USER MOD reduce.3.24.130724 H: found=0, std=0, add=1025, rem=0, adj=25 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 19 MET CE :methyl -159:sc= -0.204 (180deg=-0.202) USER MOD Set 1.2: A 115 MET CE :methyl -134:sc= -3.22! (180deg=-4.76!) USER MOD Set 2.1: A 55 LYS NZ :NH3+ 175:sc= 0.169 (180deg=0) USER MOD Set 2.2: A 108 GLN : amide:sc= -4.5! X(o=-4.3!,f=-4.7) USER MOD Single : A 9 GLN : amide:sc= 0 K(o=0,f=-1.1) USER MOD Single : A 10 GLN : amide:sc= -2.58 K(o=-2.6,f=-0.38) USER MOD Single : A 13 LYS NZ :NH3+ -178:sc= 0 (180deg=-0.00372) USER MOD Single : A 24 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 31 GLN : amide:sc= -0.289 X(o=-0.29,f=-0.67) 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 41 SER OG : rot -150:sc= -0.597 USER MOD Single : A 42 SER OG : rot 180:sc= -1.06 USER MOD Single : A 44 ASN : amide:sc= -0.0352 K(o=-0.035,f=-2.1) 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 X(o=0,f=0) USER MOD Single : A 71 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 80 SER OG : rot 180:sc= 0 USER MOD Single : A 83 ASN : amide:sc= -0.528 K(o=-0.53,f=-5.6!) USER MOD Single : A 86 SER OG : rot -52:sc= 0.0617 USER MOD Single : A 87 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 88 SER OG : rot -50:sc= -1.11 USER MOD Single : A 89 TYR OH : rot 180:sc= 0 USER MOD Single : A 91 LYS NZ :NH3+ -167:sc=-0.00858 (180deg=-0.145) USER MOD Single : A 92 THR OG1 : rot 74:sc= 0.565 USER MOD Single : A 93 THR OG1 : rot 77:sc= 0.946 USER MOD Single : A 94 HIS : no HD1:sc=-0.000311 X(o=-0.00031,f=-0.38) USER MOD Single : A 95 ASN : amide:sc= -1.08 K(o=-1.1,f=-5.8!) 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 -122:sc= 0.0568 USER MOD Single : A 110 HIS : no HD1:sc= -2.26! K(o=-2.3!,f=-0.94) USER MOD Single : A 112 TYR OH : rot 166:sc= 0.437 USER MOD Single : A 113 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 116 LYS NZ :NH3+ -134:sc=-0.00837 (180deg=-0.754) USER MOD Single : A 117 SER OG : rot 180:sc= 0 USER MOD Single : A 119 SER OG : rot 150:sc= 0 USER MOD Single : A 120 TYR OH : rot 180:sc= 0 USER MOD Single : A 126 SER OG : rot -6:sc= 0.385 USER MOD Single : A 127 SER OG : rot 180:sc= 0 USER MOD Single : A 129 TYR OH : rot -15:sc= -0.904 USER MOD Single : A 130 GLN : amide:sc= -0.069 K(o=-0.069,f=-1.6!) USER MOD ----------------------------------------------------------------- ATOM 77 N GLN A 9 -18.835 8.565 1.509 1.00 0.00 N ATOM 78 CA GLN A 9 -19.031 7.838 0.261 1.00 0.00 C ATOM 79 C GLN A 9 -18.334 8.546 -0.897 1.00 0.00 C ATOM 80 O GLN A 9 -17.612 7.922 -1.674 1.00 0.00 O ATOM 81 CB GLN A 9 -20.523 7.690 -0.040 1.00 0.00 C ATOM 82 CG GLN A 9 -20.812 7.082 -1.403 1.00 0.00 C ATOM 83 CD GLN A 9 -22.286 6.804 -1.618 1.00 0.00 C ATOM 84 OE1 GLN A 9 -23.102 6.984 -0.713 1.00 0.00 O ATOM 85 NE2 GLN A 9 -22.637 6.361 -2.820 1.00 0.00 N ATOM 0 HA GLN A 9 -18.591 6.847 0.375 1.00 0.00 H new ATOM 0 HB2 GLN A 9 -20.980 7.069 0.730 1.00 0.00 H new ATOM 0 HB3 GLN A 9 -20.996 8.670 0.019 1.00 0.00 H new ATOM 0 HG2 GLN A 9 -20.457 7.758 -2.181 1.00 0.00 H new ATOM 0 HG3 GLN A 9 -20.252 6.153 -1.508 1.00 0.00 H new ATOM 0 HE21 GLN A 9 -21.928 6.226 -3.541 1.00 0.00 H new ATOM 0 HE22 GLN A 9 -23.615 6.156 -3.022 1.00 0.00 H new ATOM 94 N GLN A 10 -18.556 9.852 -1.004 1.00 0.00 N ATOM 95 CA GLN A 10 -17.950 10.645 -2.068 1.00 0.00 C ATOM 96 C GLN A 10 -16.430 10.649 -1.945 1.00 0.00 C ATOM 97 O GLN A 10 -15.717 10.497 -2.937 1.00 0.00 O ATOM 98 CB GLN A 10 -18.481 12.079 -2.030 1.00 0.00 C ATOM 99 CG GLN A 10 -19.996 12.169 -2.108 1.00 0.00 C ATOM 100 CD GLN A 10 -20.576 11.307 -3.213 1.00 0.00 C ATOM 101 OE1 GLN A 10 -20.840 11.786 -4.316 1.00 0.00 O ATOM 102 NE2 GLN A 10 -20.776 10.027 -2.922 1.00 0.00 N ATOM 0 H GLN A 10 -19.150 10.383 -0.368 1.00 0.00 H new ATOM 0 HA GLN A 10 -18.218 10.192 -3.022 1.00 0.00 H new ATOM 0 HB2 GLN A 10 -18.144 12.558 -1.111 1.00 0.00 H new ATOM 0 HB3 GLN A 10 -18.049 12.640 -2.859 1.00 0.00 H new ATOM 0 HG2 GLN A 10 -20.424 11.865 -1.153 1.00 0.00 H new ATOM 0 HG3 GLN A 10 -20.287 13.207 -2.272 1.00 0.00 H new ATOM 0 HE21 GLN A 10 -20.543 9.672 -1.995 1.00 0.00 H new ATOM 0 HE22 GLN A 10 -21.163 9.398 -3.626 1.00 0.00 H new ATOM 111 N ARG A 11 -15.941 10.824 -0.721 1.00 0.00 N ATOM 112 CA ARG A 11 -14.505 10.850 -0.469 1.00 0.00 C ATOM 113 C ARG A 11 -13.852 9.543 -0.911 1.00 0.00 C ATOM 114 O ARG A 11 -12.745 9.541 -1.448 1.00 0.00 O ATOM 115 CB ARG A 11 -14.231 11.093 1.016 1.00 0.00 C ATOM 116 CG ARG A 11 -12.777 11.414 1.322 1.00 0.00 C ATOM 117 CD ARG A 11 -12.420 11.063 2.758 1.00 0.00 C ATOM 118 NE ARG A 11 -12.975 12.022 3.710 1.00 0.00 N ATOM 119 CZ ARG A 11 -12.343 13.124 4.097 1.00 0.00 C ATOM 120 NH1 ARG A 11 -11.140 13.405 3.616 1.00 0.00 N ATOM 121 NH2 ARG A 11 -12.914 13.947 4.967 1.00 0.00 N ATOM 0 H ARG A 11 -16.518 10.950 0.111 1.00 0.00 H new ATOM 0 HA ARG A 11 -14.074 11.666 -1.049 1.00 0.00 H new ATOM 0 HB2 ARG A 11 -14.857 11.916 1.362 1.00 0.00 H new ATOM 0 HB3 ARG A 11 -14.526 10.209 1.581 1.00 0.00 H new ATOM 0 HG2 ARG A 11 -12.130 10.863 0.640 1.00 0.00 H new ATOM 0 HG3 ARG A 11 -12.593 12.474 1.149 1.00 0.00 H new ATOM 0 HD2 ARG A 11 -12.792 10.065 2.990 1.00 0.00 H new ATOM 0 HD3 ARG A 11 -11.336 11.032 2.865 1.00 0.00 H new ATOM 0 HE ARG A 11 -13.899 11.835 4.099 1.00 0.00 H new ATOM 0 HH11 ARG A 11 -10.698 12.774 2.947 1.00 0.00 H new ATOM 0 HH12 ARG A 11 -10.656 14.252 3.915 1.00 0.00 H new ATOM 0 HH21 ARG A 11 -13.839 13.734 5.339 1.00 0.00 H new ATOM 0 HH22 ARG A 11 -12.428 14.793 5.264 1.00 0.00 H new ATOM 135 N VAL A 12 -14.546 8.433 -0.679 1.00 0.00 N ATOM 136 CA VAL A 12 -14.034 7.120 -1.053 1.00 0.00 C ATOM 137 C VAL A 12 -13.847 7.012 -2.562 1.00 0.00 C ATOM 138 O VAL A 12 -12.755 6.710 -3.044 1.00 0.00 O ATOM 139 CB VAL A 12 -14.976 5.996 -0.582 1.00 0.00 C ATOM 140 CG1 VAL A 12 -14.470 4.642 -1.056 1.00 0.00 C ATOM 141 CG2 VAL A 12 -15.119 6.021 0.932 1.00 0.00 C ATOM 0 H VAL A 12 -15.464 8.417 -0.234 1.00 0.00 H new ATOM 0 HA VAL A 12 -13.068 7.005 -0.561 1.00 0.00 H new ATOM 0 HB VAL A 12 -15.960 6.163 -1.020 1.00 0.00 H new ATOM 0 HG11 VAL A 12 -15.148 3.860 -0.714 1.00 0.00 H new ATOM 0 HG12 VAL A 12 -14.424 4.632 -2.145 1.00 0.00 H new ATOM 0 HG13 VAL A 12 -13.475 4.463 -0.649 1.00 0.00 H new ATOM 0 HG21 VAL A 12 -15.788 5.220 1.248 1.00 0.00 H new ATOM 0 HG22 VAL A 12 -14.141 5.879 1.392 1.00 0.00 H new ATOM 0 HG23 VAL A 12 -15.531 6.981 1.243 1.00 0.00 H new ATOM 151 N LYS A 13 -14.920 7.262 -3.305 1.00 0.00 N ATOM 152 CA LYS A 13 -14.876 7.196 -4.761 1.00 0.00 C ATOM 153 C LYS A 13 -13.617 7.868 -5.298 1.00 0.00 C ATOM 154 O LYS A 13 -12.949 7.336 -6.185 1.00 0.00 O ATOM 155 CB LYS A 13 -16.117 7.861 -5.360 1.00 0.00 C ATOM 156 CG LYS A 13 -16.239 7.678 -6.863 1.00 0.00 C ATOM 157 CD LYS A 13 -16.995 6.407 -7.211 1.00 0.00 C ATOM 158 CE LYS A 13 -17.197 6.272 -8.713 1.00 0.00 C ATOM 159 NZ LYS A 13 -18.255 7.192 -9.214 1.00 0.00 N ATOM 0 H LYS A 13 -15.832 7.512 -2.922 1.00 0.00 H new ATOM 0 HA LYS A 13 -14.858 6.146 -5.052 1.00 0.00 H new ATOM 0 HB2 LYS A 13 -17.006 7.452 -4.879 1.00 0.00 H new ATOM 0 HB3 LYS A 13 -16.093 8.927 -5.133 1.00 0.00 H new ATOM 0 HG2 LYS A 13 -16.752 8.537 -7.294 1.00 0.00 H new ATOM 0 HG3 LYS A 13 -15.245 7.644 -7.308 1.00 0.00 H new ATOM 0 HD2 LYS A 13 -16.447 5.542 -6.837 1.00 0.00 H new ATOM 0 HD3 LYS A 13 -17.964 6.410 -6.711 1.00 0.00 H new ATOM 0 HE2 LYS A 13 -16.259 6.483 -9.226 1.00 0.00 H new ATOM 0 HE3 LYS A 13 -17.467 5.243 -8.952 1.00 0.00 H new ATOM 0 HZ1 LYS A 13 -18.387 7.046 -10.235 1.00 0.00 H new ATOM 0 HZ2 LYS A 13 -19.148 6.997 -8.718 1.00 0.00 H new ATOM 0 HZ3 LYS A 13 -17.970 8.177 -9.039 1.00 0.00 H new ATOM 173 N ARG A 14 -13.298 9.038 -4.755 1.00 0.00 N ATOM 174 CA ARG A 14 -12.118 9.781 -5.180 1.00 0.00 C ATOM 175 C ARG A 14 -10.898 8.868 -5.256 1.00 0.00 C ATOM 176 O ARG A 14 -10.118 8.936 -6.206 1.00 0.00 O ATOM 177 CB ARG A 14 -11.844 10.938 -4.217 1.00 0.00 C ATOM 178 CG ARG A 14 -12.788 12.115 -4.395 1.00 0.00 C ATOM 179 CD ARG A 14 -12.236 13.127 -5.387 1.00 0.00 C ATOM 180 NE ARG A 14 -11.114 13.880 -4.834 1.00 0.00 N ATOM 181 CZ ARG A 14 -10.788 15.107 -5.226 1.00 0.00 C ATOM 182 NH1 ARG A 14 -11.496 15.716 -6.167 1.00 0.00 N ATOM 183 NH2 ARG A 14 -9.752 15.727 -4.675 1.00 0.00 N ATOM 0 H ARG A 14 -13.840 9.492 -4.020 1.00 0.00 H new ATOM 0 HA ARG A 14 -12.311 10.183 -6.175 1.00 0.00 H new ATOM 0 HB2 ARG A 14 -11.921 10.573 -3.193 1.00 0.00 H new ATOM 0 HB3 ARG A 14 -10.819 11.281 -4.357 1.00 0.00 H new ATOM 0 HG2 ARG A 14 -13.757 11.756 -4.741 1.00 0.00 H new ATOM 0 HG3 ARG A 14 -12.952 12.600 -3.433 1.00 0.00 H new ATOM 0 HD2 ARG A 14 -11.915 12.610 -6.291 1.00 0.00 H new ATOM 0 HD3 ARG A 14 -13.027 13.818 -5.679 1.00 0.00 H new ATOM 0 HE ARG A 14 -10.550 13.440 -4.107 1.00 0.00 H new ATOM 0 HH11 ARG A 14 -12.293 15.243 -6.592 1.00 0.00 H new ATOM 0 HH12 ARG A 14 -11.243 16.658 -6.466 1.00 0.00 H new ATOM 0 HH21 ARG A 14 -9.206 15.262 -3.950 1.00 0.00 H new ATOM 0 HH22 ARG A 14 -9.502 16.669 -4.976 1.00 0.00 H new ATOM 197 N TRP A 15 -10.740 8.016 -4.249 1.00 0.00 N ATOM 198 CA TRP A 15 -9.614 7.090 -4.202 1.00 0.00 C ATOM 199 C TRP A 15 -9.542 6.256 -5.476 1.00 0.00 C ATOM 200 O TRP A 15 -8.463 5.839 -5.896 1.00 0.00 O ATOM 201 CB TRP A 15 -9.732 6.174 -2.983 1.00 0.00 C ATOM 202 CG TRP A 15 -10.056 6.908 -1.717 1.00 0.00 C ATOM 203 CD1 TRP A 15 -9.736 8.201 -1.415 1.00 0.00 C ATOM 204 CD2 TRP A 15 -10.761 6.391 -0.583 1.00 0.00 C ATOM 205 NE1 TRP A 15 -10.200 8.518 -0.161 1.00 0.00 N ATOM 206 CE2 TRP A 15 -10.833 7.426 0.370 1.00 0.00 C ATOM 207 CE3 TRP A 15 -11.340 5.155 -0.281 1.00 0.00 C ATOM 208 CZ2 TRP A 15 -11.460 7.260 1.602 1.00 0.00 C ATOM 209 CZ3 TRP A 15 -11.961 4.993 0.943 1.00 0.00 C ATOM 210 CH2 TRP A 15 -12.018 6.040 1.871 1.00 0.00 C ATOM 0 H TRP A 15 -11.377 7.947 -3.455 1.00 0.00 H new ATOM 0 HA TRP A 15 -8.697 7.674 -4.121 1.00 0.00 H new ATOM 0 HB2 TRP A 15 -10.505 5.429 -3.171 1.00 0.00 H new ATOM 0 HB3 TRP A 15 -8.795 5.634 -2.851 1.00 0.00 H new ATOM 0 HD1 TRP A 15 -9.198 8.875 -2.065 1.00 0.00 H new ATOM 0 HE1 TRP A 15 -10.091 9.421 0.300 1.00 0.00 H new ATOM 0 HE3 TRP A 15 -11.303 4.342 -0.991 1.00 0.00 H new ATOM 0 HZ2 TRP A 15 -11.504 8.066 2.320 1.00 0.00 H new ATOM 0 HZ3 TRP A 15 -12.410 4.042 1.188 1.00 0.00 H new ATOM 0 HH2 TRP A 15 -12.512 5.881 2.818 1.00 0.00 H new ATOM 221 N GLY A 16 -10.698 6.015 -6.087 1.00 0.00 N ATOM 222 CA GLY A 16 -10.743 5.231 -7.308 1.00 0.00 C ATOM 223 C GLY A 16 -10.316 6.028 -8.524 1.00 0.00 C ATOM 224 O GLY A 16 -10.716 5.722 -9.648 1.00 0.00 O ATOM 0 H GLY A 16 -11.604 6.349 -5.758 1.00 0.00 H new ATOM 0 HA2 GLY A 16 -10.095 4.361 -7.202 1.00 0.00 H new ATOM 0 HA3 GLY A 16 -11.756 4.858 -7.459 1.00 0.00 H new ATOM 228 N PHE A 17 -9.502 7.054 -8.302 1.00 0.00 N ATOM 229 CA PHE A 17 -9.022 7.899 -9.389 1.00 0.00 C ATOM 230 C PHE A 17 -7.503 7.821 -9.510 1.00 0.00 C ATOM 231 O PHE A 17 -6.876 8.664 -10.150 1.00 0.00 O ATOM 232 CB PHE A 17 -9.453 9.350 -9.164 1.00 0.00 C ATOM 233 CG PHE A 17 -10.915 9.587 -9.414 1.00 0.00 C ATOM 234 CD1 PHE A 17 -11.540 9.038 -10.522 1.00 0.00 C ATOM 235 CD2 PHE A 17 -11.664 10.361 -8.542 1.00 0.00 C ATOM 236 CE1 PHE A 17 -12.885 9.254 -10.754 1.00 0.00 C ATOM 237 CE2 PHE A 17 -13.009 10.580 -8.769 1.00 0.00 C ATOM 238 CZ PHE A 17 -13.620 10.027 -9.878 1.00 0.00 C ATOM 0 H PHE A 17 -9.161 7.321 -7.379 1.00 0.00 H new ATOM 0 HA PHE A 17 -9.462 7.536 -10.318 1.00 0.00 H new ATOM 0 HB2 PHE A 17 -9.217 9.636 -8.139 1.00 0.00 H new ATOM 0 HB3 PHE A 17 -8.871 9.999 -9.818 1.00 0.00 H new ATOM 0 HD1 PHE A 17 -10.969 8.434 -11.212 1.00 0.00 H new ATOM 0 HD2 PHE A 17 -11.191 10.798 -7.675 1.00 0.00 H new ATOM 0 HE1 PHE A 17 -13.361 8.818 -11.620 1.00 0.00 H new ATOM 0 HE2 PHE A 17 -13.582 11.183 -8.080 1.00 0.00 H new ATOM 0 HZ PHE A 17 -14.671 10.199 -10.059 1.00 0.00 H new ATOM 248 N GLY A 18 -6.918 6.801 -8.889 1.00 0.00 N ATOM 249 CA GLY A 18 -5.478 6.631 -8.938 1.00 0.00 C ATOM 250 C GLY A 18 -4.840 6.691 -7.564 1.00 0.00 C ATOM 251 O GLY A 18 -5.271 7.460 -6.706 1.00 0.00 O ATOM 0 H GLY A 18 -7.416 6.090 -8.353 1.00 0.00 H new ATOM 0 HA2 GLY A 18 -5.244 5.673 -9.402 1.00 0.00 H new ATOM 0 HA3 GLY A 18 -5.045 7.406 -9.570 1.00 0.00 H new ATOM 255 N MET A 19 -3.811 5.876 -7.355 1.00 0.00 N ATOM 256 CA MET A 19 -3.113 5.840 -6.075 1.00 0.00 C ATOM 257 C MET