13.440 -3.207 -0.708 1.00 0.00 C ATOM 2048 O ALA A 128 -13.817 -2.501 0.227 1.00 0.00 O ATOM 2049 CB ALA A 128 -11.998 -5.194 -0.231 1.00 0.00 C ATOM 0 H ALA A 128 -13.379 -6.236 -2.029 1.00 0.00 H new ATOM 0 HA ALA A 128 -14.078 -5.009 0.232 1.00 0.00 H new ATOM 0 HB1 ALA A 128 -11.665 -4.704 0.684 1.00 0.00 H new ATOM 0 HB2 ALA A 128 -12.000 -6.274 -0.085 1.00 0.00 H new ATOM 0 HB3 ALA A 128 -11.320 -4.940 -1.045 1.00 0.00 H new ATOM 2055 N TYR A 129 -13.044 -2.710 -1.875 1.00 0.00 N ATOM 2056 CA TYR A 129 -13.028 -1.274 -2.129 1.00 0.00 C ATOM 2057 C TYR A 129 -14.446 -0.726 -2.246 1.00 0.00 C ATOM 2058 O TYR A 129 -14.808 0.238 -1.572 1.00 0.00 O ATOM 2059 CB TYR A 129 -12.244 -0.970 -3.406 1.00 0.00 C ATOM 2060 CG TYR A 129 -12.600 0.359 -4.033 1.00 0.00 C ATOM 2061 CD1 TYR A 129 -13.682 0.473 -4.898 1.00 0.00 C ATOM 2062 CD2 TYR A 129 -11.856 1.500 -3.762 1.00 0.00 C ATOM 2063 CE1 TYR A 129 -14.012 1.684 -5.474 1.00 0.00 C ATOM 2064 CE2 TYR A 129 -12.179 2.716 -4.332 1.00 0.00 C ATOM 2065 CZ TYR A 129 -13.258 2.803 -5.188 1.00 0.00 C ATOM 2066 OH TYR A 129 -13.582 4.012 -5.759 1.00 0.00 O ATOM 0 H TYR A 129 -12.730 -3.280 -2.660 1.00 0.00 H new ATOM 0 HA TYR A 129 -12.539 -0.787 -1.286 1.00 0.00 H new ATOM 0 HB2 TYR A 129 -11.178 -0.981 -3.179 1.00 0.00 H new ATOM 0 HB3 TYR A 129 -12.424 -1.764 -4.131 1.00 0.00 H new ATOM 0 HD1 TYR A 129 -14.275 -0.401 -5.124 1.00 0.00 H new ATOM 0 HD2 TYR A 129 -11.010 1.435 -3.094 1.00 0.00 H new ATOM 0 HE1 TYR A 129 -14.856 1.754 -6.145 1.00 0.00 H new ATOM 0 HE2 TYR A 129 -11.590 3.594 -4.109 1.00 0.00 H new ATOM 0 HH TYR A 129 -14.366 3.901 -6.337 1.00 0.00 H new ATOM 2076 N GLN A 130 -15.245 -1.348 -3.108 1.00 0.00 N ATOM 2077 CA GLN A 130 -16.624 -0.923 -3.314 1.00 0.00 C ATOM 2078 C GLN A 130 -17.378 -0.858 -1.990 1.00 0.00 C ATOM 2079 O GLN A 130 -18.250 -0.010 -1.803 1.00 0.00 O ATOM 2080 CB GLN A 130 -17.336 -1.878 -4.273 1.00 0.00 C ATOM 2081 CG GLN A 130 -16.672 -1.978 -5.637 1.00 0.00 C ATOM 2082 CD GLN A 130 -17.204 -0.955 -6.621 1.00 0.00 C ATOM 2083 OE1 GLN A 130 -18.044 -0.123 -6.277 1.00 0.00 O ATOM 2084 NE2 GLN A 130 -16.715 -1.010 -7.855 1.00 0.00 N ATOM 0 H GLN A 130 -14.961 -2.147 -3.674 1.00 0.00 H new ATOM 0 HA GLN A 130 -16.608 0.075 -3.751 1.00 0.00 H new ATOM 0 HB2 GLN A 130 -17.374 -2.870 -3.823 1.00 0.00 H new ATOM 0 HB3 GLN A 130 -18.366 -1.547 -4.403 1.00 0.00 H new ATOM 0 HG2 GLN A 130 -15.596 -1.843 -5.524 1.00 0.00 H new ATOM 0 HG3 GLN A 130 -16.827 -2.979 -6.040 1.00 0.00 H new ATOM 0 HE21 GLN A 130 -16.020 -1.716 -8.097 1.00 0.00 H new ATOM 0 HE22 GLN A 130 -17.035 -0.346 -8.560 1.00 0.00 H new ATOM 2093 N GLU A 131 -17.035 -1.759 -1.075 1.00 0.00 N ATOM 2094 CA GLU A 131 -17.681 -1.803 0.232 1.00 0.00 C ATOM 2095 C GLU A 131 -17.995 -0.396 0.732 1.00 0.00 C ATOM 2096 O GLU A 131 -19.159 -0.024 0.886 1.00 0.00 O ATOM 2097 CB GLU A 131 -16.790 -2.529 1.242 1.00 0.00 C ATOM 2098 CG GLU A 131 -16.499 -3.973 0.870 1.00 0.00 C ATOM 2099 CD GLU A 131 -17.687 -4.886 1.103 1.00 0.00 C ATOM 2100 OE1 GLU A 131 -18.392 -4.697 2.116 1.00 0.00 O ATOM 2101 OE2 GLU A 131 -17.911 -5.790 0.271 1.00 0.00 O ATOM 0 H GLU A 131 -16.315 -2.467 -1.214 1.00 0.00 H new ATOM 0 HA GLU A 131 -18.618 -2.349 0.127 1.00 0.00 H new ATOM 0 HB2 GLU A 131 -15.847 -1.990 1.336 1.00 0.00 H new ATOM 0 HB3 GLU A 131 -17.270 -2.504 2.220 1.00 0.00 H new ATOM 0 HG2 GLU A 131 -16.208 -4.022 -0.179 1.00 0.00 H new ATOM 0 HG3 GLU A 131 -15.651 -4.331 1.453 1.00 0.00 H new ATOM 2108 N LEU A 132 -16.948 0.382 0.985 1.00 0.00 N ATOM 2109 CA LEU A 132 -17.110 1.749 1.469 1.00 0.00 C ATOM 2110 C LEU A 132 -18.184 2.484 0.674 1.00 0.00 C ATOM 2111 O LEU A 132 -19.105 3.068 1.247 1.00 0.00 O ATOM 2112 CB LEU A 132 -15.783 2.505 1.374 1.00 0.00 C ATOM 2113 CG LEU A 132 -14.627 1.937 2.198 1.00 0.00 C ATOM 2114 CD1 LEU A 132 -15.149 1.268 3.460 1.00 0.00 C ATOM 2115 CD2 LEU A 132 -13.813 0.954 1.369 1.00 0.00 C ATOM 0 H LEU A 132 -15.978 0.090 0.863 1.00 0.00 H new ATOM 0 HA LEU A 132 -17.422 1.704 2.512 1.00 0.00 H new ATOM 0 HB2 LEU A 132 -15.478 2.533 0.328 1.00 0.00 H new ATOM 0 HB3 LEU A 132 -15.952 3.536 1.685 1.00 0.00 H new ATOM 0 HG LEU A 132 -13.976 2.761 2.491 1.00 0.00 H new ATOM 0 HD11 LEU A 132 -14.312 0.870 4.034 1.00 0.00 H new ATOM 0 HD12 LEU A 132 -15.687 1.999 4.063 1.00 0.00 H new ATOM 0 HD13 LEU A 132 -15.822 0.455 3.189 1.00 0.00 H new ATOM 0 HD21 LEU A 132 -12.995 0.560 1.972 1.00 0.00 H new ATOM 0 HD22 LEU A 132 -14.453 0.133 1.046 1.00 0.00 H new ATOM 0 HD23 LEU A 132 -13.407 1.464 0.495 1.00 0.00 H new ATOM 2127 N LEU A 133 -18.062 2.450 -0.648 1.00 0.00 N ATOM 2128 CA LEU A 133 -19.025 3.111 -1.523 1.00 0.00 C ATOM 2129 C LEU A 133 -20.444 2.635 -1.229 1.00 0.00 C ATOM 2130 O LEU A 133 -21.302 3.419 -0.825 1.00 0.00 O ATOM 2131 CB LEU A 133 -18.678 2.845 -2.989 1.00 0.00 C ATOM 2132 CG LEU A 133 -17.493 3.630 -3.551 1.00 0.00 C ATOM 2133 CD1 LEU A 133 -17.134 3.132 -4.943 1.00 0.00 C ATOM 2134 CD2 LEU A 133 -17.804 5.120 -3.579 1.00 0.00 C ATOM 0 H LEU A 133 -17.306 1.972 -1.138 1.00 0.00 H new ATOM 0 HA LEU A 133 -18.975 4.183 -1.333 1.00 0.00 H new ATOM 0 HB2 LEU A 133 -18.471 1.781 -3.105 1.00 0.00 H new ATOM 0 HB3 LEU A 133 -19.556 3.067 -3.596 1.00 0.00 H new ATOM 0 HG LEU A 133 -16.635 3.471 -2.898 1.00 0.00 H new ATOM 0 HD11 LEU A 133 -16.288 3.703 -5.327 1.00 0.00 H new ATOM 0 HD12 LEU A 133 -16.867 2.076 -4.894 1.00 0.00 H new ATOM 0 HD13 LEU A 133 -17.989 3.260 -5.607 1.00 0.00 H new ATOM 0 HD21 LEU A 133 -16.949 5.663 -3.982 1.00 0.00 H new ATOM 0 HD22 LEU A 133 -18.676 5.298 -4.208 1.00 0.00 H new ATOM 0 HD23 LEU A 133 -18.010 5.468 -2.567 1.00 0.00 H new