A 19 -2.996 7.239 -5.480 1.00 0.00 C ATOM 258 O MET A 19 -3.212 7.435 -4.284 1.00 0.00 O ATOM 259 CB MET A 19 -1.721 5.228 -6.246 1.00 0.00 C ATOM 260 CG MET A 19 -1.184 4.577 -4.982 1.00 0.00 C ATOM 261 SD MET A 19 0.024 3.283 -5.326 1.00 0.00 S ATOM 262 CE MET A 19 1.539 4.237 -5.370 1.00 0.00 C ATOM 0 H MET A 19 -3.442 5.232 -8.055 1.00 0.00 H new ATOM 0 HA MET A 19 -3.693 5.221 -5.391 1.00 0.00 H new ATOM 0 HB2 MET A 19 -1.756 4.484 -7.042 1.00 0.00 H new ATOM 0 HB3 MET A 19 -1.028 6.006 -6.567 1.00 0.00 H new ATOM 0 HG2 MET A 19 -0.725 5.339 -4.352 1.00 0.00 H new ATOM 0 HG3 MET A 19 -2.013 4.153 -4.416 1.00 0.00 H new ATOM 0 HE1 MET A 19 2.300 3.686 -5.922 1.00 0.00 H new ATOM 0 HE2 MET A 19 1.354 5.192 -5.862 1.00 0.00 H new ATOM 0 HE3 MET A 19 1.887 4.415 -4.352 1.00 0.00 H new ATOM 272 N ASP A 20 -2.654 8.208 -6.321 1.00 0.00 N ATOM 273 CA ASP A 20 -2.510 9.590 -5.878 1.00 0.00 C ATOM 274 C ASP A 20 -3.509 9.913 -4.771 1.00 0.00 C ATOM 275 O ASP A 20 -3.124 10.290 -3.665 1.00 0.00 O ATOM 276 CB ASP A 20 -2.705 10.549 -7.053 1.00 0.00 C ATOM 277 CG ASP A 20 -1.753 10.262 -8.198 1.00 0.00 C ATOM 278 OD1 ASP A 20 -0.555 10.592 -8.071 1.00 0.00 O ATOM 279 OD2 ASP A 20 -2.205 9.706 -9.220 1.00 0.00 O ATOM 0 H ASP A 20 -2.471 8.062 -7.314 1.00 0.00 H new ATOM 0 HA ASP A 20 -1.502 9.714 -5.482 1.00 0.00 H new ATOM 0 HB2 ASP A 20 -3.732 10.476 -7.411 1.00 0.00 H new ATOM 0 HB3 ASP A 20 -2.559 11.573 -6.710 1.00 0.00 H new ATOM 284 N GLU A 21 -4.794 9.763 -5.079 1.00 0.00 N ATOM 285 CA GLU A 21 -5.848 10.041 -4.111 1.00 0.00 C ATOM 286 C GLU A 21 -5.749 9.099 -2.913 1.00 0.00 C ATOM 287 O GLU A 21 -5.569 9.539 -1.778 1.00 0.00 O ATOM 288 CB GLU A 21 -7.224 9.905 -4.767 1.00 0.00 C ATOM 289 CG GLU A 21 -7.426 10.834 -5.952 1.00 0.00 C ATOM 290 CD GLU A 21 -7.345 12.298 -5.566 1.00 0.00 C ATOM 291 OE1 GLU A 21 -7.934 12.671 -4.530 1.00 0.00 O ATOM 292 OE2 GLU A 21 -6.693 13.071 -6.300 1.00 0.00 O ATOM 0 H GLU A 21 -5.129 9.451 -5.990 1.00 0.00 H new ATOM 0 HA GLU A 21 -5.721 11.065 -3.759 1.00 0.00 H new ATOM 0 HB2 GLU A 21 -7.360 8.875 -5.096 1.00 0.00 H new ATOM 0 HB3 GLU A 21 -7.994 10.106 -4.022 1.00 0.00 H new ATOM 0 HG2 GLU A 21 -6.672 10.620 -6.710 1.00 0.00 H new ATOM 0 HG3 GLU A 21 -8.398 10.634 -6.404 1.00 0.00 H new ATOM 299 N ALA A 22 -5.869 7.802 -3.177 1.00 0.00 N ATOM 300 CA ALA A 22 -5.791 6.799 -2.123 1.00 0.00 C ATOM 301 C ALA A 22 -4.788 7.206 -1.049 1.00 0.00 C ATOM 302 O ALA A 22 -5.022 7.003 0.143 1.00 0.00 O ATOM 303 CB ALA A 22 -5.419 5.445 -2.709 1.00 0.00 C ATOM 0 H ALA A 22 -6.021 7.422 -4.111 1.00 0.00 H new ATOM 0 HA ALA A 22 -6.773 6.723 -1.655 1.00 0.00 H new ATOM 0 HB1 ALA A 22 -5.364 4.705 -1.910 1.00 0.00 H new ATOM 0 HB2 ALA A 22 -6.175 5.142 -3.433 1.00 0.00 H new ATOM 0 HB3 ALA A 22 -4.451 5.516 -3.204 1.00 0.00 H new ATOM 309 N LEU A 23 -3.670 7.781 -1.479 1.00 0.00 N ATOM 310 CA LEU A 23 -2.630 8.217 -0.554 1.00 0.00 C ATOM 311 C LEU A 23 -3.030 9.513 0.145 1.00 0.00 C ATOM 312 O LEU A 23 -2.916 9.635 1.365 1.00 0.00 O ATOM 313 CB LEU A 23 -1.308 8.413 -1.298 1.00 0.00 C ATOM 314 CG LEU A 23 -0.873 7.263 -2.207 1.00 0.00 C ATOM 315 CD1 LEU A 23 0.152 7.744 -3.223 1.00 0.00 C ATOM 316 CD2 LEU A 23 -0.310 6.115 -1.382 1.00 0.00 C ATOM 0 H LEU A 23 -3.461 7.956 -2.462 1.00 0.00 H new ATOM 0 HA LEU A 23 -2.503 7.442 0.202 1.00 0.00 H new ATOM 0 HB2 LEU A 23 -1.384 9.318 -1.901 1.00 0.00 H new ATOM 0 HB3 LEU A 23 -0.522 8.586 -0.563 1.00 0.00 H new ATOM 0 HG LEU A 23 -1.748 6.901 -2.747 1.00 0.00 H new ATOM 0 HD11 LEU A 23 0.450 6.912 -3.861 1.00 0.00 H new ATOM 0 HD12 LEU A 23 -0.285 8.533 -3.835 1.00 0.00 H new ATOM 0 HD13 LEU A 23 1.027 8.132 -2.701 1.00 0.00 H new ATOM 0 HD21 LEU A 23 -0.006 5.305 -2.045 1.00 0.00 H new ATOM 0 HD22 LEU A 23 0.553 6.464 -0.815 1.00 0.00 H new ATOM 0 HD23 LEU A 23 -1.074 5.753 -0.694 1.00 0.00 H new ATOM 328 N LYS A 24 -3.502 10.479 -0.636 1.00 0.00 N ATOM 329 CA LYS A 24 -3.924 11.765 -0.094 1.00 0.00 C ATOM 330 C LYS A 24 -4.635 11.585 1.243 1.00 0.00 C ATOM 331 O LYS A 24 -4.165 12.061 2.276 1.00 0.00 O ATOM 332 CB LYS A 24 -4.847 12.481 -1.083 1.00 0.00 C ATOM 333 CG LYS A 24 -4.111 13.119 -2.248 1.00 0.00 C ATOM 334 CD LYS A 24 -4.873 14.313 -2.801 1.00 0.00 C ATOM 335 CE LYS A 24 -3.972 15.210 -3.636 1.00 0.00 C ATOM 336 NZ LYS A 24 -3.223 16.183 -2.793 1.00 0.00 N ATOM 0 H LYS A 24 -3.602 10.395 -1.648 1.00 0.00 H new ATOM 0 HA LYS A 24 -3.034 12.373 0.067 1.00 0.00 H new ATOM 0 HB2 LYS A 24 -5.574 11.767 -1.470 1.00 0.00 H new ATOM 0 HB3 LYS A 24 -5.407 13.251 -0.552 1.00 0.00 H new ATOM 0 HG2 LYS A 24 -3.120 13.437 -1.924 1.00 0.00 H new ATOM 0 HG3 LYS A 24 -3.967 12.381 -3.037 1.00 0.00 H new ATOM 0 HD2 LYS A 24 -5.706 13.964 -3.411 1.00 0.00 H new ATOM 0 HD3 LYS A 24 -5.299 14.887 -1.978 1.00 0.00 H new ATOM 0 HE2 LYS A 24 -3.266 14.596 -4.196 1.00 0.00 H new ATOM 0 HE3 LYS A 24 -4.574 15.750 -4.367 1.00 0.00 H new ATOM 0 HZ1 LYS A 24 -2.621 16.776 -3.399 1.00 0.00 H new ATOM 0 HZ2 LYS A 24 -3.896 16.786 -2.278 1.00 0.00 H new ATOM 0 HZ3 LYS A 24 -2.629 15.668 -2.113 1.00 0.00 H new ATOM 350 N ASP A 25 -5.769 10.894 1.216 1.00 0.00 N ATOM 351 CA ASP A 25 -6.544 10.649 2.427 1.00 0.00 C ATOM 352 C ASP A 25 -5.848 9.627 3.320 1.00 0.00 C ATOM 353 O ASP A 25 -5.167 8.716 2.849 1.00 0.00 O ATOM 354 CB ASP A 25 -7.948 10.159 2.069 1.00 0.00 C ATOM 355 CG ASP A 25 -8.524 10.879 0.865 1.00 0.00 C ATOM 356 OD1 ASP A 25 -8.007 10.673 -0.253 1.00 0.00 O ATOM 357 OD2 ASP A 25 -9.491 11.649 1.041 1.00 0.00 O ATOM 0 H ASP A 25 -6.172 10.494 0.369 1.00 0.00 H new ATOM 0 HA ASP A 25 -6.624 11.588 2.974 1.00 0.00 H new ATOM 0 HB2 ASP A 25 -7.915 9.088 1.867 1.00 0.00 H new ATOM 0 HB3 ASP A 25 -8.608 10.302 2.924 1.00 0.00 H new ATOM 362 N PRO A 26 -6.021 9.781 4.641 1.00 0.00 N ATOM 363 CA PRO A 26 -5.416 8.881 5.629 1.00 0.00 C ATOM 364 C PRO A 26 -6.045 7.492 5.609 1.00 0.00 C ATOM 365 O PRO A 26 -5.343 6.483 5.542 1.00 0.00 O ATOM 366 CB PRO A 26 -5.699 9.577 6.962 1.00 0.00 C ATOM 367 CG PRO A 26 -6.911 10.405 6.709 1.00 0.00 C ATOM 368 CD PRO A 26 -6.820 10.844 5.273 1.00 0.00 C ATOM 0 HA PRO A 26 -4.356 8.716 5.435 1.00 0.00 H new ATOM 0 HB2 PRO A 26 -5.874 8.852 7.757 1.00 0.00 H new ATOM 0 HB3 PRO A 26 -4.856 10.194 7.273 1.00 0.00 H new ATOM 0 HG2 PRO A 26 -7.820 9.830 6.884 1.00 0.00 H new ATOM 0 HG3 PRO A 26 -6.943 11.264 7.379 1.00 0.00 H new ATOM 0 HD2 PRO A 26 -7.806 10.931 4.816 1.00 0.00 H new ATOM 0 HD3 PRO A 26 -6.339 11.818 5.180 1.00 0.00 H new ATOM 376 N VAL A 27 -7.372 7.448 5.667 1.00 0.00 N ATOM 377 CA VAL A 27 -8.096 6.182 5.654 1.00 0.00 C ATOM 378 C VAL A 27 -7.815 5.401 4.375 1.00 0.00 C ATOM 379 O VAL A 27 -7.697 4.177 4.396 1.00 0.00 O ATOM 380 CB VAL A 27 -9.615 6.402 5.786 1.00 0.00 C ATOM 381 CG1 VAL A 27 -10.359 5.082 5.660 1.00 0.00 C ATOM 382 CG2 VAL A 27 -9.941 7.085 7.105 1.00 0.00 C ATOM 0 H VAL A 27 -7.968 8.274 5.723 1.00 0.00 H new ATOM 0 HA VAL A 27 -7.744 5.608 6.511 1.00 0.00 H new ATOM 0 HB VAL A 27 -9.942 7.053 4.976 1.00 0.00 H new ATOM 0 HG11 VAL A 27 -11.430 5.258 5.756 1.00 0.00 H new ATOM 0 HG12 VAL A 27 -10.150 4.638 4.687 1.00 0.00 H new ATOM 0 HG13 VAL A 27 -10.031 4.403 6.447 1.00 0.00 H new ATOM 0 HG21 VAL A 27 -11.018 7.233 7.182 1.00 0.00 H new ATOM 0 HG22 VAL A 27 -9.600 6.461 7.932 1.00 0.00 H new ATOM 0 HG23 VAL A 27 -9.438 8.051 7.148 1.00 0.00 H new ATOM 392 N GLY A 28 -7.709 6.120 3.261 1.00 0.00 N ATOM 393 CA GLY A 28 -7.442 5.478 1.987 1.00 0.00 C ATOM 394 C GLY A 28 -6.093 4.787 1.957 1.00 0.00 C ATOM 395 O GLY A 28 -5.904 3.811 1.231 1.00 0.00 O ATOM 0 H GLY A 28 -7.803 7.135 3.218 1.00 0.00 H new ATOM 0 HA2 GLY A 28 -8.225 4.748 1.780 1.00 0.00 H new ATOM 0 HA3 GLY A 28 -7.483 6.223 1.193 1.00 0.00 H new ATOM 399 N ARG A 29 -5.152 5.295 2.746 1.00 0.00 N ATOM 400 CA ARG A 29 -3.813 4.723 2.804 1.00 0.00 C ATOM 401 C ARG A 29 -3.840 3.341 3.451 1.00 0.00 C ATOM 402 O ARG A 29 -3.266 2.388 2.925 1.00 0.00 O ATOM 403 CB ARG A 29 -2.875 5.645 3.586 1.00 0.00 C ATOM 404 CG ARG A 29 -2.149 6.656 2.713 1.00 0.00 C ATOM 405 CD ARG A 29 -0.872 7.148 3.376 1.00 0.00 C ATOM 406 NE ARG A 29 -0.299 8.294 2.676 1.00 0.00 N ATOM 407 CZ ARG A 29 0.583 9.124 3.223 1.00 0.00 C ATOM 408 NH1 ARG A 29 0.992 8.934 4.470 1.00 0.00 N ATOM 409 NH2 ARG A 29 1.059 10.145 2.521 1.00 0.00 N ATOM 0 H ARG A 29 -5.293 6.102 3.354 1.00 0.00 H new ATOM 0 HA ARG A 29 -3.444 4.621 1.783 1.00 0.00 H new ATOM 0 HB2 ARG A 29 -3.451 6.178 4.343 1.00 0.00 H new ATOM 0 HB3 ARG A 29 -2.139 5.038 4.114 1.00 0.00 H new ATOM 0 HG2 ARG A 29 -1.910 6.203 1.751 1.00 0.00 H new ATOM 0 HG3 ARG A 29 -2.805 7.503 2.512 1.00 0.00 H new ATOM 0 HD2 ARG A 29 -1.083 7.423 4.410 1.00 0.00 H new ATOM 0 HD3 ARG A 29 -0.143 6.338 3.404 1.00 0.00 H new ATOM 0 HE ARG A 29 -0.592 8.467 1.714 1.00 0.00 H new ATOM 0 HH11 ARG A 29 0.630 8.149 5.012 1.00 0.00 H new ATOM 0 HH12 ARG A 29 1.669 9.572 4.888 1.00 0.00 H new ATOM 0 HH21 ARG A 29 0.748 10.293 1.561 1.00 0.00 H new ATOM 0 HH22 ARG A 29 1.736 10.782 2.942 1.00 0.00 H new ATOM 423 N GLU A 30 -4.510 3.241 4.595 1.00 0.00 N ATOM 424 CA GLU A 30 -4.610 1.976 5.313 1.00 0.00 C ATOM 425 C GLU A 30 -5.534 1.007 4.581 1.00 0.00 C ATOM 426 O GLU A 30 -5.209 -0.169 4.415 1.00 0.00 O ATOM 427 CB GLU A 30 -5.123 2.211 6.735 1.00 0.00 C ATOM 428 CG GLU A 30 -6.639 2.221 6.842 1.00 0.00 C ATOM 429 CD GLU A 30 -7.123 2.533 8.245 1.00 0.00 C ATOM 430 OE1 GLU A 30 -6.967 3.693 8.682 1.00 0.00 O ATOM 431 OE2 GLU A 30 -7.656 1.618 8.906 1.00 0.00 O ATOM 0 H GLU A 30 -4.991 4.020 5.044 1.00 0.00 H new ATOM 0 HA GLU A 30 -3.614 1.535 5.362 1.00 0.00 H new ATOM 0 HB2 GLU A 30 -4.726 1.434 7.388 1.00 0.00 H new ATOM 0 HB3 GLU A 30 -4.735 3.162 7.099 1.00 0.00 H new ATOM 0 HG2 GLU A 30 -7.043 2.959 6.150 1.00 0.00 H new ATOM 0 HG3 GLU A 30 -7.028 1.250 6.535 1.00 0.00 H new ATOM 438 N GLN A 31 -6.685 1.509 4.147 1.00 0.00 N ATOM 439 CA GLN A 31 -7.656 0.687 3.435 1.00 0.00 C ATOM 440 C GLN A 31 -7.010 -0.008 2.241 1.00 0.00 C ATOM 441 O GLN A 31 -7.006 -1.236 2.152 1.00 0.00 O ATOM 442 CB GLN A 31 -8.834 1.544 2.965 1.00 0.00 C ATOM 443 CG GLN A 31 -9.929 1.696 4.008 1.00 0.00 C ATOM 444 CD GLN A 31 -10.558 0.372 4.392 1.00 0.00 C ATOM 445 OE1 GLN A 31 -10.813 -0.479 3.539 1.00 0.00 O ATOM 446 NE2 GLN A 31 -10.812 0.189 5.683 1.00 0.00 N ATOM 0 H GLN A 31 -6.968 2.480 4.276 1.00 0.00 H new ATOM 0 HA GLN A 31 -8.022 -0.076 4.122 1.00 0.00 H new ATOM 0 HB2 GLN A 31 -8.466 2.532 2.689 1.00 0.00 H new ATOM 0 HB3 GLN A 31 -9.260 1.100 2.065 1.00 0.00 H new ATOM 0 HG2 GLN A 31 -9.514 2.168 4.898 1.00 0.00 H new ATOM 0 HG3 GLN A 31 -10.701 2.363 3.624 1.00 0.00 H new ATOM 0 HE21 GLN A 31 -10.585 0.921 6.356 1.00 0.00 H new ATOM 0 HE22 GLN A 31 -11.234 -0.683 6.001 1.00 0.00 H new ATOM 455 N PHE A 32 -6.463 0.785 1.326 1.00 0.00 N ATOM 456 CA PHE A 32 -5.815 0.246 0.136 1.00 0.00 C ATOM 457 C PHE A 32 -4.724 -0.751 0.516 1.00 0.00 C ATOM 458 O PHE A 32 -4.499 -1.739 -0.184 1.00 0.00 O ATOM 459 CB PHE A 32 -5.217 1.378 -0.702 1.00 0.00 C ATOM 460 CG PHE A 32 -4.179 0.914 -1.683 1.00 0.00 C ATOM 461 CD1 PHE A 32 -4.486 -0.044 -2.636 1.00 0.00 C ATOM 462 CD2 PHE A 32 -2.896 1.436 -1.653 1.00 0.00 C ATOM 463 CE1 PHE A 32 -3.532 -0.474 -3.539 1.00 0.00 C ATOM 464 CE2 PHE A 32 -1.938 1.010 -2.554 1.00 0.00 C ATOM 465 CZ PHE A 32 -2.257 0.055 -3.499 1.00 0.00 C ATOM 0 H PHE A 32 -6.455 1.803 1.386 1.00 0.00 H new ATOM 0 HA PHE A 32 -6.569 -0.274 -0.454 1.00 0.00 H new ATOM 0 HB2 PHE A 32 -6.018 1.881 -1.244 1.00 0.00 H new ATOM 0 HB3 PHE A 32 -4.771 2.116 -0.035 1.00 0.00 H new ATOM 0 HD1 PHE A 32 -5.482 -0.459 -2.674 1.00 0.00 H new ATOM 0 HD2 PHE A 32 -2.641 2.184 -0.917 1.00 0.00 H new ATOM 0 HE1 PHE A 32 -3.783 -1.223 -4.275 1.00 0.00 H new ATOM 0 HE2 PHE A 32 -0.941 1.424 -2.519 1.00 0.00 H new ATOM 0 HZ PHE A 32 -1.511 -0.278 -4.205 1.00 0.00 H new ATOM 475 N LEU A 33 -4.049 -0.484 1.629 1.00 0.00 N ATOM 476 CA LEU A 33 -2.981 -1.357 2.103 1.00 0.00 C ATOM 477 C LEU A 33 -3.522 -2.740 2.453 1.00 0.00 C ATOM 478 O LEU A 33 -3.034 -3.754 1.953 1.00 0.00 O ATOM 479 CB LEU A 33 -2.297 -0.741 3.325 1.00 0.00 C ATOM 480 CG LEU A 33 -1.515 -1.708 4.215 1.00 0.00 C ATOM 481 CD1 LEU A 33 -0.097 -1.884 3.695 1.00 0.00 C ATOM 482 CD2 LEU A 33 -1.500 -1.214 5.654 1.00 0.00 C ATOM 0 H LEU A 33 -4.222 0.329 2.219 1.00 0.00 H new ATOM 0 HA LEU A 33 -2.251 -1.465 1.301 1.00 0.00 H new ATOM 0 HB2 LEU A 33 -1.615 0.037 2.981 1.00 0.00 H new ATOM 0 HB3 LEU A 33 -3.057 -0.252 3.934 1.00 0.00 H new ATOM 0 HG LEU A 33 -2.012 -2.678 4.190 1.00 0.00 H new ATOM 0 HD11 LEU A 33 0.444 -2.575 4.341 1.00 0.00 H new ATOM 0 HD12 LEU A 33 -0.128 -2.283 2.681 1.00 0.00 H new ATOM 0 HD13 LEU A 33 0.411 -0.920 3.690 1.00 0.00 H new ATOM 0 HD21 LEU A 33 -0.939 -1.914 6.273 1.00 0.00 H new ATOM 0 HD22 LEU A 33 -1.027 -0.233 5.697 1.00 0.00 H new ATOM 0 HD23 LEU A 33 -2.523 -1.141 6.024 1.00 0.00 H new ATOM 494 N LYS A 34 -4.534 -2.773 3.313 1.00 0.00 N ATOM 495 CA LYS A 34 -5.145 -4.031 3.727 1.00 0.00 C ATOM 496 C LYS A 34 -5.205 -5.016 2.564 1.00 0.00 C ATOM 497 O LYS A 34 -4.689 -6.130 2.655 1.00 0.00 O ATOM 498 CB LYS A 34 -6.554 -3.782 4.271 1.00 0.00 C ATOM 499 CG LYS A 34 -6.594 -2.798 5.428 1.00 0.00 C ATOM 500 CD LYS A 34 -7.821 -3.010 6.298 1.00 0.00 C ATOM 501 CE LYS A 34 -7.727 -2.222 7.596 1.00 0.00 C ATOM 502 NZ LYS A 34 -8.747 -2.663 8.588 1.00 0.00 N ATOM 0 H LYS A 34 -4.949 -1.943 3.737 1.00 0.00 H new ATOM 0 HA LYS A 34 -4.528 -4.464 4.515 1.00 0.00 H new ATOM 0 HB2 LYS A 34 -7.185 -3.408 3.465 1.00 0.00 H new ATOM 0 HB3 LYS A 34 -6.982 -4.730 4.596 1.00 0.00 H new ATOM 0 HG2 LYS A 34 -5.694 -2.910 6.033 1.00 0.00 H new ATOM 0 HG3 LYS A 34 -6.593 -1.779 5.041 1.00 0.00 H new ATOM 0 HD2 LYS A 34 -8.713 -2.706 5.751 1.00 0.00 H new ATOM 0 HD3 LYS A 34 -7.930 -4.071 6.522 1.00 0.00 H new ATOM 0 HE2 LYS A 34 -6.731 -2.341 8.022 1.00 0.00 H new ATOM 0 HE3 LYS A 34 -7.859 -1.160 7.387 1.00 0.00 H new ATOM 0 HZ1 LYS A 34 -8.650 -2.102 9.458 1.00 0.00 H new ATOM 0 HZ2 LYS A 34 -9.699 -2.526 8.192 1.00 0.00 H new ATOM 0 HZ3 LYS A 34 -8.605 -3.670 8.807 1.00 0.00 H new ATOM 516 N PHE A 35 -5.836 -4.598 1.472 1.00 0.00 N ATOM 517 CA PHE A 35 -5.962 -5.444 0.291 1.00 0.00 C ATOM 518 C PHE A 35 -4.600 -5.975 -0.146 1.00 0.00 C ATOM 519 O PHE A 35 -4.430 -7.175 -0.363 1.00 0.00 O ATOM 520 CB PHE A 35 -6.609 -4.663 -0.855 1.00 0.00 C ATOM 521 CG PHE A 35 -6.591 -5.396 -2.165 1.00 0.00 C ATOM 522 CD1 PHE A 35 -5.510 -5.280 -3.025 1.00 0.00 C ATOM 523 CD2 PHE A 35 -7.654 -6.203 -2.538 1.00 0.00 C ATOM 524 CE1 PHE A 35 -5.492 -5.953 -4.232 1.00 0.00 C ATOM 525 CE2 PHE A 35 -7.641 -6.879 -3.743 1.00 0.00 C ATOM 526 CZ PHE A 35 -6.558 -6.755 -4.591 1.00 0.00 C ATOM 0 H PHE A 35 -6.268 -3.679 1.380 1.00 0.00 H new ATOM 0 HA PHE A 35 -6.597 -6.292 0.548 1.00 0.00 H new ATOM 0 HB2 PHE A 35 -7.641 -4.434 -0.590 1.00 0.00 H new ATOM 0 HB3 PHE A 35 -6.091 -3.711 -0.973 1.00 0.00 H new ATOM 0 HD1 PHE A 35 -4.672 -4.657 -2.749 1.00 0.00 H new ATOM 0 HD2 PHE A 35 -8.503 -6.305 -1.879 1.00 0.00 H new ATOM 0 HE1 PHE A 35 -4.645 -5.852 -4.894 1.00 0.00 H new ATOM 0 HE2 PHE A 35 -8.477 -7.504 -4.021 1.00 0.00 H new ATOM 0 HZ PHE A 35 -6.545 -7.284 -5.533 1.00 0.00 H new ATOM 536 N LEU A 36 -3.633 -5.073 -0.272 1.00 0.00 N ATOM 537 CA LEU A 36 -2.285 -5.450 -0.684 1.00 0.00 C ATOM 538 C LEU A 36 -1.796 -6.664 0.099 1.00 0.00 C ATOM 539 O LEU A 36 -1.456 -7.693 -0.483 1.00 0.00 O ATOM 540 CB LEU A 36 -1.323 -4.277 -0.482 1.00 0.00 C ATOM 541 CG LEU A 36 -1.680 -2.983 -1.213 1.00 0.00 C ATOM 542 CD1 LEU A 36 -0.808 -1.836 -0.726 1.00 0.00 C ATOM 543 CD2 LEU A 36 -1.535 -3.163 -2.717 1.00 0.00 C ATOM 0 H LEU A 36 -3.757 -4.076 -0.095 1.00 0.00 H new ATOM 0 HA LEU A 36 -2.314 -5.711 -1.742 1.00 0.00 H new ATOM 0 HB2 LEU A 36 -1.262 -4.063 0.585 1.00 0.00 H new ATOM 0 HB3 LEU A 36 -0.329 -4.589 -0.802 1.00 0.00 H new ATOM 0 HG LEU A 36 -2.720 -2.740 -0.994 1.00 0.00 H new ATOM 0 HD11 LEU A 36 -1.077 -0.923 -1.258 1.00 0.00 H new ATOM 0 HD12 LEU A 36 -0.961 -1.691 0.343 1.00 0.00 H new ATOM 0 HD13 LEU A 36 0.240 -2.070 -0.914 1.00 0.00 H new ATOM 0 HD21 LEU A 36 -1.793 -2.232 -3.221 1.00 0.00 H new ATOM 0 HD22 LEU A 36 -0.505 -3.431 -2.954 1.00 0.00 H new ATOM 0 HD23 LEU A 36 -2.203 -3.956 -3.055 1.00 0.00 H new ATOM 555 N GLU A 37 -1.766 -6.536 1.422 1.00 0.00 N ATOM 556 CA GLU A 37 -1.321 -7.625 2.284 1.00 0.00 C ATOM 557 C GLU A 37 -1.884 -8.961 1.809 1.00 0.00 C ATOM 558 O GLU A 37 -1.153 -9.942 1.673 1.00 0.00 O ATOM 559 CB GLU A 37 -1.745 -7.365 3.731 1.00 0.00 C ATOM 560 CG GLU A 37 -1.161 -6.090 4.317 1.00 0.00 C ATOM 561 CD GLU A 37 -1.744 -5.752 5.675 1.00 0.00 C ATOM 562 OE1 GLU A 37 -2.778 -5.053 5.719 1.00 0.00 O ATOM 563 OE2 GLU A 37 -1.168 -6.186 6.694 1.00 0.00 O ATOM 0 H GLU A 37 -2.044 -5.690 1.920 1.00 0.00 H new ATOM 0 HA GLU A 37 -0.233 -7.672 2.234 1.00 0.00 H new ATOM 0 HB2 GLU A 37 -2.833 -7.311 3.778 1.00 0.00 H new ATOM 0 HB3 GLU A 37 -1.441 -8.211 4.347 1.00 0.00 H new ATOM 0 HG2 GLU A 37 -0.080 -6.198 4.406 1.00 0.00 H new ATOM 0 HG3 GLU A 37 -1.343 -5.263 3.631 1.00 0.00 H new ATOM 570 N SER A 38 -3.190 -8.990 1.560 1.00 0.00 N ATOM 571 CA SER A 38 -3.853 -10.206 1.104 1.00 0.00 C ATOM 572 C SER A 38 -3.177 -10.758 -0.147 1.00 0.00 C ATOM 573 O SER A 38 -2.948 -11.962 -0.262 1.00 0.00 O ATOM 574 CB SER A 38 -5.331 -9.930 0.820 1.00 0.00 C ATOM 575 OG SER A 38 -6.068 -9.810 2.024 1.00 0.00 O ATOM 0 H SER A 38 -3.809 -8.186 1.666 1.00 0.00 H new ATOM 0 HA SER A 38 -3.775 -10.951 1.896 1.00 0.00 H new ATOM 0 HB2 SER A 38 -5.428 -9.014 0.238 1.00 0.00 H new ATOM 0 HB3 SER A 38 -5.745 -10.737 0.215 1.00 0.00 H new ATOM 0 HG SER A 38 -7.009 -9.632 1.815 1.00 0.00 H new ATOM 581 N GLU A 39 -2.861 -9.868 -1.083 1.00 0.00 N ATOM 582 CA GLU A 39 -2.213 -10.266 -2.327 1.00 0.00 C ATOM 583 C GLU A 39 -0.695 -10.288 -2.166 1.00 0.00 C ATOM 584 O GLU A 39 0.043 -10.353 -3.149 1.00 0.00 O ATOM 585 CB GLU A 39 -2.603 -9.314 -3.459 1.00 0.00 C ATOM 586 CG GLU A 39 -2.231 -7.865 -3.191 1.00 0.00 C ATOM 587 CD GLU A 39 -2.287 -7.008 -4.440 1.00 0.00 C ATOM 588 OE1 GLU A 39 -2.149 -7.566 -5.549 1.00 0.00 O ATOM 589 OE2 GLU A 39 -2.467 -5.779 -4.310 1.00 0.00 O ATOM 0 H GLU A 39 -3.043 -8.868 -1.003 1.00 0.00 H new ATOM 0 HA GLU A 39 -2.550 -11.272 -2.577 1.00 0.00 H new ATOM 0 HB2 GLU A 39 -2.119 -9.640 -4.380 1.00 0.00 H new ATOM 0 HB3 GLU A 39 -3.679 -9.380 -3.623 1.00 0.00 H new ATOM 0 HG2 GLU A 39 -2.907 -7.453 -2.442 1.00 0.00 H new ATOM 0 HG3 GLU A 39 -1.226 -7.823 -2.771 1.00 0.00 H new ATOM 596 N PHE A 40 -0.237 -10.232 -0.920 1.00 0.00 N ATOM 597 CA PHE A 40 1.192 -10.244 -0.629 1.00 0.00 C ATOM 598 C PHE A 40 1.919 -9.168 -1.432 1.00 0.00 C ATOM 599 O PHE A 40 3.027 -9.387 -1.921 1.00 0.00 O ATOM 600 CB PHE A 40 1.786 -11.618 -0.942 1.00 0.00 C ATOM 601 CG PHE A 40 0.899 -12.761 -0.537 1.00 0.00 C ATOM 602 CD1 PHE A 40 0.986 -13.307 0.733 1.00 0.00 C ATOM 603 CD2 PHE A 40 -0.021 -13.289 -1.428 1.00 0.00 C ATOM 604 CE1 PHE A 40 0.171 -14.358 1.109 1.00 0.00 C ATOM 605 CE2 PHE A 40 -0.839 -14.340 -1.058 1.00 0.00 C ATOM 606 CZ PHE A 40 -0.742 -14.876 0.211 1.00 0.00 C ATOM 0 H PHE A 40 -0.835 -10.178 -0.095 1.00 0.00 H new ATOM 0 HA PHE A 40 1.324 -10.032 0.432 1.00 0.00 H new ATOM 0 HB2 PHE A 40 1.985 -11.684 -2.012 1.00 0.00 H new ATOM 0 HB3 PHE A 40 2.745 -11.715 -0.433 1.00 0.00 H new ATOM 0 HD1 PHE A 40 1.699 -12.907 1.438 1.00 0.00 H new ATOM 0 HD2 PHE A 40 -0.100 -12.875 -2.422 1.00 0.00 H new ATOM 0 HE1 PHE A 40 0.248 -14.773 2.103 1.00 0.00 H new ATOM 0 HE2 PHE A 40 -1.554 -14.742 -1.761 1.00 0.00 H new ATOM 0 HZ PHE A 40 -1.379 -15.699 0.501 1.00 0.00 H new ATOM 616 N SER A 41 1.286 -8.007 -1.562 1.00 0.00 N ATOM 617 CA SER A 41 1.869 -6.898 -2.309 1.00 0.00 C ATOM 618 C SER A 41 2.230 -5.746 -1.377 1.00 0.00 C ATOM 619 O SER A 41 3.050 -4.892 -1.715 1.00 0.00 O ATOM 620 CB SER A 41 0.897 -6.413 -3.386 1.00 0.00 C ATOM 621 OG SER A 41 0.593 -7.450 -4.303 1.00 0.00 O ATOM 0 H SER A 41 0.370 -7.809 -1.160 1.00 0.00 H new ATOM 0 HA SER A 41 2.781 -7.255 -2.788 1.00 0.00 H new ATOM 0 HB2 SER A 41 -0.021 -6.056 -2.918 1.00 0.00 H new ATOM 0 HB3 SER A 41 1.332 -5.568 -3.919 1.00 0.00 H new ATOM 0 HG SER A 41 0.399 -7.063 -5.182 1.00 0.00 H new ATOM 627 N SER A 42 1.611 -5.728 -0.201 1.00 0.00 N ATOM 628 CA SER A 42 1.863 -4.679 0.780 1.00 0.00 C ATOM 629 C SER A 42 3.343 -4.311 0.814 1.00 0.00 C ATOM 630 O SER A 42 3.699 -3.133 0.845 1.00 0.00 O ATOM 631 CB SER A 42 1.406 -5.130 2.169 1.00 0.00 C ATOM 632 OG SER A 42 2.094 -4.423 3.187 1.00 0.00 O ATOM 0 H SER A 42 0.931 -6.428 0.096 1.00 0.00 H new ATOM 0 HA SER A 42 1.294 -3.797 0.486 1.00 0.00 H new ATOM 0 HB2 SER A 42 0.333 -4.969 2.272 1.00 0.00 H new ATOM 0 HB3 SER A 42 1.581 -6.200 2.283 1.00 0.00 H new ATOM 0 HG SER A 42 1.783 -4.728 4.065 1.00 0.00 H new ATOM 638 N GLU A 43 4.199 -5.327 0.807 1.00 0.00 N ATOM 639 CA GLU A 43 5.641 -5.110 0.838 1.00 0.00 C ATOM 640 C GLU A 43 6.030 -3.916 -0.029 1.00 0.00 C ATOM 641 O GLU A 43 6.842 -3.083 0.372 1.00 0.00 O ATOM 642 CB GLU A 43 6.378 -6.363 0.360 1.00 0.00 C ATOM 643 CG GLU A 43 6.024 -6.773 -1.060 1.00 0.00 C ATOM 644 CD GLU A 43 6.224 -8.255 -1.307 1.00 0.00 C ATOM 645 OE1 GLU A 43 6.055 -9.043 -0.352 1.00 0.00 O ATOM 646 OE2 GLU A 43 6.549 -8.628 -2.453 1.00 0.00 O ATOM 0 H GLU A 43 3.920 -6.308 0.780 1.00 0.00 H new ATOM 0 HA GLU A 43 5.929 -4.899 1.868 1.00 0.00 H new ATOM 0 HB2 GLU A 43 7.452 -6.188 0.422 1.00 0.00 H new ATOM 0 HB3 GLU A 43 6.150 -7.188 1.035 1.00 0.00 H new ATOM 0 HG2 GLU A 43 4.985 -6.512 -1.261 1.00 0.00 H new ATOM 0 HG3 GLU A 43 6.636 -6.206 -1.761 1.00 0.00 H new ATOM 653 N ASN A 44 5.445 -3.842 -1.220 1.00 0.00 N ATOM 654 CA ASN A 44 5.731 -2.751 -2.145 1.00 0.00 C ATOM 655 C ASN A 44 5.432 -1.400 -1.502 1.00 0.00 C ATOM 656 O ASN A 44 6.300 -0.529 -1.428 1.00 0.00 O ATOM 657 CB ASN A 44 4.909 -2.912 -3.425 1.00 0.00 C ATOM 658 CG ASN A 44 5.341 -4.115 -4.242 1.00 0.00 C ATOM 659 OD1 ASN A 44 6.230 -4.865 -3.840 1.00 0.00 O ATOM 660 ND2 ASN A 44 4.710 -4.304 -5.395 1.00 0.00 N ATOM 0 H ASN A 44 4.771 -4.524 -1.567 1.00 0.00 H new ATOM 0 HA ASN A 44 6.791 -2.788 -2.395 1.00 0.00 H new ATOM 0 HB2 ASN A 44 3.855 -3.011 -3.166 1.00 0.00 H new ATOM 0 HB3 ASN A 44 5.005 -2.011 -4.031 1.00 0.00 H new ATOM 0 HD21 ASN A 44 4.956 -5.097 -5.987 1.00 0.00 H new ATOM 0 HD22 ASN A 44 3.979 -3.656 -5.688 1.00 0.00 H new ATOM 667 N LEU A 45 4.199 -1.232 -1.037 1.00 0.00 N ATOM 668 CA LEU A 45 3.784 0.012 -0.399 1.00 0.00 C ATOM 669 C LEU A 45 4.623 0.293 0.843 1.00 0.00 C ATOM 670 O LEU A 45 5.292 1.323 0.933 1.00 0.00 O ATOM 671 CB LEU A 45 2.302 -0.053 -0.024 1.00 0.00 C ATOM 672 CG LEU A 45 1.704 1.222 0.573 1.00 0.00 C ATOM 673 CD1 LEU A 45 1.645 2.324 -0.472 1.00 0.00 C ATOM 674 CD2 LEU A 45 0.319 0.946 1.140 1.00 0.00 C ATOM 0 H LEU A 45 3.469 -1.942 -1.090 1.00 0.00 H new ATOM 0 HA LEU A 45 3.937 0.824 -1.110 1.00 0.00 H new ATOM 0 HB2 LEU A 45 1.733 -0.314 -0.916 1.00 0.00 H new ATOM 0 HB3 LEU A 45 2.164 -0.864 0.691 1.00 0.00 H new ATOM 0 HG LEU A 45 2.348 1.556 1.387 1.00 0.00 H new ATOM 0 HD11 LEU A 45 1.217 3.223 -0.029 1.00 0.00 H new ATOM 0 HD12 LEU A 45 2.652 2.540 -0.830 1.00 0.00 H new ATOM 0 HD13 LEU A 45 1.024 2.000 -1.307 1.00 0.00 H new ATOM 0 HD21 LEU A 45 -0.092 1.864 1.561 1.00 0.00 H new ATOM 0 HD22 LEU A 45 -0.335 0.587 0.345 1.00 0.00 H new ATOM 0 HD23 LEU A 45 0.390 0.189 1.921 1.00 0.00 H new ATOM 686 N ARG A 46 4.583 -0.630 1.799 1.00 0.00 N ATOM 687 CA ARG A 46 5.341 -0.483 3.036 1.00 0.00 C ATOM 688 C ARG A 46 6.671 0.218 2.778 1.00 0.00 C ATOM 689 O ARG A 46 7.022 1.179 3.464 1.00 0.00 O ATOM 690 CB ARG A 46 5.588 -1.851 3.674 1.00 0.00 C ATOM 691 CG ARG A 46 4.323 -2.522 4.184 1.00 0.00 C ATOM 692 CD ARG A 46 4.609 -3.409 5.386 1.00 0.00 C ATOM 693 NE ARG A 46 4.711 -2.640 6.623 1.00 0.00 N ATOM 694 CZ ARG A 46 3.695 -2.451 7.457 1.00 0.00 C ATOM 695 NH1 ARG A 46 2.507 -2.974 7.188 1.00 0.00 N ATOM 696 NH2 ARG A 46 3.866 -1.739 8.563 1.00 0.00 N ATOM 0 H ARG A 46 4.034 -1.487 1.740 1.00 0.00 H new ATOM 0 HA ARG A 46 4.755 0.129 3.722 1.00 0.00 H new ATOM 0 HB2 ARG A 46 6.065 -2.503 2.942 1.00 0.00 H new ATOM 0 HB3 ARG A 46 6.287 -1.735 4.502 1.00 0.00 H new ATOM 0 HG2 ARG A 46 3.591 -1.762 4.457 1.00 0.00 H new ATOM 0 HG3 ARG A 46 3.880 -3.119 3.387 1.00 0.00 H new ATOM 0 HD2 ARG A 46 3.817 -4.151 5.485 1.00 0.00 H new ATOM 0 HD3 ARG A 46 5.538 -3.954 5.221 1.00 0.00 H new ATOM 0 HE ARG A 46 5.612 -2.225 6.860 1.00 0.00 H new ATOM 0 HH11 ARG A 46 2.372 -3.523 6.339 1.00 0.00 H new ATOM 0 HH12 ARG A 46 1.728 -2.828 7.830 1.00 0.00 H new ATOM 0 HH21 ARG A 46 4.779 -1.336 8.774 1.00 0.00 H new ATOM 0 HH22 ARG A 46 3.085 -1.595 9.203 1.00 0.00 H new ATOM 710 N PHE A 47 7.409 -0.269 1.786 1.00 0.00 N ATOM 711 CA PHE A 47 8.701 0.309 1.438 1.00 0.00 C ATOM 712 C PHE A 47 8.542 1.750 0.961 1.00 0.00 C ATOM 713 O PHE A 47 9.331 2.624 1.320 1.00 0.00 O ATOM 714 CB PHE A 47 9.383 -0.527 0.353 1.00 0.00 C ATOM 715 CG PHE A 47 10.605 0.125 -0.227 1.00 0.00 C ATOM 716 CD1 PHE A 47 11.676 0.465 0.584 1.00 0.00 C ATOM 717 CD2 PHE A 47 10.684 0.397 -1.583 1.00 0.00 C ATOM 718 CE1 PHE A 47 12.802 1.066 0.052 1.00 0.00 C ATOM 719 CE2 PHE A 47 11.807 0.998 -2.120 1.00 0.00 C ATOM 720 CZ PHE A 47 12.868 1.331 -1.301 1.00 0.00 C ATOM 0 H PHE A 47 7.134 -1.063 1.209 1.00 0.00 H new ATOM 0 HA PHE A 47 9.324 0.308 2.333 1.00 0.00 H new ATOM 0 HB2 PHE A 47 9.661 -1.494 0.772 1.00 0.00 H new ATOM 0 HB3 PHE A 47 8.669 -0.720 -0.448 1.00 0.00 H new ATOM 0 HD1 PHE A 47 11.631 0.258 1.643 1.00 0.00 H new ATOM 0 HD2 PHE A 47 9.858 0.136 -2.228 1.00 0.00 H new ATOM 0 HE1 PHE A 47 13.629 1.328 0.695 1.00 0.00 H new ATOM 0 HE2 PHE A 47 11.855 1.207 -3.179 1.00 0.00 H new ATOM 0 HZ PHE A 47 13.748 1.798 -1.718 1.00 0.00 H new ATOM 730 N TRP A 48 7.518 1.988 0.151 1.00 0.00 N ATOM 731 CA TRP A 48 7.255 3.322 -0.377 1.00 0.00 C ATOM 732 C TRP A 48 7.013 4.316 0.754 1.00 0.00 C ATOM 733 O TRP A 48 7.694 5.338 0.852 1.00 0.00 O ATOM 734 CB TRP A 48 6.047 3.293 -1.315 1.00 0.00 C ATOM 735 CG TRP A 48 5.885 4.551 -2.113 1.00 0.00 C ATOM 736 CD1 TRP A 48 6.629 4.940 -3.191 1.00 0.00 C ATOM 737 CD2 TRP A 48 4.919 5.586 -1.896 1.00 0.00 C ATOM 738 NE1 TRP A 48 6.184 6.154 -3.656 1.00 0.00 N ATOM 739 CE2 TRP A 48 5.136 6.571 -2.880 1.00 0.00 C ATOM 740 CE3 TRP A 48 3.892 5.775 -0.968 1.00 0.00 C ATOM 741 CZ2 TRP A 48 4.363 7.726 -2.958 1.00 0.00 C ATOM 742 CZ3 TRP A 48 3.126 6.922 -1.047 1.00 0.00 C ATOM 743 CH2 TRP A 48 3.364 7.885 -2.037 1.00 0.00 C ATOM 0 H TRP A 48 6.856 1.275 -0.155 1.00 0.00 H new ATOM 0 HA TRP A 48 8.133 3.644 -0.937 1.00 0.00 H new ATOM 0 HB2 TRP A 48 6.146 2.449 -1.997 1.00 0.00 H new ATOM 0 HB3 TRP A 48 5.144 3.125 -0.728 1.00 0.00 H new ATOM 0 HD1 TRP A 48 7.447 4.376 -3.615 1.00 0.00 H new ATOM 0 HE1 TRP A 48 6.572 6.662 -4.451 1.00 0.00 H new ATOM 0 HE3 TRP A 48 3.700 5.038 -0.203 1.00 0.00 H new ATOM 0 HZ2 TRP A 48 4.546 8.470 -3.719 1.00 0.00 H new ATOM 0 HZ3 TRP A 48 2.330 7.079 -0.334 1.00 0.00 H new ATOM 0 HH2 TRP A 48 2.746 8.770 -2.074 1.00 0.00 H new ATOM 754 N LEU A 49 6.040 4.012 1.605 1.00 0.00 N ATOM 755 CA LEU A 49 5.708 4.880 2.730 1.00 0.00 C ATOM 756 C LEU A 49 6.915 5.073 3.643 1.00 0.00 C ATOM 757 O LEU A 49 7.216 6.190 4.062 1.00 0.00 O ATOM 758 CB LEU A 49 4.541 4.292 3.526 1.00 0.00 C ATOM 759 CG LEU A 49 3.252 4.043 2.741 1.00 0.00 C ATOM 760 CD1 LEU A 49 2.232 3.320 3.607 1.00 0.00 C ATOM 761 CD2 LEU A 49 2.681 5.354 2.222 1.00 0.00 C ATOM 0 H LEU A 49 5.467 3.171 1.538 1.00 0.00 H new ATOM 0 HA LEU A 49 5.416 5.852 2.333 1.00 0.00 H new ATOM 0 HB2 LEU A 49 4.865 3.348 3.963 1.00 0.00 H new ATOM 0 HB3 LEU A 49 4.315 4.965 4.353 1.00 0.00 H new ATOM 0 HG LEU A 49 3.487 3.409 1.886 1.00 0.00 H new ATOM 0 HD11 LEU A 49 1.321 3.151 3.032 1.00 0.00 H new ATOM 0 HD12 LEU A 49 2.641 2.362 3.928 1.00 0.00 H new ATOM 0 HD13 LEU A 49 2.001 3.928 4.482 1.00 0.00 H new ATOM 0 HD21 LEU A 49 1.764 5.157 1.666 1.00 0.00 H new ATOM 0 HD22 LEU A 49 2.461 6.013 3.062 1.00 0.00 H new ATOM 0 HD23 LEU A 49 3.408 5.833 1.565 1.00 0.00 H new ATOM 773 N ALA A 50 7.603 3.977 3.945 1.00 0.00 N ATOM 774 CA ALA A 50 8.779 4.026 4.805 1.00 0.00 C ATOM 775 C ALA A 50 9.717 5.154 4.388 1.00 0.00 C ATOM 776 O ALA A 50 10.255 5.872 5.231 1.00 0.00 O ATOM 777 CB ALA A 50 9.510 2.692 4.776 1.00 0.00 C ATOM 0 H ALA A 50 7.366 3.044 3.607 1.00 0.00 H new ATOM 0 HA ALA A 50 8.446 4.223 5.824 1.00 0.00 H new ATOM 0 HB1 ALA A 50 10.386 2.743 5.423 1.00 0.00 H new ATOM 0 HB2 ALA A 50 8.844 1.904 5.129 1.00 0.00 H new ATOM 0 HB3 ALA A 50 9.824 2.471 3.756 1.00 0.00 H new ATOM 783 N VAL A 51 9.910 5.305 3.081 1.00 0.00 N ATOM 784 CA VAL A 51 10.782 6.346 2.552 1.00 0.00 C ATOM 785 C VAL A 51 10.216 7.733 2.834 1.00 0.00 C ATOM 786 O VAL A 51 10.930 8.623 3.295 1.00 0.00 O ATOM 787 CB VAL A 51 10.990 6.187 1.034 1.00 0.00 C ATOM 788 CG1 VAL A 51 11.863 7.309 0.494 1.00 0.00 C ATOM 789 CG2 VAL A 51 11.597 4.828 0.719 1.00 0.00 C ATOM 0 H VAL A 51 9.474 4.719 2.369 1.00 0.00 H new ATOM 0 HA VAL A 51 11.743 6.240 3.056 1.00 0.00 H new ATOM 0 HB VAL A 51 10.019 6.248 0.543 1.00 0.00 H new ATOM 0 HG11 VAL A 51 11.999 7.180 -0.580 1.00 0.00 H new ATOM 0 HG12 VAL A 51 11.383 8.268 0.686 1.00 0.00 H new ATOM 0 HG13 VAL A 51 12.834 7.284 0.988 1.00 0.00 H new ATOM 0 HG21 VAL A 51 11.737 4.733 -0.358 1.00 0.00 H new ATOM 0 HG22 VAL A 51 12.561 4.735 1.220 1.00 0.00 H new ATOM 0 HG23 VAL A 51 10.929 4.041 1.069 1.00 0.00 H new ATOM 799 N GLU A 52 8.929 7.909 2.554 1.00 0.00 N ATOM 800 CA GLU A 52 8.267 9.189 2.778 1.00 0.00 C ATOM 801 C GLU A 52 8.452 9.653 4.220 1.00 0.00 C ATOM 802 O GLU A 52 8.836 10.795 4.472 1.00 0.00 O ATOM 803 CB GLU A 52 6.776 9.082 2.453 1.00 0.00 C ATOM 804 CG GLU A 52 6.461 9.252 0.976 1.00 0.00 C ATOM 805 CD GLU A 52 6.453 10.706 0.546 1.00 0.00 C ATOM 806 OE1 GLU A 52 5.957 11.552 1.319 1.00 0.00 O ATOM 807 OE2 GLU A 52 6.943 10.998 -0.565 1.00 0.00 O ATOM 0 H GLU A 52 8.324 7.182 2.172 1.00 0.00 H new ATOM 0 HA GLU A 52 8.724 9.925 2.116 1.00 0.00 H new ATOM 0 HB2 GLU A 52 6.409 8.111 2.785 1.00 0.00 H new ATOM 0 HB3 GLU A 52 6.234 9.838 3.021 1.00 0.00 H new ATOM 0 HG2 GLU A 52 7.197 8.706 0.386 1.00 0.00 H new ATOM 0 HG3 GLU A 52 5.489 8.808 0.762 1.00 0.00 H new ATOM 814 N ASP A 53 8.175 8.758 5.163 1.00 0.00 N ATOM 815 CA ASP A 53 8.311 9.074 6.580 1.00 0.00 C ATOM 816 C ASP A 53 9.781 9.178 6.975 1.00 0.00 C ATOM 817 O ASP A 53 10.166 10.054 7.751 1.00 0.00 O ATOM 818 CB ASP A 53 7.615 8.010 7.430 1.00 0.00 C ATOM 819 CG ASP A 53 7.812 8.236 8.916 1.00 0.00 C ATOM 820 OD1 ASP A 53 8.067 9.393 9.311 1.00 0.00 O ATOM 821 OD2 ASP A 53 7.713 7.256 9.684 1.00 0.00 O ATOM 0 H ASP A 53 7.855 7.809 4.971 1.00 0.00 H new ATOM 0 HA ASP A 53 7.837 10.039 6.760 1.00 0.00 H new ATOM 0 HB2 ASP A 53 6.549 8.009 7.204 1.00 0.00 H new ATOM 0 HB3 ASP A 53 7.999 7.026 7.161 1.00 0.00 H new ATOM 826 N LEU A 54 10.597 8.278 6.438 1.00 0.00 N ATOM 827 CA LEU A 54 12.025 8.267 6.735 1.00 0.00 C ATOM 828 C LEU A 54 12.573 9.688 6.828 1.00 0.00 C ATOM 829 O LEU A 54 13.344 10.010 7.733 1.00 0.00 O ATOM 830 CB LEU A 54 12.784 7.486 5.661 1.00 0.00 C ATOM 831 CG LEU A 54 14.287 7.751 5.574 1.00 0.00 C ATOM 832 CD1 LEU A 54 14.974 7.360 6.873 1.00 0.00 C ATOM 833 CD2 LEU A 54 14.895 6.998 4.399 1.00 0.00 C ATOM 0 H LEU A 54 10.294 7.547 5.795 1.00 0.00 H new ATOM 0 HA LEU A 54 12.166 7.778 7.699 1.00 0.00 H new ATOM 0 HB2 LEU A 54 12.633 6.421 5.840 1.00 0.00 H new ATOM 0 HB3 LEU A 54 12.339 7.713 4.692 1.00 0.00 H new ATOM 0 HG LEU A 54 14.439 8.818 5.413 1.00 0.00 H new ATOM 0 HD11 LEU A 54 16.043 7.556 6.792 1.00 0.00 H new ATOM 0 HD12 LEU A 54 14.559 7.944 7.694 1.00 0.00 H new ATOM 0 HD13 LEU A 54 14.813 6.299 7.065 1.00 0.00 H new ATOM 0 HD21 LEU A 54 15.965 7.199 4.353 1.00 0.00 H new ATOM 0 HD22 LEU A 54 14.732 5.928 4.529 1.00 0.00 H new ATOM 0 HD23 LEU A 54 14.424 7.327 3.473 1.00 0.00 H new ATOM 845 N LYS A 55 12.167 10.536 5.889 1.00 0.00 N ATOM 846 CA LYS A 55 12.614 11.924 5.866 1.00 0.00 C ATOM 847 C LYS A 55 12.190 12.652 7.138 1.00 0.00 C ATOM 848 O LYS A 55 13.006 13.299 7.796 1.00 0.00 O ATOM 849 CB LYS A 55 12.046 12.643 4.640 1.00 0.00 C ATOM 850 CG LYS A 55 12.370 11.954 3.326 1.00 0.00 C ATOM 851 CD LYS A 55 11.304 12.224 2.278 1.00 0.00 C ATOM 852 CE LYS A 55 11.207 11.084 1.275 1.00 0.00 C ATOM 853 NZ LYS A 55 10.328 11.431 0.124 1.00 0.00 N ATOM 0 H LYS A 55 11.529 10.286 5.134 1.00 0.00 H new ATOM 0 HA LYS A 55 13.703 11.929 5.811 1.00 0.00 H new ATOM 0 HB2 LYS A 55 10.964 12.719 4.743 1.00 0.00 H new ATOM 0 HB3 LYS A 55 12.436 13.660 4.613 1.00 0.00 H new ATOM 0 HG2 LYS A 55 13.337 12.301 2.961 1.00 0.00 H new ATOM 0 HG3 LYS A 55 12.458 10.880 3.489 1.00 0.00 H new ATOM 0 HD2 LYS A 55 10.339 12.364 2.766 1.00 0.00 H new ATOM 0 HD3 LYS A 55 11.534 13.152 1.755 1.00 0.00 H new ATOM 0 HE2 LYS A 55 12.203 10.836 0.909 1.00 0.00 H new ATOM 0 HE3 LYS A 55 10.820 10.195 1.772 1.00 0.00 H new ATOM 0 HZ1 LYS A 55 10.355 10.663 -0.577 1.00 0.00 H new ATOM 0 HZ2 LYS A 55 9.352 11.560 0.459 1.00 0.00 H new ATOM 0 HZ3 LYS A 55 10.663 12.313 -0.315 1.00 0.00 H new ATOM 867 N LYS A 56 10.911 12.542 7.479 1.00 0.00 N ATOM 868 CA LYS A 56 10.379 13.188 8.674 1.00 0.00 C ATOM 869 C LYS A 56 11.181 12.791 9.909 1.00 0.00 C ATOM 870 O LYS A 56 11.441 13.617 10.784 1.00 0.00 O ATOM 871 CB LYS A 56 8.907 12.816 8.867 1.00 0.00 C ATOM 872 CG LYS A 56 8.010 13.274 7.729 1.00 0.00 C ATOM 873 CD LYS A 56 7.526 14.698 7.940 1.00 0.00 C ATOM 874 CE LYS A 56 6.275 14.740 8.804 1.00 0.00 C ATOM 875 NZ LYS A 56 6.079 16.076 9.431 1.00 0.00 N ATOM 0 H LYS A 56 10.223 12.011 6.945 1.00 0.00 H new ATOM 0 HA LYS A 56 10.460 14.267 8.541 1.00 0.00 H new ATOM 0 HB2 LYS A 56 8.825 11.734 8.971 1.00 0.00 H new ATOM 0 HB3 LYS A 56 8.549 13.253 9.799 1.00 0.00 H new ATOM 0 HG2 LYS A 56 8.554 13.210 6.787 1.00 0.00 H new ATOM 0 HG3 LYS A 56 7.153 12.605 7.648 1.00 0.00 H new ATOM 0 HD2 LYS A 56 8.314 15.285 8.411 1.00 0.00 H new ATOM 0 HD3 LYS A 56 7.318 15.159 6.975 1.00 0.00 H new ATOM 0 HE2 LYS A 56 5.405 14.493 8.196 1.00 0.00 H new ATOM 0 HE3 LYS A 56 6.346 13.980 9.582 1.00 0.00 H new ATOM 0 HZ1 LYS A 56 5.216 16.064 10.012 1.00 0.00 H new ATOM 0 HZ2 LYS A 56 6.898 16.301 10.032 1.00 0.00 H new ATOM 0 HZ3 LYS A 56 5.986 16.798 8.688 1.00 0.00 H new ATOM 889 N ARG A 57 11.571 11.522 9.974 1.00 0.00 N ATOM 890 CA ARG A 57 12.343 11.016 11.102 1.00 0.00 C ATOM 891 C ARG A 57 13.570 11.888 11.355 1.00 0.00 C ATOM 892 O ARG A 57 14.177 12.431 10.432 1.00 0.00 O ATOM 893 CB ARG A 57 12.775 9.571 10.846 1.00 0.00 C ATOM 894 CG ARG A 57 11.630 8.574 10.910 1.00 0.00 C ATOM 895 CD ARG A 57 11.183 8.329 12.343 1.00 0.00 C ATOM 896 NE ARG A 57 10.319 7.157 12.454 1.00 0.00 N ATOM 897 CZ ARG A 57 10.013 6.577 13.609 1.00 0.00 C ATOM 898 NH1 ARG A 57 10.498 7.058 14.746 1.00 0.00 N ATOM 899 NH2 ARG A 57 9.219 5.514 13.630 1.00 0.00 N ATOM 0 H ARG A 57 11.365 10.825 9.258 1.00 0.00 H new ATOM 0 HA ARG A 57 11.708 11.046 11.987 1.00 0.00 H new ATOM 0 HB2 ARG A 57 13.245 9.509 9.864 1.00 0.00 H new ATOM 0 HB3 ARG A 57 13.531 9.291 11.580 1.00 0.00 H new ATOM 0 HG2 ARG A 57 10.789 8.946 10.324 1.00 0.00 H new ATOM 0 HG3 ARG A 57 11.941 7.632 10.459 1.00 0.00 H new ATOM 0 HD2 ARG A 57 12.059 8.195 12.978 1.00 0.00 H new ATOM 0 HD3 ARG A 57 10.653 9.207 12.712 1.00 0.00 H new ATOM 0 HE ARG A 57 9.929 6.762 11.598 1.00 0.00 H new ATOM 0 HH11 ARG A 57 11.108 7.876 14.735 1.00 0.00 H new ATOM 0 HH12 ARG A 57 10.261 6.610 15.631 1.00 0.00 H new ATOM 0 HH21 ARG A 57 8.843 5.141 12.758 1.00 0.00 H new ATOM 0 HH22 ARG A 57 8.985 5.070 14.518 1.00 0.00 H new ATOM 913 N PRO A 58 13.945 12.025 12.636 1.00 0.00 N ATOM 914 CA PRO A 58 15.102 12.829 13.040 1.00 0.00 C ATOM 915 C PRO A 58 16.424 12.195 12.619 1.00 0.00 C ATOM 916 O PRO A 58 16.488 10.996 12.344 1.00 0.00 O ATOM 917 CB PRO A 58 14.991 12.869 14.566 1.00 0.00 C ATOM 918 CG PRO A 58 14.226 11.641 14.922 1.00 0.00 C ATOM 919 CD PRO A 58 13.268 11.405 13.787 1.00 0.00 C ATOM 0 HA PRO A 58 15.097 13.814 12.572 1.00 0.00 H new ATOM 0 HB2 PRO A 58 15.975 12.872 15.035 1.00 0.00 H new ATOM 0 HB3 PRO A 58 14.475 13.768 14.902 1.00 0.00 H new ATOM 0 HG2 PRO A 58 14.894 10.789 15.052 1.00 0.00 H new ATOM 0 HG3 PRO A 58 13.691 11.773 15.863 1.00 0.00 H new ATOM 0 HD2 PRO A 58 13.091 10.342 13.625 1.00 0.00 H new ATOM 0 HD3 PRO A 58 12.298 11.864 13.978 1.00 0.00 H new ATOM 927 N ILE A 59 17.475 13.007 12.570 1.00 0.00 N ATOM 928 CA ILE A 59 18.795 12.524 12.184 1.00 0.00 C ATOM 929 C ILE A 59 19.205 11.317 13.020 1.00 0.00 C ATOM 930 O ILE A 59 19.941 10.446 12.555 1.00 0.00 O ATOM 931 CB ILE A 59 19.862 13.624 12.333 1.00 0.00 C ATOM 932 CG1 ILE A 59 21.219 13.120 11.836 1.00 0.00 C ATOM 933 CG2 ILE A 59 19.957 14.077 13.782 1.00 0.00 C ATOM 934 CD1 ILE A 59 21.311 13.017 10.330 1.00 0.00 C ATOM 0 H ILE A 59 17.438 14.002 12.793 1.00 0.00 H new ATOM 0 HA ILE A 59 18.730 12.231 11.136 1.00 0.00 H new ATOM 0 HB ILE A 59 19.568 14.479 11.724 1.00 0.00 H new ATOM 0 HG12 ILE A 59 22.000 13.791 12.195 1.00 0.00 H new ATOM 0 HG13 ILE A 59 21.415 12.140 12.272 1.00 0.00 H new ATOM 0 HG21 ILE A 59 20.715 14.855 13.871 1.00 0.00 H new ATOM 0 HG22 ILE A 59 18.993 14.471 14.104 1.00 0.00 H new ATOM 0 HG23 ILE A 59 20.231 13.230 14.411 1.00 0.00 H new ATOM 0 HD11 ILE A 59 22.300 12.654 10.050 1.00 0.00 H new ATOM 0 HD12 ILE A 59 20.553 12.324 9.966 1.00 0.00 H new ATOM 0 HD13 ILE A 59 21.147 13.999 9.887 1.00 0.00 H new ATOM 946 N LYS A 60 18.722 11.269 14.257 1.00 0.00 N ATOM 947 CA LYS A 60 19.035 10.168 15.159 1.00 0.00 C ATOM 948 C LYS A 60 18.413 8.866 14.665 1.00 0.00 C ATOM 949 O LYS A 60 18.940 7.782 14.914 1.00 0.00 O ATOM 950 CB LYS A 60 18.536 10.480 16.572 1.00 0.00 C ATOM 951 CG LYS A 60 17.022 10.450 16.702 1.00 0.00 C ATOM 952 CD LYS A 60 16.577 10.810 18.109 1.00 0.00 C ATOM 953 CE LYS A 60 16.341 12.305 18.254 1.00 0.00 C ATOM 954 NZ LYS A 60 16.264 12.719 19.682 1.00 0.00 N ATOM 0 H LYS A 60 18.111 11.981 14.658 1.00 0.00 H new ATOM 0 HA LYS A 60 20.118 10.047 15.182 1.00 0.00 H new ATOM 0 HB2 LYS A 60 18.967 9.760 17.268 1.00 0.00 H new ATOM 0 HB3 LYS A 60 18.898 11.465 16.867 1.00 0.00 H new ATOM 0 HG2 LYS A 60 16.581 11.147 15.990 1.00 0.00 H new ATOM 0 HG3 LYS A 60 16.653 9.457 16.446 1.00 0.00 H new ATOM 0 HD2 LYS A 60 15.661 10.271 18.351 1.00 0.00 H new ATOM 0 HD3 LYS A 60 17.334 10.489 18.824 1.00 0.00 H new ATOM 0 HE2 LYS A 60 17.147 12.849 17.761 1.00 0.00 H new ATOM 0 HE3 LYS A 60 15.416 12.577 17.747 1.00 0.00 H new ATOM 0 HZ1 LYS A 60 16.102 13.745 19.738 1.00 0.00 H new ATOM 0 HZ2 LYS A 60 15.479 12.219 20.147 1.00 0.00 H new ATOM 0 HZ3 LYS A 60 17.157 12.483 20.161 1.00 0.00 H new ATOM 968 N GLU A 61 17.291 8.981 13.962 1.00 0.00 N ATOM 969 CA GLU A 61 16.598 7.813 13.432 1.00 0.00 C ATOM 970 C GLU A 61 16.639 7.801 11.907 1.00 0.00 C ATOM 971 O GLU A 61 15.923 7.036 11.261 1.00 0.00 O ATOM 972 CB GLU A 61 15.146 7.790 13.914 1.00 0.00 C ATOM 973 CG GLU A 61 14.969 7.158 15.284 1.00 0.00 C ATOM 974 CD GLU A 61 15.386 5.700 15.312 1.00 0.00 C ATOM 975 OE1 GLU A 61 15.346 5.052 14.245 1.00 0.00 O ATOM 976 OE2 GLU A 61 15.752 5.208 16.400 1.00 0.00 O ATOM 0 H GLU A 61 16.843 9.871 13.746 1.00 0.00 H new ATOM 0 HA GLU A 61 17.109 6.923 13.799 1.00 0.00 H new ATOM 0 HB2 GLU A 61 14.765 8.811 13.942 1.00 0.00 H new ATOM 0 HB3 GLU A 61 14.541 7.244 13.190 1.00 0.00 H new ATOM 0 HG2 GLU A 61 15.556 7.714 16.015 1.00 0.00 H new ATOM 0 HG3 GLU A 61 13.925 7.239 15.585 1.00 0.00 H new ATOM 983 N VAL A 62 17.483 8.655 11.337 1.00 0.00 N ATOM 984 CA VAL A 62 17.619 8.744 9.888 1.00 0.00 C ATOM 985 C VAL A 62 18.363 7.535 9.331 1.00 0.00 C ATOM 986 O VAL A 62 17.854 6.794 8.490 1.00 0.00 O ATOM 987 CB VAL A 62 18.361 10.027 9.471 1.00 0.00 C ATOM 988 CG1 VAL A 62 19.169 9.789 8.204 1.00 0.00 C ATOM 989 CG2 VAL A 62 17.379 11.172 9.280 1.00 0.00 C ATOM 0 H VAL A 62 18.083 9.295 11.857 1.00 0.00 H new ATOM 0 HA VAL A 62 16.610 8.768 9.476 1.00 0.00 H new ATOM 0 HB VAL A 62 19.052 10.301 10.268 1.00 0.00 H new ATOM 0 HG11 VAL A 62 19.686 10.707 7.925 1.00 0.00 H new ATOM 0 HG12 VAL A 62 19.900 9.000 8.381 1.00 0.00 H new ATOM 0 HG13 VAL A 62 18.500 9.489 7.397 1.00 0.00 H new ATOM 0 HG21 VAL A 62 17.921 12.071 8.985 1.00 0.00 H new ATOM 0 HG22 VAL A 62 16.661 10.910 8.503 1.00 0.00 H new ATOM 0 HG23 VAL A 62 16.850 11.357 10.215 1.00 0.00 H new ATOM 999 N PRO A 63 19.599 7.329 9.810 1.00 0.00 N ATOM 1000 CA PRO A 63 20.440 6.210 9.375 1.00 0.00 C ATOM 1001 C PRO A 63 19.918 4.866 9.869 1.00 0.00 C ATOM 1002 O PRO A 63 19.751 3.929 9.089 1.00 0.00 O ATOM 1003 CB PRO A 63 21.799 6.522 10.007 1.00 0.00 C ATOM 1004 CG PRO A 63 21.481 7.365 11.193 1.00 0.00 C ATOM 1005 CD PRO A 63 20.270 8.172 10.814 1.00 0.00 C ATOM 0 HA PRO A 63 20.470 6.120 8.289 1.00 0.00 H new ATOM 0 HB2 PRO A 63 22.319 5.609 10.298 1.00 0.00 H new ATOM 0 HB3 PRO A 63 22.448 7.050 9.309 1.00 0.00 H new ATOM 0 HG2 PRO A 63 21.280 6.747 12.068 1.00 0.00 H new ATOM 0 HG3 PRO A 63 22.319 8.014 11.446 1.00 0.00 H new ATOM 0 HD2 PRO A 63 19.628 8.361 11.674 1.00 0.00 H new ATOM 0 HD3 PRO A 63 20.547 9.143 10.403 1.00 0.00 H new ATOM 1013 N SER A 64 19.661 4.778 11.171 1.00 0.00 N ATOM 1014 CA SER A 64 19.161 3.546 11.770 1.00 0.00 C ATOM 1015 C SER A 64 18.075 2.921 10.900 1.00 0.00 C ATOM 1016 O SER A 64 17.978 1.699 10.791 1.00 0.00 O ATOM 1017 CB SER A 64 18.613 3.822 13.171 1.00 0.00 C ATOM 1018 OG SER A 64 19.664 4.020 14.100 1.00 0.00 O ATOM 0 H SER A 64 19.791 5.545 11.831 1.00 0.00 H new ATOM 0 HA SER A 64 19.991 2.843 11.844 1.00 0.00 H new ATOM 0 HB2 SER A 64 17.973 4.704 13.147 1.00 0.00 H new ATOM 0 HB3 SER A 64 17.992 2.986 13.493 1.00 0.00 H new ATOM 0 HG SER A 64 19.287 4.196 14.987 1.00 0.00 H new ATOM 1024 N ARG A 65 17.258 3.770 10.284 1.00 0.00 N ATOM 1025 CA ARG A 65 16.177 3.302 9.424 1.00 0.00 C ATOM 1026 C ARG A 65 16.705 2.925 8.043 1.00 0.00 C ATOM 1027 O ARG A 65 16.382 1.861 7.513 1.00 0.00 O ATOM 1028 CB ARG A 65 15.099 4.380 9.293 1.00 0.00 C ATOM 1029 CG ARG A 65 13.716 3.824 8.997 1.00 0.00 C ATOM 1030 CD ARG A 65 13.057 3.272 10.252 1.00 0.00 C ATOM 1031 NE ARG A 65 11.602 3.391 10.203 1.00 0.00 N ATOM 1032 CZ ARG A 65 10.793 2.889 11.130 1.00 0.00 C ATOM 1033 NH1 ARG A 65 11.294 2.240 12.171 1.00 0.00 N ATOM 1034 NH2 ARG A 65 9.479 3.038 11.016 1.00 0.00 N ATOM 0 H ARG A 65 17.324 4.785 10.364 1.00 0.00 H new ATOM 0 HA ARG A 65 15.740 2.414 9.881 1.00 0.00 H new ATOM 0 HB2 ARG A 65 15.060 4.957 10.217 1.00 0.00 H new ATOM 0 HB3 ARG A 65 15.382 5.070 8.498 1.00 0.00 H new ATOM 0 HG2 ARG A 65 13.091 4.609 8.571 1.00 0.00 H new ATOM 0 HG3 ARG A 65 13.792 3.036 8.248 1.00 0.00 H new ATOM 0 HD2 ARG A 65 13.331 2.224 10.375 1.00 0.00 H new ATOM 0 HD3 ARG A 65 13.435 3.805 11.124 1.00 0.00 H new ATOM 0 HE ARG A 65 11.185 3.886 9.415 1.00 0.00 H new ATOM 0 HH11 ARG A 65 12.303 2.125 12.262 1.00 0.00 H new ATOM 0 HH12 ARG A 65 10.670 1.856 12.881 1.00 0.00 H new ATOM 0 HH21 ARG A 65 9.090 3.538 10.217 1.00 0.00 H new ATOM 0 HH22 ARG A 65 8.858 2.652 11.728 1.00 0.00 H new ATOM 1048 N VAL A 66 17.518 3.803 7.466 1.00 0.00 N ATOM 1049 CA VAL A 66 18.091 3.562 6.147 1.00 0.00 C ATOM 1050 C VAL A 66 18.362 2.078 5.928 1.00 0.00 C ATOM 1051 O VAL A 66 17.762 1.449 5.058 1.00 0.00 O ATOM 1052 CB VAL A 66 19.402 4.347 5.953 1.00 0.00 C ATOM 1053 CG1 VAL A 66 20.165 3.822 4.746 1.00 0.00 C ATOM 1054 CG2 VAL A 66 19.116 5.834 5.808 1.00 0.00 C ATOM 0 H VAL A 66 17.795 4.688 7.891 1.00 0.00 H new ATOM 0 HA VAL A 66 17.359 3.906 5.416 1.00 0.00 H new ATOM 0 HB VAL A 66 20.025 4.205 6.836 1.00 0.00 H new ATOM 0 HG11 VAL A 66 21.088 4.389 4.625 1.00 0.00 H new ATOM 0 HG12 VAL A 66 20.403 2.769 4.896 1.00 0.00 H new ATOM 0 HG13 VAL A 66 19.552 3.932 3.852 1.00 0.00 H new ATOM 0 HG21 VAL A 66 20.053 6.373 5.672 1.00 0.00 H new ATOM 0 HG22 VAL A 66 18.474 5.998 4.943 1.00 0.00 H new ATOM 0 HG23 VAL A 66 18.615 6.197 6.705 1.00 0.00 H new ATOM 1064 N GLN A 67 19.271 1.525 6.725 1.00 0.00 N ATOM 1065 CA GLN A 67 19.622 0.114 6.619 1.00 0.00 C ATOM 1066 C GLN A 67 18.403 -0.771 6.862 1.00 0.00 C ATOM 1067 O GLN A 67 18.134 -1.696 6.097 1.00 0.00 O ATOM 1068 CB GLN A 67 20.727 -0.236 7.617 1.00 0.00 C ATOM 1069 CG GLN A 67 20.246 -0.307 9.057 1.00 0.00 C ATOM 1070 CD GLN A 67 21.385 -0.456 10.046 1.00 0.00 C ATOM 1071 OE1 GLN A 67 21.582 -1.523 10.628 1.00 0.00 O ATOM 1072 NE2 GLN A 67 22.143 0.617 10.242 1.00 0.00 N ATOM 0 H GLN A 67 19.777 2.032 7.451 1.00 0.00 H new ATOM 0 HA GLN A 67 19.985 -0.068 5.607 1.00 0.00 H new ATOM 0 HB2 GLN A 67 21.164 -1.196 7.341 1.00 0.00 H new ATOM 0 HB3 GLN A 67 21.520 0.508 7.544 1.00 0.00 H new ATOM 0 HG2 GLN A 67 19.681 0.595 9.292 1.00 0.00 H new ATOM 0 HG3 GLN A 67 19.562 -1.149 9.167 1.00 0.00 H new ATOM 0 HE21 GLN A 67 21.944 1.481 9.738 1.00 0.00 H new ATOM 0 HE22 GLN A 67 22.924 0.577 10.896 1.00 0.00 H new ATOM 1081 N GLU A 68 17.670 -0.479 7.932 1.00 0.00 N ATOM 1082 CA GLU A 68 16.481 -1.249 8.276 1.00 0.00 C ATOM 1083 C GLU A 68 15.603 -1.472 7.047 1.00 0.00 C ATOM 1084 O GLU A 68 15.409 -2.605 6.608 1.00 0.00 O ATOM 1085 CB GLU A 68 15.680 -0.533 9.365 1.00 0.00 C ATOM 1086 CG GLU A 68 16.216 -0.766 10.768 1.00 0.00 C ATOM 1087 CD GLU A 68 16.110 -2.216 11.199 1.00 0.00 C ATOM 1088 OE1 GLU A 68 15.054 -2.834 10.948 1.00 0.00 O ATOM 1089 OE2 GLU A 68 17.082 -2.734 11.787 1.00 0.00 O ATOM 0 H GLU A 68 17.879 0.285 8.575 1.00 0.00 H new ATOM 0 HA GLU A 68 16.804 -2.220 8.652 1.00 0.00 H new ATOM 0 HB2 GLU A 68 15.679 0.537 9.159 1.00 0.00 H new ATOM 0 HB3 GLU A 68 14.643 -0.867 9.321 1.00 0.00 H new ATOM 0 HG2 GLU A 68 17.259 -0.453 10.811 1.00 0.00 H new ATOM 0 HG3 GLU A 68 15.666 -0.141 11.472 1.00 0.00 H new ATOM 1096 N ILE A 69 15.076 -0.382 6.499 1.00 0.00 N ATOM 1097 CA ILE A 69 14.220 -0.458 5.321 1.00 0.00 C ATOM 1098 C ILE A 69 14.825 -1.371 4.260 1.00 0.00 C ATOM 1099 O ILE A 69 14.142 -2.231 3.704 1.00 0.00 O ATOM 1100 CB ILE A 69 13.980 0.934 4.709 1.00 0.00 C ATOM 1101 CG1 ILE A 69 13.300 1.853 5.726 1.00 0.00 C ATOM 1102 CG2 ILE A 69 13.139 0.820 3.446 1.00 0.00 C ATOM 1103 CD1 ILE A 69 13.477 3.324 5.425 1.00 0.00 C ATOM 0 H ILE A 69 15.226 0.563 6.851 1.00 0.00 H new ATOM 0 HA ILE A 69 13.266 -0.870 5.650 1.00 0.00 H new ATOM 0 HB ILE A 69 14.944 1.368 4.443 1.00 0.00 H new ATOM 0 HG12 ILE A 69 12.235 1.622 5.757 1.00 0.00 H new ATOM 0 HG13 ILE A 69 13.700 1.643 6.718 1.00 0.00 H new ATOM 0 HG21 ILE A 69 12.978 1.813 3.025 1.00 0.00 H new ATOM 0 HG22 ILE A 69 13.659 0.197 2.718 1.00 0.00 H new ATOM 0 HG23 ILE A 69 12.177 0.369 3.689 1.00 0.00 H new ATOM 0 HD11 ILE A 69 12.969 3.915 6.187 1.00 0.00 H new ATOM 0 HD12 ILE A 69 14.539 3.570 5.423 1.00 0.00 H new ATOM 0 HD13 ILE A 69 13.051 3.549 4.447 1.00 0.00 H new ATOM 1115 N TRP A 70 16.110 -1.178 3.985 1.00 0.00 N ATOM 1116 CA TRP A 70 16.808 -1.985 2.991 1.00 0.00 C ATOM 1117 C TRP A 70 17.007 -3.412 3.490 1.00 0.00 C ATOM 1118 O TRP A 70 17.182 -4.337 2.698 1.00 0.00 O ATOM 1119 CB TRP A 70 18.161 -1.357 2.653 1.00 0.00 C ATOM 1120 CG TRP A 70 19.249 -2.367 2.445 1.00 0.00 C ATOM 1121 CD1 TRP A 70 19.901 -3.080 3.411 1.00 0.00 C ATOM 1122 CD2 TRP A 70 19.814 -2.774 1.194 1.00 0.00 C ATOM 1123 NE1 TRP A 70 20.836 -3.905 2.835 1.00 0.00 N ATOM 1124 CE2 TRP A 70 20.802 -3.737 1.477 1.00 0.00 C ATOM 1125 CE3 TRP A 70 19.579 -2.420 -0.137 1.00 0.00 C ATOM 1126 CZ2 TRP A 70 21.554 -4.347 0.476 1.00 0.00 C ATOM 1127 CZ3 TRP A 70 20.326 -3.026 -1.129 1.00 0.00 C ATOM 1128 CH2 TRP A 70 21.303 -3.982 -0.819 1.00 0.00 C ATOM 0 H TRP A 70 16.689 -0.470 4.436 1.00 0.00 H new ATOM 0 HA TRP A 70 16.195 -2.017 2.090 1.00 0.00 H new ATOM 0 HB2 TRP A 70 18.058 -0.753 1.751 1.00 0.00 H new ATOM 0 HB3 TRP A 70 18.451 -0.681 3.458 1.00 0.00 H new ATOM 0 HD1 TRP A 70 19.709 -3.006 4.471 1.00 0.00 H new ATOM 0 HE1 TRP A 70 21.456 -4.540 3.338 1.00 0.00 H new ATOM 0 HE3 TRP A 70 18.827 -1.686 -0.386 1.00 0.00 H new ATOM 0 HZ2 TRP A 70 22.309 -5.082 0.713 1.00 0.00 H new ATOM 0 HZ3 TRP A 70 20.154 -2.758 -2.161 1.00 0.00 H new ATOM 0 HH2 TRP A 70 21.869 -4.439 -1.617 1.00 0.00 H new ATOM 1139 N GLN A 71 16.977 -3.583 4.808 1.00 0.00 N ATOM 1140 CA GLN A 71 17.155 -4.898 5.412 1.00 0.00 C ATOM 1141 C GLN A 71 15.835 -5.663 5.448 1.00 0.00 C ATOM 1142 O GLN A 71 15.801 -6.842 5.800 1.00 0.00 O ATOM 1143 CB GLN A 71 17.718 -4.761 6.827 1.00 0.00 C ATOM 1144 CG GLN A 71 19.208 -4.460 6.863 1.00 0.00 C ATOM 1145 CD GLN A 71 19.864 -4.914 8.151 1.00 0.00 C ATOM 1146 OE1 GLN A 71 19.810 -4.221 9.167 1.00 0.00 O ATOM 1147 NE2 GLN A 71 20.490 -6.085 8.117 1.00 0.00 N ATOM 0 H GLN A 71 16.831 -2.827 5.478 1.00 0.00 H new ATOM 0 HA GLN A 71 17.862 -5.458 4.801 1.00 0.00 H new ATOM 0 HB2 GLN A 71 17.183 -3.966 7.347 1.00 0.00 H new ATOM 0 HB3 GLN A 71 17.529 -5.684 7.375 1.00 0.00 H new ATOM 0 HG2 GLN A 71 19.694 -4.950 6.020 1.00 0.00 H new ATOM 0 HG3 GLN A 71 19.361 -3.388 6.740 1.00 0.00 H new ATOM 0 HE21 GLN A 71 20.511 -6.627 7.253 1.00 0.00 H new ATOM 0 HE22 GLN A 71 20.950 -6.442 8.954 1.00 0.00 H new ATOM 1156 N GLU A 72 14.753 -4.983 5.084 1.00 0.00 N ATOM 1157 CA GLU A 72 13.431 -5.599 5.077 1.00 0.00 C ATOM 1158 C GLU A 72 12.942 -5.822 3.649 1.00 0.00 C ATOM 1159 O GLU A 72 12.499 -6.915 3.296 1.00 0.00 O ATOM 1160 CB GLU A 72 12.433 -4.726 5.839 1.00 0.00 C ATOM 1161 CG GLU A 72 11.143 -5.445 6.196 1.00 0.00 C ATOM 1162 CD GLU A 72 11.292 -6.344 7.408 1.00 0.00 C ATOM 1163 OE1 GLU A 72 12.401 -6.877 7.619 1.00 0.00 O ATOM 1164 OE2 GLU A 72 10.299 -6.513 8.146 1.00 0.00 O ATOM 0 H GLU A 72 14.765 -4.006 4.790 1.00 0.00 H new ATOM 0 HA GLU A 72 13.507 -6.567 5.572 1.00 0.00 H new ATOM 0 HB2 GLU A 72 12.903 -4.366 6.754 1.00 0.00 H new ATOM 0 HB3 GLU A 72 12.196 -3.850 5.236 1.00 0.00 H new ATOM 0 HG2 GLU A 72 10.362 -4.709 6.388 1.00 0.00 H new ATOM 0 HG3 GLU A 72 10.816 -6.041 5.344 1.00 0.00 H new ATOM 1171 N PHE A 73 13.026 -4.777 2.831 1.00 0.00 N ATOM 1172 CA PHE A 73 12.591 -4.857 1.442 1.00 0.00 C ATOM 1173 C PHE A 73 13.778 -5.099 0.513 1.00 0.00 C ATOM 1174 O PHE A 73 13.885 -6.153 -0.114 1.00 0.00 O ATOM 1175 CB PHE A 73 11.866 -3.572 1.038 1.00 0.00 C ATOM 1176 CG PHE A 73 10.909 -3.070 2.081 1.00 0.00 C ATOM 1177 CD1 PHE A 73 9.652 -3.635 2.217 1.00 0.00 C ATOM 1178 CD2 PHE A 73 11.268 -2.031 2.926 1.00 0.00 C ATOM 1179 CE1 PHE A 73 8.769 -3.176 3.176 1.00 0.00 C ATOM 1180 CE2 PHE A 73 10.390 -1.568 3.887 1.00 0.00 C ATOM 1181 CZ PHE A 73 9.139 -2.140 4.012 1.00 0.00 C ATOM 0 H PHE A 73 13.391 -3.865 3.107 1.00 0.00 H new ATOM 0 HA PHE A 73 11.904 -5.698 1.350 1.00 0.00 H new ATOM 0 HB2 PHE A 73 12.604 -2.797 0.831 1.00 0.00 H new ATOM 0 HB3 PHE A 73 11.321 -3.748 0.111 1.00 0.00 H new ATOM 0 HD1 PHE A 73 9.358 -4.445 1.565 1.00 0.00 H new ATOM 0 HD2 PHE A 73 12.244 -1.579 2.832 1.00 0.00 H new ATOM 0 HE1 PHE A 73 7.792 -3.626 3.272 1.00 0.00 H new ATOM 0 HE2 PHE A 73 10.682 -0.759 4.540 1.00 0.00 H new ATOM 0 HZ PHE A 73 8.451 -1.778 4.762 1.00 0.00 H new ATOM 1191 N LEU A 74 14.666 -4.114 0.430 1.00 0.00 N ATOM 1192 CA LEU A 74 15.845 -4.218 -0.422 1.00 0.00 C ATOM 1193 C LEU A 74 16.822 -5.254 0.125 1.00 0.00 C ATOM 1194 O LEU A 74 17.997 -5.267 -0.241 1.00 0.00 O ATOM 1195 CB LEU A 74 16.537 -2.858 -0.537 1.00 0.00 C ATOM 1196 CG LEU A 74 15.631 -1.670 -0.861 1.00 0.00 C ATOM 1197 CD1 LEU A 74 16.439 -0.383 -0.920 1.00 0.00 C ATOM 1198 CD2 LEU A 74 14.896 -1.901 -2.173 1.00 0.00 C ATOM 0 H LEU A 74 14.592 -3.235 0.942 1.00 0.00 H new ATOM 0 HA LEU A 74 15.521 -4.539 -1.412 1.00 0.00 H new ATOM 0 HB2 LEU A 74 17.050 -2.653 0.403 1.00 0.00 H new ATOM 0 HB3 LEU A 74 17.303 -2.927 -1.309 1.00 0.00 H new ATOM 0 HG LEU A 74 14.892 -1.575 -0.066 1.00 0.00 H new ATOM 0 HD11 LEU A 74 15.777 0.452 -1.152 1.00 0.00 H new ATOM 0 HD12 LEU A 74 16.918 -0.210 0.044 1.00 0.00 H new ATOM 0 HD13 LEU A 74 17.202 -0.467 -1.694 1.00 0.00 H new ATOM 0 HD21 LEU A 74 14.256 -1.045 -2.387 1.00 0.00 H new ATOM 0 HD22 LEU A 74 15.620 -2.024 -2.979 1.00 0.00 H new ATOM 0 HD23 LEU A 74 14.285 -2.800 -2.094 1.00 0.00 H new ATOM 1210 N ALA A 75 16.328 -6.122 1.001 1.00 0.00 N ATOM 1211 CA ALA A 75 17.156 -7.164 1.595 1.00 0.00 C ATOM 1212 C ALA A 75 16.676 -8.550 1.179 1.00 0.00 C ATOM 1213 O ALA A 75 15.477 -8.822 1.107 1.00 0.00 O ATOM 1214 CB ALA A 75 17.158 -7.037 3.111 1.00 0.00 C ATOM 0 H ALA A 75 15.358 -6.124 1.315 1.00 0.00 H new ATOM 0 HA ALA A 75 18.175 -7.036 1.230 1.00 0.00 H new ATOM 0 HB1 ALA A 75 17.780 -7.822 3.541 1.00 0.00 H new ATOM 0 HB2 ALA A 75 17.556 -6.062 3.394 1.00 0.00 H new ATOM 0 HB3 ALA A 75 16.139 -7.136 3.486 1.00 0.00 H new ATOM 1220 N PRO A 76 17.631 -9.449 0.899 1.00 0.00 N ATOM 1221 CA PRO A 76 17.329 -10.822 0.485 1.00 0.00 C ATOM 1222 C PRO A 76 16.743 -11.654 1.621 1.00 0.00 C ATOM 1223 O PRO A 76 16.879 -11.305 2.793 1.00 0.00 O ATOM 1224 CB PRO A 76 18.694 -11.375 0.066 1.00 0.00 C ATOM 1225 CG PRO A 76 19.682 -10.565 0.833 1.00 0.00 C ATOM 1226 CD PRO A 76 19.080 -9.193 0.964 1.00 0.00 C ATOM 0 HA PRO A 76 16.580 -10.854 -0.306 1.00 0.00 H new ATOM 0 HB2 PRO A 76 18.782 -12.435 0.304 1.00 0.00 H new ATOM 0 HB3 PRO A 76 18.849 -11.275 -1.008 1.00 0.00 H new ATOM 0 HG2 PRO A 76 19.870 -11.004 1.813 1.00 0.00 H new ATOM 0 HG3 PRO A 76 20.639 -10.523 0.314 1.00 0.00 H new ATOM 0 HD2 PRO A 76 19.362 -8.718 1.904 1.00 0.00 H new ATOM 0 HD3 PRO A 76 19.408 -8.532 0.162 1.00 0.00 H new ATOM 1234 N GLY A 77 16.092 -12.757 1.265 1.00 0.00 N ATOM 1235 CA GLY A 77 15.495 -13.622 2.267 1.00 0.00 C ATOM 1236 C GLY A 77 14.630 -12.859 3.250 1.00 0.00 C ATOM 1237 O GLY A 77 14.283 -13.375 4.312 1.00 0.00 O ATOM 0 H GLY A 77 15.967 -13.067 0.301 1.00 0.00 H new ATOM 0 HA2 GLY A 77 14.892 -14.384 1.772 1.00 0.00 H new ATOM 0 HA3 GLY A 77 16.284 -14.143 2.810 1.00 0.00 H new ATOM 1241 N ALA A 78 14.282 -11.626 2.897 1.00 0.00 N ATOM 1242 CA ALA A 78 13.452 -10.791 3.757 1.00 0.00 C ATOM 1243 C ALA A 78 11.971 -11.078 3.536 1.00 0.00 C ATOM 1244 O ALA A 78 11.563 -11.598 2.498 1.00 0.00 O ATOM 1245 CB ALA A 78 13.750 -9.319 3.509 1.00 0.00 C ATOM 0 H ALA A 78 14.562 -11.183 2.022 1.00 0.00 H new ATOM 0 HA ALA A 78 13.690 -11.029 4.794 1.00 0.00 H new ATOM 0 HB1 ALA A 78 13.123 -8.707 4.158 1.00 0.00 H new ATOM 0 HB2 ALA A 78 14.800 -9.119 3.724 1.00 0.00 H new ATOM 0 HB3 ALA A 78 13.541 -9.076 2.467 1.00 0.00 H new ATOM 1251 N PRO A 79 11.146 -10.732 4.535 1.00 0.00 N ATOM 1252 CA PRO A 79 9.696 -10.944 4.474 1.00 0.00 C ATOM 1253 C PRO A 79 9.019 -10.023 3.464 1.00 0.00 C ATOM 1254 O PRO A 79 8.210 -10.468 2.650 1.00 0.00 O ATOM 1255 CB PRO A 79 9.229 -10.616 5.894 1.00 0.00 C ATOM 1256 CG PRO A 79 10.263 -9.685 6.427 1.00 0.00 C ATOM 1257 CD PRO A 79 11.563 -10.108 5.802 1.00 0.00 C ATOM 0 HA PRO A 79 9.444 -11.954 4.151 1.00 0.00 H new ATOM 0 HB2 PRO A 79 8.243 -10.152 5.889 1.00 0.00 H new ATOM 0 HB3 PRO A 79 9.154 -11.516 6.504 1.00 0.00 H new ATOM 0 HG2 PRO A 79 10.026 -8.652 6.173 1.00 0.00 H new ATOM 0 HG3 PRO A 79 10.316 -9.742 7.514 1.00 0.00 H new ATOM 0 HD2 PRO A 79 12.223 -9.257 5.633 1.00 0.00 H new ATOM 0 HD3 PRO A 79 12.104 -10.810 6.436 1.00 0.00 H new ATOM 1265 N SER A 80 9.354 -8.738 3.524 1.00 0.00 N ATOM 1266 CA SER A 80 8.775 -7.754 2.617 1.00 0.00 C ATOM 1267 C SER A 80 9.715 -7.472 1.449 1.00 0.00 C ATOM 1268 O SER A 80 9.582 -6.461 0.761 1.00 0.00 O ATOM 1269 CB SER A 80 8.469 -6.456 3.366 1.00 0.00 C ATOM 1270 OG SER A 80 7.799 -6.717 4.587 1.00 0.00 O ATOM 0 H SER A 80 10.023 -8.354 4.191 1.00 0.00 H new ATOM 0 HA SER A 80 7.846 -8.164 2.221 1.00 0.00 H new ATOM 0 HB2 SER A 80 9.397 -5.920 3.564 1.00 0.00 H new ATOM 0 HB3 SER A 80 7.854 -5.808 2.741 1.00 0.00 H new ATOM 0 HG SER A 80 7.616 -5.871 5.047 1.00 0.00 H new ATOM 1276 N ALA A 81 10.666 -8.374 1.233 1.00 0.00 N ATOM 1277 CA ALA A 81 11.629 -8.225 0.148 1.00 0.00 C ATOM 1278 C ALA A 81 10.924 -7.957 -1.178 1.00 0.00 C ATOM 1279 O ALA A 81 10.086 -8.745 -1.616 1.00 0.00 O ATOM 1280 CB ALA A 81 12.502 -9.466 0.042 1.00 0.00 C ATOM 0 H ALA A 81 10.791 -9.216 1.795 1.00 0.00 H new ATOM 0 HA ALA A 81 12.263 -7.367 0.373 1.00 0.00 H new ATOM 0 HB1 ALA A 81 13.216 -9.340 -0.772 1.00 0.00 H new ATOM 0 HB2 ALA A 81 13.041 -9.613 0.978 1.00 0.00 H new ATOM 0 HB3 ALA A 81 11.876 -10.336 -0.156 1.00 0.00 H new ATOM 1286 N ILE A 82 11.268 -6.840 -1.810 1.00 0.00 N ATOM 1287 CA ILE A 82 10.668 -6.469 -3.086 1.00 0.00 C ATOM 1288 C ILE A 82 11.664 -6.632 -4.229 1.00 0.00 C ATOM 1289 O ILE A 82 12.812 -7.018 -4.016 1.00 0.00 O ATOM 1290 CB ILE A 82 10.158 -5.016 -3.067 1.00 0.00 C ATOM 1291 CG1 ILE A 82 11.333 -4.042 -2.957 1.00 0.00 C ATOM 1292 CG2 ILE A 82 9.184 -4.812 -1.917 1.00 0.00 C ATOM 1293 CD1 ILE A 82 11.010 -2.648 -3.448 1.00 0.00 C ATOM 0 H ILE A 82 11.959 -6.176 -1.460 1.00 0.00 H new ATOM 0 HA ILE A 82 9.823 -7.139 -3.245 1.00 0.00 H new ATOM 0 HB ILE A 82 9.633 -4.818 -4.001 1.00 0.00 H new ATOM 0 HG12 ILE A 82 11.653 -3.987 -1.916 1.00 0.00 H new ATOM 0 HG13 ILE A 82 12.174 -4.434 -3.529 1.00 0.00 H new ATOM 0 HG21 ILE A 82 8.832 -3.780 -1.917 1.00 0.00 H new ATOM 0 HG22 ILE A 82 8.335 -5.485 -2.036 1.00 0.00 H new ATOM 0 HG23 ILE A 82 9.686 -5.024 -0.973 1.00 0.00 H new ATOM 0 HD11 ILE A 82 11.888 -2.012 -3.340 1.00 0.00 H new ATOM 0 HD12 ILE A 82 10.719 -2.690 -4.498 1.00 0.00 H new ATOM 0 HD13 ILE A 82 10.189 -2.236 -2.860 1.00 0.00 H new ATOM 1305 N ASN A 83 11.215 -6.333 -5.444 1.00 0.00 N ATOM 1306 CA ASN A 83 12.067 -6.445 -6.623 1.00 0.00 C ATOM 1307 C ASN A 83 12.087 -5.136 -7.406 1.00 0.00 C ATOM 1308 O ASN A 83 11.049 -4.504 -7.607 1.00 0.00 O ATOM 1309 CB ASN A 83 11.582 -7.584 -7.522 1.00 0.00 C ATOM 1310 CG ASN A 83 12.579 -7.923 -8.613 1.00 0.00 C ATOM 1311 OD1 ASN A 83 13.636 -7.301 -8.720 1.00 0.00 O ATOM 1312 ND2 ASN A 83 12.246 -8.915 -9.431 1.00 0.00 N ATOM 0 H ASN A 83 10.267 -6.011 -5.638 1.00 0.00 H new ATOM 0 HA ASN A 83 13.081 -6.663 -6.289 1.00 0.00 H new ATOM 0 HB2 ASN A 83 11.397 -8.470 -6.914 1.00 0.00 H new ATOM 0 HB3 ASN A 83 10.631 -7.305 -7.976 1.00 0.00 H new ATOM 0 HD21 ASN A 83 12.877 -9.188 -10.184 1.00 0.00 H new ATOM 0 HD22 ASN A 83 11.359 -9.404 -9.306 1.00 0.00 H new ATOM 1319 N LEU A 84 13.274 -4.735 -7.847 1.00 0.00 N ATOM 1320 CA LEU A 84 13.430 -3.502 -8.610 1.00 0.00 C ATOM 1321 C LEU A 84 14.162 -3.762 -9.923 1.00 0.00 C ATOM 1322 O LEU A 84 14.576 -4.887 -10.202 1.00 0.00 O ATOM 1323 CB LEU A 84 14.191 -2.462 -7.786 1.00 0.00 C ATOM 1324 CG LEU A 84 13.593 -2.118 -6.421 1.00 0.00 C ATOM 1325 CD1 LEU A 84 14.629 -1.437 -5.540 1.00 0.00 C ATOM 1326 CD2 LEU A 84 12.365 -1.234 -6.584 1.00 0.00 C ATOM 0 H LEU A 84 14.143 -5.246 -7.689 1.00 0.00 H new ATOM 0 HA LEU A 84 12.436 -3.118 -8.840 1.00 0.00 H new ATOM 0 HB2 LEU A 84 15.209 -2.822 -7.634 1.00 0.00 H new ATOM 0 HB3 LEU A 84 14.261 -1.545 -8.371 1.00 0.00 H new ATOM 0 HG LEU A 84 13.287 -3.045 -5.936 1.00 0.00 H new ATOM 0 HD11 LEU A 84 14.185 -1.200 -4.573 1.00 0.00 H new ATOM 0 HD12 LEU A 84 15.479 -2.104 -5.395 1.00 0.00 H new ATOM 0 HD13 LEU A 84 14.967 -0.518 -6.019 1.00 0.00 H new ATOM 0 HD21 LEU A 84 11.953 -0.999 -5.603 1.00 0.00 H new ATOM 0 HD22 LEU A 84 12.646 -0.310 -7.090 1.00 0.00 H new ATOM 0 HD23 LEU A 84 11.615 -1.758 -7.176 1.00 0.00 H new ATOM 1338 N ASP A 85 14.319 -2.714 -10.724 1.00 0.00 N ATOM 1339 CA ASP A 85 15.004 -2.828 -12.006 1.00 0.00 C ATOM 1340 C ASP A 85 16.513 -2.931 -11.809 1.00 0.00 C ATOM 1341 O ASP A 85 17.059 -2.412 -10.835 1.00 0.00 O ATOM 1342 CB ASP A 85 14.674 -1.627 -12.893 1.00 0.00 C ATOM 1343 CG ASP A 85 14.843 -1.933 -14.369 1.00 0.00 C ATOM 1344 OD1 ASP A 85 15.961 -2.316 -14.771 1.00 0.00 O ATOM 1345 OD2 ASP A 85 13.856 -1.789 -15.121 1.00 0.00 O ATOM 0 H ASP A 85 13.981 -1.776 -10.508 1.00 0.00 H new ATOM 0 HA ASP A 85 14.657 -3.738 -12.496 1.00 0.00 H new ATOM 0 HB2 ASP A 85 13.648 -1.312 -12.706 1.00 0.00 H new ATOM 0 HB3 ASP A 85 15.319 -0.791 -12.622 1.00 0.00 H new ATOM 1350 N SER A 86 17.182 -3.605 -12.739 1.00 0.00 N ATOM 1351 CA SER A 86 18.628 -3.780 -12.664 1.00 0.00 C ATOM 1352 C SER A 86 19.322 -2.453 -12.371 1.00 0.00 C ATOM 1353 O SER A 86 20.314 -2.405 -11.643 1.00 0.00 O ATOM 1354 CB SER A 86 19.160 -4.369 -13.973 1.00 0.00 C ATOM 1355 OG SER A 86 18.941 -3.482 -15.056 1.00 0.00 O ATOM 0 H SER A 86 16.746 -4.039 -13.553 1.00 0.00 H new ATOM 0 HA SER A 86 18.844 -4.470 -11.849 1.00 0.00 H new ATOM 0 HB2 SER A 86 20.226 -4.574 -13.877 1.00 0.00 H new ATOM 0 HB3 SER A 86 18.669 -5.321 -14.173 1.00 0.00 H new ATOM 0 HG SER A 86 17.996 -3.222 -15.080 1.00 0.00 H new ATOM 1361 N LYS A 87 18.793 -1.377 -12.943 1.00 0.00 N ATOM 1362 CA LYS A 87 19.358 -0.048 -12.744 1.00 0.00 C ATOM 1363 C LYS A 87 19.064 0.463 -11.338 1.00 0.00 C ATOM 1364 O LYS A 87 19.974 0.640 -10.528 1.00 0.00 O ATOM 1365 CB LYS A 87 18.797 0.928 -13.781 1.00 0.00 C ATOM 1366 CG LYS A 87 19.023 2.387 -13.427 1.00 0.00 C ATOM 1367 CD LYS A 87 18.886 3.285 -14.646 1.00 0.00 C ATOM 1368 CE LYS A 87 18.449 4.689 -14.258 1.00 0.00 C ATOM 1369 NZ LYS A 87 16.969 4.791 -14.119 1.00 0.00 N ATOM 0 H LYS A 87 17.973 -1.400 -13.549 1.00 0.00 H new ATOM 0 HA LYS A 87 20.439 -0.118 -12.867 1.00 0.00 H new ATOM 0 HB2 LYS A 87 19.257 0.722 -14.748 1.00 0.00 H new ATOM 0 HB3 LYS A 87 17.727 0.751 -13.893 1.00 0.00 H new ATOM 0 HG2 LYS A 87 18.305 2.693 -12.666 1.00 0.00 H new ATOM 0 HG3 LYS A 87 20.016 2.508 -12.995 1.00 0.00 H new ATOM 0 HD2 LYS A 87 19.839 3.332 -15.173 1.00 0.00 H new ATOM 0 HD3 LYS A 87 18.160 2.855 -15.336 1.00 0.00 H new ATOM 0 HE2 LYS A 87 18.922 4.970 -13.317 1.00 0.00 H new ATOM 0 HE3 LYS A 87 18.793 5.398 -15.012 1.00 0.00 H new ATOM 0 HZ1 LYS A 87 16.711 5.763 -13.854 1.00 0.00 H new ATOM 0 HZ2 LYS A 87 16.518 4.548 -15.024 1.00 0.00 H new ATOM 0 HZ3 LYS A 87 16.643 4.133 -13.382 1.00 0.00 H new ATOM 1383 N SER A 88 17.787 0.698 -11.053 1.00 0.00 N ATOM 1384 CA SER A 88 17.374 1.191 -9.745 1.00 0.00 C ATOM 1385 C SER A 88 18.043 0.395 -8.628 1.00 0.00 C ATOM 1386 O SER A 88 18.677 0.964 -7.739 1.00 0.00 O ATOM 1387 CB SER A 88 15.852 1.110 -9.603 1.00 0.00 C ATOM 1388 OG SER A 88 15.396 -0.222 -9.760 1.00 0.00 O ATOM 0 H SER A 88 17.021 0.555 -11.711 1.00 0.00 H new ATOM 0 HA SER A 88 17.685 2.232 -9.662 1.00 0.00 H new ATOM 0 HB2 SER A 88 15.554 1.487 -8.624 1.00 0.00 H new ATOM 0 HB3 SER A 88 15.379 1.750 -10.348 1.00 0.00 H new ATOM 0 HG SER A 88 15.778 -0.604 -10.578 1.00 0.00 H new ATOM 1394 N TYR A 89 17.897 -0.924 -8.681 1.00 0.00 N ATOM 1395 CA TYR A 89 18.484 -1.799 -7.673 1.00 0.00 C ATOM 1396 C TYR A 89 19.975 -1.521 -7.513 1.00 0.00 C ATOM 1397 O TYR A 89 20.430 -1.106 -6.446 1.00 0.00 O ATOM 1398 CB TYR A 89 18.265 -3.265 -8.051 1.00 0.00 C ATOM 1399 CG TYR A 89 18.386 -4.216 -6.881 1.00 0.00 C ATOM 1400 CD1 TYR A 89 17.408 -4.263 -5.895 1.00 0.00 C ATOM 1401 CD2 TYR A 89 19.478 -5.067 -6.762 1.00 0.00 C ATOM 1402 CE1 TYR A 89 17.514 -5.129 -4.824 1.00 0.00 C ATOM 1403 CE2 TYR A 89 19.592 -5.937 -5.696 1.00 0.00 C ATOM 1404 CZ TYR A 89 18.608 -5.965 -4.729 1.00 0.00 C ATOM 1405 OH TYR A 89 18.718 -6.830 -3.665 1.00 0.00 O ATOM 0 H TYR A 89 17.377 -1.411 -9.411 1.00 0.00 H new ATOM 0 HA TYR A 89 17.991 -1.598 -6.722 1.00 0.00 H new ATOM 0 HB2 TYR A 89 17.276 -3.373 -8.496 1.00 0.00 H new ATOM 0 HB3 TYR A 89 18.990 -3.547 -8.814 1.00 0.00 H new ATOM 0 HD1 TYR A 89 16.550 -3.611 -5.967 1.00 0.00 H new ATOM 0 HD2 TYR A 89 20.251 -5.048 -7.516 1.00 0.00 H new ATOM 0 HE1 TYR A 89 16.745 -5.152 -4.066 1.00 0.00 H new ATOM 0 HE2 TYR A 89 20.447 -6.592 -5.619 1.00 0.00 H new ATOM 0 HH TYR A 89 19.545 -7.348 -3.749 1.00 0.00 H new ATOM 1415 N ASP A 90 20.732 -1.752 -8.580 1.00 0.00 N ATOM 1416 CA ASP A 90 22.172 -1.526 -8.560 1.00 0.00 C ATOM 1417 C ASP A 90 22.502 -0.180 -7.921 1.00 0.00 C ATOM 1418 O ASP A 90 23.307 -0.102 -6.993 1.00 0.00 O ATOM 1419 CB ASP A 90 22.738 -1.583 -9.980 1.00 0.00 C ATOM 1420 CG ASP A 90 24.239 -1.368 -10.013 1.00 0.00 C ATOM 1421 OD1 ASP A 90 24.678 -0.213 -9.835 1.00 0.00 O ATOM 1422 OD2 ASP A 90 24.974 -2.356 -10.217 1.00 0.00 O ATOM 0 H ASP A 90 20.372 -2.096 -9.470 1.00 0.00 H new ATOM 0 HA ASP A 90 22.631 -2.314 -7.962 1.00 0.00 H new ATOM 0 HB2 ASP A 90 22.502 -2.550 -10.424 1.00 0.00 H new ATOM 0 HB3 ASP A 90 22.251 -0.824 -10.593 1.00 0.00 H new ATOM 1427 N LYS A 91 21.875 0.878 -8.425 1.00 0.00 N ATOM 1428 CA LYS A 91 22.100 2.221 -7.905 1.00 0.00 C ATOM 1429 C LYS A 91 21.818 2.278 -6.407 1.00 0.00 C ATOM 1430 O LYS A 91 22.700 2.598 -5.609 1.00 0.00 O ATOM 1431 CB LYS A 91 21.216 3.230 -8.641 1.00 0.00 C ATOM 1432 CG LYS A 91 21.676 4.669 -8.484 1.00 0.00 C ATOM 1433 CD LYS A 91 22.679 5.054 -9.559 1.00 0.00 C ATOM 1434 CE LYS A 91 22.951 6.551 -9.557 1.00 0.00 C ATOM 1435 NZ LYS A 91 21.785 7.327 -10.061 1.00 0.00 N ATOM 0 H LYS A 91 21.206 0.831 -9.194 1.00 0.00 H new ATOM 0 HA LYS A 91 23.147 2.477 -8.070 1.00 0.00 H new ATOM 0 HB2 LYS A 91 21.196 2.977 -9.701 1.00 0.00 H new ATOM 0 HB3 LYS A 91 20.194 3.142 -8.273 1.00 0.00 H new ATOM 0 HG2 LYS A 91 20.814 5.335 -8.534 1.00 0.00 H new ATOM 0 HG3 LYS A 91 22.126 4.803 -7.500 1.00 0.00 H new ATOM 0 HD2 LYS A 91 23.612 4.513 -9.398 1.00 0.00 H new ATOM 0 HD3 LYS A 91 22.300 4.753 -10.536 1.00 0.00 H new ATOM 0 HE2 LYS A 91 23.193 6.875 -8.545 1.00 0.00 H new ATOM 0 HE3 LYS A 91 23.823 6.763 -10.176 1.00 0.00 H new ATOM 0 HZ1 LYS A 91 22.077 8.307 -10.253 1.00 0.00 H new ATOM 0 HZ2 LYS A 91 21.432 6.893 -10.938 1.00 0.00 H new ATOM 0 HZ3 LYS A 91 21.031 7.324 -9.345 1.00 0.00 H new ATOM 1449 N THR A 92 20.582 1.966 -6.030 1.00 0.00 N ATOM 1450 CA THR A 92 20.183 1.982 -4.628 1.00 0.00 C ATOM 1451 C THR A 92 21.194 1.241 -3.761 1.00 0.00 C ATOM 1452 O THR A 92 21.838 1.833 -2.894 1.00 0.00 O ATOM 1453 CB THR A 92 18.793 1.348 -4.432 1.00 0.00 C ATOM 1454 OG1 THR A 92 17.814 2.070 -5.188 1.00 0.00 O ATOM 1455 CG2 THR A 92 18.402 1.344 -2.962 1.00 0.00 C ATOM 0 H THR A 92 19.840 1.699 -6.676 1.00 0.00 H new ATOM 0 HA THR A 92 20.143 3.028 -4.322 1.00 0.00 H new ATOM 0 HB THR A 92 18.836 0.317 -4.783 1.00 0.00 H new ATOM 0 HG1 THR A 92 17.920 1.865 -6.140 1.00 0.00 H new ATOM 0 HG21 THR A 92 17.417 0.892 -2.849 1.00 0.00 H new ATOM 0 HG22 THR A 92 19.133 0.770 -2.393 1.00 0.00 H new ATOM 0 HG23 THR A 92 18.376 2.368 -2.590 1.00 0.00 H new ATOM 1463 N THR A 93 21.329 -0.060 -3.999 1.00 0.00 N ATOM 1464 CA THR A 93 22.262 -0.883 -3.238 1.00 0.00 C ATOM 1465 C THR A 93 23.515 -0.097 -2.871 1.00 0.00 C ATOM 1466 O THR A 93 24.003 -0.178 -1.743 1.00 0.00 O ATOM 1467 CB THR A 93 22.671 -2.142 -4.026 1.00 0.00 C ATOM 1468 OG1 THR A 93 21.505 -2.821 -4.505 1.00 0.00 O ATOM 1469 CG2 THR A 93 23.491 -3.082 -3.155 1.00 0.00 C ATOM 0 H THR A 93 20.804 -0.566 -4.712 1.00 0.00 H new ATOM 0 HA THR A 93 21.747 -1.185 -2.326 1.00 0.00 H new ATOM 0 HB THR A 93 23.282 -1.831 -4.873 1.00 0.00 H new ATOM 0 HG1 THR A 93 21.151 -2.350 -5.288 1.00 0.00 H new ATOM 0 HG21 THR A 93 23.768 -3.964 -3.732 1.00 0.00 H new ATOM 0 HG22 THR A 93 24.393 -2.571 -2.817 1.00 0.00 H new ATOM 0 HG23 THR A 93 22.900 -3.385 -2.291 1.00 0.00 H new ATOM 1477 N HIS A 94 24.033 0.664 -3.830 1.00 0.00 N ATOM 1478 CA HIS A 94 25.231 1.466 -3.606 1.00 0.00 C ATOM 1479 C HIS A 94 24.915 2.684 -2.742 1.00 0.00 C ATOM 1480 O HIS A 94 25.661 3.013 -1.821 1.00 0.00 O ATOM 1481 CB HIS A 94 25.827 1.915 -4.941 1.00 0.00 C ATOM 1482 CG HIS A 94 26.932 2.915 -4.798 1.00 0.00 C ATOM 1483 ND1 HIS A 94 27.889 2.842 -3.808 1.00 0.00 N ATOM 1484 CD2 HIS A 94 27.230 4.015 -5.527 1.00 0.00 C ATOM 1485 CE1 HIS A 94 28.728 3.855 -3.934 1.00 0.00 C ATOM 1486 NE2 HIS A 94 28.350 4.582 -4.970 1.00 0.00 N ATOM 0 H HIS A 94 23.642 0.742 -4.769 1.00 0.00 H new ATOM 0 HA HIS A 94 25.959 0.848 -3.081 1.00 0.00 H new ATOM 0 HB2 HIS A 94 26.205 1.042 -5.473 1.00 0.00 H new ATOM 0 HB3 HIS A 94 25.036 2.345 -5.556 1.00 0.00 H new ATOM 0 HD2 HIS A 94 26.688 4.379 -6.387 1.00 0.00 H new ATOM 0 HE1 HIS A 94 29.578 4.055 -3.298 1.00 0.00 H new ATOM 0 HE2 HIS A 94 28.814 5.427 -5.302 1.00 0.00 H new ATOM 1494 N ASN A 95 23.805 3.348 -3.047 1.00 0.00 N ATOM 1495 CA ASN A 95 23.392 4.530 -2.299 1.00 0.00 C ATOM 1496 C ASN A 95 23.188 4.196 -0.824 1.00 0.00 C ATOM 1497 O ASN A 95 23.556 4.974 0.056 1.00 0.00 O ATOM 1498 CB ASN A 95 22.102 5.106 -2.886 1.00 0.00 C ATOM 1499 CG ASN A 95 22.275 5.564 -4.321 1.00 0.00 C ATOM 1500 OD1 ASN A 95 23.104 5.032 -5.060 1.00 0.00 O ATOM 1501 ND2 ASN A 95 21.490 6.558 -4.723 1.00 0.00 N ATOM 0 H ASN A 95 23.176 3.088 -3.806 1.00 0.00 H new ATOM 0 HA ASN A 95 24.184 5.275 -2.379 1.00 0.00 H new ATOM 0 HB2 ASN A 95 21.317 4.352 -2.840 1.00 0.00 H new ATOM 0 HB3 ASN A 95 21.772 5.947 -2.276 1.00 0.00 H new ATOM 0 HD21 ASN A 95 21.561 6.909 -5.678 1.00 0.00 H new ATOM 0 HD22 ASN A 95 20.817 6.969 -4.077 1.00 0.00 H new ATOM 1508 N VAL A 96 22.599 3.033 -0.562 1.00 0.00 N ATOM 1509 CA VAL A 96 22.347 2.595 0.805 1.00 0.00 C ATOM 1510 C VAL A 96 23.517 2.943 1.718 1.00 0.00 C ATOM 1511 O VAL A 96 23.358 3.661 2.705 1.00 0.00 O ATOM 1512 CB VAL A 96 22.093 1.077 0.871 1.00 0.00 C ATOM 1513 CG1 VAL A 96 21.957 0.620 2.315 1.00 0.00 C ATOM 1514 CG2 VAL A 96 20.853 0.711 0.068 1.00 0.00 C ATOM 0 H VAL A 96 22.288 2.378 -1.279 1.00 0.00 H new ATOM 0 HA VAL A 96 21.455 3.120 1.146 1.00 0.00 H new ATOM 0 HB VAL A 96 22.948 0.563 0.432 1.00 0.00 H new ATOM 0 HG11 VAL A 96 21.778 -0.455 2.341 1.00 0.00 H new ATOM 0 HG12 VAL A 96 22.875 0.848 2.857 1.00 0.00 H new ATOM 0 HG13 VAL A 96 21.121 1.139 2.784 1.00 0.00 H new ATOM 0 HG21 VAL A 96 20.687 -0.365 0.125 1.00 0.00 H new ATOM 0 HG22 VAL A 96 19.988 1.233 0.476 1.00 0.00 H new ATOM 0 HG23 VAL A 96 20.995 1.002 -0.973 1.00 0.00 H new ATOM 1524 N LYS A 97 24.696 2.429 1.382 1.00 0.00 N ATOM 1525 CA LYS A 97 25.896 2.685 2.170 1.00 0.00 C ATOM 1526 C LYS A 97 25.864 4.088 2.768 1.00 0.00 C ATOM 1527 O LYS A 97 26.300 4.300 3.899 1.00 0.00 O ATOM 1528 CB LYS A 97 27.145 2.517 1.303 1.00 0.00 C ATOM 1529 CG LYS A 97 27.761 1.130 1.386 1.00 0.00 C ATOM 1530 CD LYS A 97 26.967 0.119 0.576 1.00 0.00 C ATOM 1531 CE LYS A 97 27.421 0.087 -0.875 1.00 0.00 C ATOM 1532 NZ LYS A 97 28.523 -0.890 -1.091 1.00 0.00 N ATOM 0 H LYS A 97 24.846 1.832 0.568 1.00 0.00 H new ATOM 0 HA LYS A 97 25.927 1.962 2.985 1.00 0.00 H new ATOM 0 HB2 LYS A 97 26.888 2.730 0.265 1.00 0.00 H new ATOM 0 HB3 LYS A 97 27.889 3.254 1.605 1.00 0.00 H new ATOM 0 HG2 LYS A 97 28.788 1.164 1.021 1.00 0.00 H new ATOM 0 HG3 LYS A 97 27.803 0.811 2.427 1.00 0.00 H new ATOM 0 HD2 LYS A 97 27.081 -0.872 1.016 1.00 0.00 H new ATOM 0 HD3 LYS A 97 25.907 0.367 0.621 1.00 0.00 H new ATOM 0 HE2 LYS A 97 26.577 -0.171 -1.514 1.00 0.00 H new ATOM 0 HE3 LYS A 97 27.754 1.081 -1.173 1.00 0.00 H new ATOM 0 HZ1 LYS A 97 28.803 -0.881 -2.092 1.00 0.00 H new ATOM 0 HZ2 LYS A 97 29.339 -0.629 -0.501 1.00 0.00 H new ATOM 0 HZ3 LYS A 97 28.198 -1.843 -0.831 1.00 0.00 H new ATOM 1546 N GLU A 98 25.346 5.042 2.001 1.00 0.00 N ATOM 1547 CA GLU A 98 25.258 6.424 2.457 1.00 0.00 C ATOM 1548 C GLU A 98 23.893 6.706 3.080 1.00 0.00 C ATOM 1549 O GLU A 98 22.880 6.820 2.391 1.00 0.00 O ATOM 1550 CB GLU A 98 25.507 7.386 1.293 1.00 0.00 C ATOM 1551 CG GLU A 98 26.743 7.046 0.477 1.00 0.00 C ATOM 1552 CD GLU A 98 27.319 8.253 -0.238 1.00 0.00 C ATOM 1553 OE1 GLU A 98 28.026 9.049 0.416 1.00 0.00 O ATOM 1554 OE2 GLU A 98 27.064 8.402 -1.451 1.00 0.00 O ATOM 0 H GLU A 98 24.981 4.883 1.062 1.00 0.00 H new ATOM 0 HA GLU A 98 26.024 6.578 3.217 1.00 0.00 H new ATOM 0 HB2 GLU A 98 24.636 7.383 0.637 1.00 0.00 H new ATOM 0 HB3 GLU A 98 25.607 8.398 1.684 1.00 0.00 H new ATOM 0 HG2 GLU A 98 27.502 6.621 1.134 1.00 0.00 H new ATOM 0 HG3 GLU A 98 26.491 6.280 -0.256 1.00 0.00 H new ATOM 1561 N PRO A 99 23.866 6.820 4.416 1.00 0.00 N ATOM 1562 CA PRO A 99 22.634 7.089 5.163 1.00 0.00 C ATOM 1563 C PRO A 99 22.114 8.504 4.933 1.00 0.00 C ATOM 1564 O PRO A 99 22.756 9.481 5.318 1.00 0.00 O ATOM 1565 CB PRO A 99 23.056 6.904 6.622 1.00 0.00 C ATOM 1566 CG PRO A 99 24.521 7.173 6.630 1.00 0.00 C ATOM 1567 CD PRO A 99 25.037 6.695 5.301 1.00 0.00 C ATOM 0 HA PRO A 99 21.819 6.434 4.855 1.00 0.00 H new ATOM 0 HB2 PRO A 99 22.524 7.592 7.278 1.00 0.00 H new ATOM 0 HB3 PRO A 99 22.837 5.895 6.973 1.00 0.00 H new ATOM 0 HG2 PRO A 99 24.722 8.235 6.767 1.00 0.00 H new ATOM 0 HG3 PRO A 99 25.010 6.647 7.450 1.00 0.00 H new ATOM 0 HD2 PRO A 99 25.872 7.303 4.952 1.00 0.00 H new ATOM 0 HD3 PRO A 99 25.393 5.666 5.354 1.00 0.00 H new ATOM 1575 N GLY A 100 20.948 8.607 4.304 1.00 0.00 N ATOM 1576 CA GLY A 100 20.362 9.908 4.035 1.00 0.00 C ATOM 1577 C GLY A 100 18.850 9.854 3.937 1.00 0.00 C ATOM 1578 O GLY A 100 18.231 8.867 4.334 1.00 0.00 O ATOM 0 H GLY A 100 20.398 7.813 3.976 1.00 0.00 H new ATOM 0 HA2 GLY A 100 20.647 10.602 4.826 1.00 0.00 H new ATOM 0 HA3 GLY A 100 20.770 10.301 3.104 1.00 0.00 H new ATOM 1582 N ARG A 101 18.255 10.918 3.410 1.00 0.00 N ATOM 1583 CA ARG A 101 16.806 10.989 3.264 1.00 0.00 C ATOM 1584 C ARG A 101 16.382 10.603 1.850 1.00 0.00 C ATOM 1585 O ARG A 101 15.494 9.771 1.663 1.00 0.00 O ATOM 1586 CB ARG A 101 16.308 12.398 3.591 1.00 0.00 C ATOM 1587 CG ARG A 101 16.418 12.758 5.063 1.00 0.00 C ATOM 1588 CD ARG A 101 15.929 14.172 5.330 1.00 0.00 C ATOM 1589 NE ARG A 101 16.242 14.613 6.687 1.00 0.00 N ATOM 1590 CZ ARG A 101 17.477 14.842 7.118 1.00 0.00 C ATOM 1591 NH1 ARG A 101 18.509 14.673 6.304 1.00 0.00 N ATOM 1592 NH2 ARG A 101 17.681 15.242 8.367 1.00 0.00 N ATOM 0 H ARG A 101 18.754 11.743 3.077 1.00 0.00 H new ATOM 0 HA ARG A 101 16.360 10.282 3.964 1.00 0.00 H new ATOM 0 HB2 ARG A 101 16.878 13.120 3.006 1.00 0.00 H new ATOM 0 HB3 ARG A 101 15.267 12.487 3.281 1.00 0.00 H new ATOM 0 HG2 ARG A 101 15.835 12.053 5.655 1.00 0.00 H new ATOM 0 HG3 ARG A 101 17.455 12.664 5.385 1.00 0.00 H new ATOM 0 HD2 ARG A 101 16.385 14.855 4.613 1.00 0.00 H new ATOM 0 HD3 ARG A 101 14.851 14.218 5.173 1.00 0.00 H new ATOM 0 HE ARG A 101 15.470 14.753 7.339 1.00 0.00 H new ATOM 0 HH11 ARG A 101 18.356 14.366 5.343 1.00 0.00 H new ATOM 0 HH12 ARG A 101 19.456 14.850 6.638 1.00 0.00 H new ATOM 0 HH21 ARG A 101 16.889 15.374 8.996 1.00 0.00 H new ATOM 0 HH22 ARG A 101 18.630 15.418 8.698 1.00 0.00 H new ATOM 1606 N TYR A 102 17.021 11.213 0.859 1.00 0.00 N ATOM 1607 CA TYR A 102 16.709 10.936 -0.538 1.00 0.00 C ATOM 1608 C TYR A 102 17.536 9.764 -1.059 1.00 0.00 C ATOM 1609 O TYR A 102 17.671 9.573 -2.268 1.00 0.00 O ATOM 1610 CB TYR A 102 16.964 12.176 -1.396 1.00 0.00 C ATOM 1611 CG TYR A 102 16.345 13.437 -0.836 1.00 0.00 C ATOM 1612 CD1 TYR A 102 14.991 13.494 -0.530 1.00 0.00 C ATOM 1613 CD2 TYR A 102 17.115 14.572 -0.612 1.00 0.00 C ATOM 1614 CE1 TYR A 102 14.422 14.644 -0.019 1.00 0.00 C ATOM 1615 CE2 TYR A 102 16.555 15.726 -0.100 1.00 0.00 C ATOM 1616 CZ TYR A 102 15.208 15.757 0.194 1.00 0.00 C ATOM 1617 OH TYR A 102 14.644 16.905 0.704 1.00 0.00 O ATOM 0 H TYR A 102 17.759 11.903 0.997 1.00 0.00 H new ATOM 0 HA TYR A 102 15.654 10.670 -0.602 1.00 0.00 H new ATOM 0 HB2 TYR A 102 18.039 12.323 -1.497 1.00 0.00 H new ATOM 0 HB3 TYR A 102 16.571 12.002 -2.398 1.00 0.00 H new ATOM 0 HD1 TYR A 102 14.373 12.624 -0.695 1.00 0.00 H new ATOM 0 HD2 TYR A 102 18.170 14.551 -0.842 1.00 0.00 H new ATOM 0 HE1 TYR A 102 13.367 14.672 0.212 1.00 0.00 H new ATOM 0 HE2 TYR A 102 17.168 16.599 0.069 1.00 0.00 H new ATOM 0 HH TYR A 102 15.333 17.596 0.795 1.00 0.00 H new ATOM 1627 N THR A 103 18.087 8.981 -0.137 1.00 0.00 N ATOM 1628 CA THR A 103 18.901 7.828 -0.501 1.00 0.00 C ATOM 1629 C THR A 103 18.156 6.911 -1.464 1.00 0.00 C ATOM 1630 O THR A 103 18.649 6.600 -2.548 1.00 0.00 O ATOM 1631 CB THR A 103 19.318 7.020 0.742 1.00 0.00 C ATOM 1632 OG1 THR A 103 19.921 7.885 1.710 1.00 0.00 O ATOM 1633 CG2 THR A 103 20.292 5.914 0.367 1.00 0.00 C ATOM 0 H THR A 103 17.984 9.124 0.868 1.00 0.00 H new ATOM 0 HA THR A 103 19.795 8.214 -0.990 1.00 0.00 H new ATOM 0 HB THR A 103 18.424 6.566 1.169 1.00 0.00 H new ATOM 0 HG1 THR A 103 20.828 7.572 1.909 1.00 0.00 H new ATOM 0 HG21 THR A 103 20.572 5.357 1.261 1.00 0.00 H new ATOM 0 HG22 THR A 103 19.819 5.240 -0.347 1.00 0.00 H new ATOM 0 HG23 THR A 103 21.184 6.351 -0.082 1.00 0.00 H new ATOM 1641 N PHE A 104 16.965 6.480 -1.061 1.00 0.00 N ATOM 1642 CA PHE A 104 16.151 5.597 -1.889 1.00 0.00 C ATOM 1643 C PHE A 104 15.194 6.401 -2.764 1.00 0.00 C ATOM 1644 O PHE A 104 14.216 5.867 -3.285 1.00 0.00 O ATOM 1645 CB PHE A 104 15.362 4.624 -1.011 1.00 0.00 C ATOM 1646 CG PHE A 104 16.175 4.027 0.103 1.00 0.00 C ATOM 1647 CD1 PHE A 104 16.403 4.738 1.270 1.00 0.00 C ATOM 1648 CD2 PHE A 104 16.710 2.755 -0.018 1.00 0.00 C ATOM 1649 CE1 PHE A 104 17.151 4.192 2.295 1.00 0.00 C ATOM 1650 CE2 PHE A 104 17.458 2.203 1.005 1.00 0.00 C ATOM 1651 CZ PHE A 104 17.678 2.922 2.163 1.00 0.00 C ATOM 0 H PHE A 104 16.542 6.728 -0.166 1.00 0.00 H new ATOM 0 HA PHE A 104 16.819 5.030 -2.538 1.00 0.00 H new ATOM 0 HB2 PHE A 104 14.504 5.145 -0.585 1.00 0.00 H new ATOM 0 HB3 PHE A 104 14.970 3.821 -1.635 1.00 0.00 H new ATOM 0 HD1 PHE A 104 15.991 5.730 1.380 1.00 0.00 H new ATOM 0 HD2 PHE A 104 16.541 2.188 -0.922 1.00 0.00 H new ATOM 0 HE1 PHE A 104 17.324 4.758 3.199 1.00 0.00 H new ATOM 0 HE2 PHE A 104 17.870 1.210 0.899 1.00 0.00 H new ATOM 0 HZ PHE A 104 18.261 2.492 2.964 1.00 0.00 H new ATOM 1661 N GLU A 105 15.483 7.690 -2.918 1.00 0.00 N ATOM 1662 CA GLU A 105 14.648 8.568 -3.728 1.00 0.00 C ATOM 1663 C GLU A 105 14.254 7.889 -5.037 1.00 0.00 C ATOM 1664 O GLU A 105 13.102 7.961 -5.464 1.00 0.00 O ATOM 1665 CB GLU A 105 15.380 9.879 -4.021 1.00 0.00 C ATOM 1666 CG GLU A 105 14.567 10.859 -4.849 1.00 0.00 C ATOM 1667 CD GLU A 105 14.610 10.546 -6.332 1.00 0.00 C ATOM 1668 OE1 GLU A 105 15.626 9.985 -6.791 1.00 0.00 O ATOM 1669 OE2 GLU A 105 13.626 10.863 -7.034 1.00 0.00 O ATOM 0 H GLU A 105 16.289 8.148 -2.492 1.00 0.00 H new ATOM 0 HA GLU A 105 13.741 8.786 -3.164 1.00 0.00 H new ATOM 0 HB2 GLU A 105 15.652 10.352 -3.077 1.00 0.00 H new ATOM 0 HB3 GLU A 105 16.309 9.657 -4.546 1.00 0.00 H new ATOM 0 HG2 GLU A 105 13.532 10.845 -4.508 1.00 0.00 H new ATOM 0 HG3 GLU A 105 14.943 11.868 -4.683 1.00 0.00 H new ATOM 1676 N ASP A 106 15.220 7.232 -5.669 1.00 0.00 N ATOM 1677 CA ASP A 106 14.976 6.539 -6.929 1.00 0.00 C ATOM 1678 C ASP A 106 14.014 5.372 -6.730 1.00 0.00 C ATOM 1679 O ASP A 106 12.912 5.363 -7.279 1.00 0.00 O ATOM 1680 CB ASP A 106 16.292 6.036 -7.523 1.00 0.00 C ATOM 1681 CG ASP A 106 16.084 5.217 -8.782 1.00 0.00 C ATOM 1682 OD1 ASP A 106 15.284 5.643 -9.641 1.00 0.00 O ATOM 1683 OD2 ASP A 106 16.722 4.151 -8.908 1.00 0.00 O ATOM 0 H ASP A 106 16.180 7.165 -5.330 1.00 0.00 H new ATOM 0 HA ASP A 106 14.521 7.247 -7.622 1.00 0.00 H new ATOM 0 HB2 ASP A 106 16.934 6.887 -7.749 1.00 0.00 H new ATOM 0 HB3 ASP A 106 16.814 5.431 -6.782 1.00 0.00 H new ATOM 1688 N ALA A 107 14.439 4.389 -5.943 1.00 0.00 N ATOM 1689 CA ALA A 107 13.615 3.218 -5.671 1.00 0.00 C ATOM 1690 C ALA A 107 12.184 3.620 -5.332 1.00 0.00 C ATOM 1691 O ALA A 107 11.228 3.045 -5.852 1.00 0.00 O ATOM 1692 CB ALA A 107 14.218 2.400 -4.539 1.00 0.00 C ATOM 0 H ALA A 107 15.349 4.381 -5.483 1.00 0.00 H new ATOM 0 HA ALA A 107 13.588 2.606 -6.573 1.00 0.00 H new ATOM 0 HB1 ALA A 107 13.592 1.528 -4.346 1.00 0.00 H new ATOM 0 HB2 ALA A 107 15.219 2.073 -4.820 1.00 0.00 H new ATOM 0 HB3 ALA A 107 14.275 3.012 -3.639 1.00 0.00 H new ATOM 1698 N GLN A 108 12.044 4.610 -4.456 1.00 0.00 N ATOM 1699 CA GLN A 108 10.729 5.087 -4.046 1.00 0.00 C ATOM 1700 C GLN A 108 9.858 5.392 -5.260 1.00 0.00 C ATOM 1701 O GLN A 108 8.668 5.079 -5.276 1.00 0.00 O ATOM 1702 CB GLN A 108 10.865 6.337 -3.175 1.00 0.00 C ATOM 1703 CG GLN A 108 9.532 6.924 -2.741 1.00 0.00 C ATOM 1704 CD GLN A 108 9.690 8.068 -1.758 1.00 0.00 C ATOM 1705 OE1 GLN A 108 10.377 9.051 -2.037 1.00 0.00 O ATOM 1706 NE2 GLN A 108 9.052 7.945 -0.600 1.00 0.00 N ATOM 0 H GLN A 108 12.825 5.097 -4.017 1.00 0.00 H new ATOM 0 HA GLN A 108 10.249 4.299 -3.466 1.00 0.00 H new ATOM 0 HB2 GLN A 108 11.450 6.090 -2.289 1.00 0.00 H new ATOM 0 HB3 GLN A 108 11.424 7.094 -3.725 1.00 0.00 H new ATOM 0 HG2 GLN A 108 8.992 7.277 -3.619 1.00 0.00 H new ATOM 0 HG3 GLN A 108 8.925 6.141 -2.287 1.00 0.00 H new ATOM 0 HE21 GLN A 108 8.494 7.113 -0.411 1.00 0.00 H new ATOM 0 HE22 GLN A 108 9.120 8.683 0.101 1.00 0.00 H new ATOM 1715 N GLU A 109 10.459 6.005 -6.275 1.00 0.00 N ATOM 1716 CA GLU A 109 9.737 6.353 -7.493 1.00 0.00 C ATOM 1717 C GLU A 109 9.435 5.107 -8.321 1.00 0.00 C ATOM 1718 O GLU A 109 8.310 4.913 -8.783 1.00 0.00 O ATOM 1719 CB GLU A 109 10.547 7.348 -8.326 1.00 0.00 C ATOM 1720 CG GLU A 109 10.129 7.402 -9.786 1.00 0.00 C ATOM 1721 CD GLU A 109 11.016 8.312 -10.614 1.00 0.00 C ATOM 1722 OE1 GLU A 109 12.076 7.845 -11.080 1.00 0.00 O ATOM 1723 OE2 GLU A 109 10.648 9.492 -10.796 1.00 0.00 O ATOM 0 H GLU A 109 11.444 6.271 -6.278 1.00 0.00 H new ATOM 0 HA GLU A 109 8.793 6.815 -7.206 1.00 0.00 H new ATOM 0 HB2 GLU A 109 10.444 8.342 -7.890 1.00 0.00 H new ATOM 0 HB3 GLU A 109 11.603 7.082 -8.269 1.00 0.00 H new ATOM 0 HG2 GLU A 109 10.155 6.396 -10.205 1.00 0.00 H new ATOM 0 HG3 GLU A 109 9.097 7.748 -9.852 1.00 0.00 H new ATOM 1730 N HIS A 110 10.448 4.266 -8.505 1.00 0.00 N ATOM 1731 CA HIS A 110 10.291 3.039 -9.278 1.00 0.00 C ATOM 1732 C HIS A 110 9.046 2.275 -8.838 1.00 0.00 C ATOM 1733 O HIS A 110 8.174 1.970 -9.652 1.00 0.00 O ATOM 1734 CB HIS A 110 11.528 2.153 -9.123 1.00 0.00 C ATOM 1735 CG HIS A 110 11.551 0.988 -10.064 1.00 0.00 C ATOM 1736 ND1 HIS A 110 11.705 1.124 -11.427 1.00 0.00 N ATOM 1737 CD2 HIS A 110 11.441 -0.341 -9.830 1.00 0.00 C ATOM 1738 CE1 HIS A 110 11.686 -0.071 -11.991 1.00 0.00 C ATOM 1739 NE2 HIS A 110 11.528 -0.977 -11.044 1.00 0.00 N ATOM 0 H HIS A 110 11.385 4.412 -8.130 1.00 0.00 H new ATOM 0 HA HIS A 110 10.177 3.312 -10.327 1.00 0.00 H new ATOM 0 HB2 HIS A 110 12.421 2.758 -9.284 1.00 0.00 H new ATOM 0 HB3 HIS A 110 11.574 1.783 -8.099 1.00 0.00 H new ATOM 0 HD2 HIS A 110 11.309 -0.813 -8.868 1.00 0.00 H new ATOM 0 HE1 HIS A 110 11.783 -0.272 -13.048 1.00 0.00 H new ATOM 0 HE2 HIS A 110 11.479 -1.985 -11.190 1.00 0.00 H new ATOM 1747 N ILE A 111 8.971 1.969 -7.547 1.00 0.00 N ATOM 1748 CA ILE A 111 7.832 1.241 -7.000 1.00 0.00 C ATOM 1749 C ILE A 111 6.530 1.997 -7.240 1.00 0.00 C ATOM 1750 O ILE A 111 5.507 1.401 -7.579 1.00 0.00 O ATOM 1751 CB ILE A 111 7.997 0.992 -5.489 1.00 0.00 C ATOM 1752 CG1 ILE A 111 9.237 0.135 -5.223 1.00 0.00 C ATOM 1753 CG2 ILE A 111 6.753 0.323 -4.924 1.00 0.00 C ATOM 1754 CD1 ILE A 111 9.157 -1.247 -5.831 1.00 0.00 C ATOM 0 H ILE A 111 9.685 2.214 -6.861 1.00 0.00 H new ATOM 0 HA ILE A 111 7.793 0.282 -7.516 1.00 0.00 H new ATOM 0 HB ILE A 111 8.128 1.952 -4.990 1.00 0.00 H new ATOM 0 HG12 ILE A 111 10.114 0.647 -5.618 1.00 0.00 H new ATOM 0 HG13 ILE A 111 9.380 0.042 -4.146 1.00 0.00 H new ATOM 0 HG21 ILE A 111 6.885 0.153 -3.855 1.00 0.00 H new ATOM 0 HG22 ILE A 111 5.888 0.967 -5.085 1.00 0.00 H new ATOM 0 HG23 ILE A 111 6.593 -0.631 -5.426 1.00 0.00 H new ATOM 0 HD11 ILE A 111 10.069 -1.798 -5.603 1.00 0.00 H new ATOM 0 HD12 ILE A 111 8.299 -1.777 -5.417 1.00 0.00 H new ATOM 0 HD13 ILE A 111 9.045 -1.163 -6.912 1.00 0.00 H new ATOM 1766 N TYR A 112 6.575 3.313 -7.064 1.00 0.00 N ATOM 1767 CA TYR A 112 5.398 4.151 -7.261 1.00 0.00 C ATOM 1768 C TYR A 112 4.811 3.947 -8.655 1.00 0.00 C ATOM 1769 O TYR A 112 3.630 3.633 -8.804 1.00 0.00 O ATOM 1770 CB TYR A 112 5.756 5.624 -7.058 1.00 0.00 C ATOM 1771 CG TYR A 112 4.668 6.578 -7.498 1.00 0.00 C ATOM 1772 CD1 TYR A 112 4.428 6.814 -8.846 1.00 0.00 C ATOM 1773 CD2 TYR A 112 3.880 7.242 -6.566 1.00 0.00 C ATOM 1774 CE1 TYR A 112 3.436 7.685 -9.253 1.00 0.00 C ATOM 1775 CE2 TYR A 112 2.885 8.113 -6.964 1.00 0.00 C ATOM 1776 CZ TYR A 112 2.667 8.332 -8.309 1.00 0.00 C ATOM 1777 OH TYR A 112 1.677 9.199 -8.710 1.00 0.00 O ATOM 0 H TYR A 112 7.414 3.822 -6.785 1.00 0.00 H new ATOM 0 HA TYR A 112 4.649 3.860 -6.525 1.00 0.00 H new ATOM 0 HB2 TYR A 112 5.972 5.795 -6.003 1.00 0.00 H new ATOM 0 HB3 TYR A 112 6.669 5.847 -7.611 1.00 0.00 H new ATOM 0 HD1 TYR A 112 5.027 6.308 -9.588 1.00 0.00 H new ATOM 0 HD2 TYR A 112 4.048 7.074 -5.513 1.00 0.00 H new ATOM 0 HE1 TYR A 112 3.264 7.858 -10.305 1.00 0.00 H new ATOM 0 HE2 TYR A 112 2.281 8.620 -6.227 1.00 0.00 H new ATOM 0 HH TYR A 112 1.088 9.396 -7.952 1.00 0.00 H new ATOM 1787 N LYS A 113 5.645 4.126 -9.673 1.00 0.00 N ATOM 1788 CA LYS A 113 5.212 3.961 -11.056 1.00 0.00 C ATOM 1789 C LYS A 113 4.636 2.567 -11.282 1.00 0.00 C ATOM 1790 O LYS A 113 3.951 2.321 -12.275 1.00 0.00 O ATOM 1791 CB LYS A 113 6.384 4.201 -12.011 1.00 0.00 C ATOM 1792 CG LYS A 113 7.148 5.483 -11.726 1.00 0.00 C ATOM 1793 CD LYS A 113 8.340 5.639 -12.655 1.00 0.00 C ATOM 1794 CE LYS A 113 9.426 4.622 -12.344 1.00 0.00 C ATOM 1795 NZ LYS A 113 10.238 4.291 -13.548 1.00 0.00 N ATOM 0 H LYS A 113 6.626 4.386 -9.567 1.00 0.00 H new ATOM 0 HA LYS A 113 4.432 4.695 -11.257 1.00 0.00 H new ATOM 0 HB2 LYS A 113 7.071 3.357 -11.949 1.00 0.00 H new ATOM 0 HB3 LYS A 113 6.008 4.232 -13.034 1.00 0.00 H new ATOM 0 HG2 LYS A 113 6.482 6.338 -11.841 1.00 0.00 H new ATOM 0 HG3 LYS A 113 7.490 5.482 -10.691 1.00 0.00 H new ATOM 0 HD2 LYS A 113 8.015 5.521 -13.689 1.00 0.00 H new ATOM 0 HD3 LYS A 113 8.746 6.646 -12.562 1.00 0.00 H new ATOM 0 HE2 LYS A 113 10.078 5.014 -11.563 1.00 0.00 H new ATOM 0 HE3 LYS A 113 8.970 3.713 -11.952 1.00 0.00 H new ATOM 0 HZ1 LYS A 113 10.967 3.594 -13.294 1.00 0.00 H new ATOM 0 HZ2 LYS A 113 9.621 3.893 -14.284 1.00 0.00 H new ATOM 0 HZ3 LYS A 113 10.694 5.154 -13.907 1.00 0.00 H new ATOM 1809 N LEU A 114 4.917 1.658 -10.354 1.00 0.00 N ATOM 1810 CA LEU A 114 4.424 0.288 -10.452 1.00 0.00 C ATOM 1811 C LEU A 114 3.086 0.138 -9.736 1.00 0.00 C ATOM 1812 O LEU A 114 2.043 -0.002 -10.374 1.00 0.00 O ATOM 1813 CB LEU A 114 5.445 -0.685 -9.858 1.00 0.00 C ATOM 1814 CG LEU A 114 4.921 -2.079 -9.512 1.00 0.00 C ATOM 1815 CD1 LEU A 114 5.231 -3.059 -10.633 1.00 0.00 C ATOM 1816 CD2 LEU A 114 5.518 -2.563 -8.199 1.00 0.00 C ATOM 0 H LEU A 114 5.483 1.845 -9.526 1.00 0.00 H new ATOM 0 HA LEU A 114 4.279 0.055 -11.507 1.00 0.00 H new ATOM 0 HB2 LEU A 114 6.268 -0.793 -10.565 1.00 0.00 H new ATOM 0 HB3 LEU A 114 5.858 -0.239 -8.953 1.00 0.00 H new ATOM 0 HG LEU A 114 3.839 -2.021 -9.396 1.00 0.00 H new ATOM 0 HD11 LEU A 114 4.851 -4.046 -10.369 1.00 0.00 H new ATOM 0 HD12 LEU A 114 4.755 -2.721 -11.554 1.00 0.00 H new ATOM 0 HD13 LEU A 114 6.310 -3.113 -10.781 1.00 0.00 H new ATOM 0 HD21 LEU A 114 5.134 -3.557 -7.969 1.00 0.00 H new ATOM 0 HD22 LEU A 114 6.604 -2.605 -8.287 1.00 0.00 H new ATOM 0 HD23 LEU A 114 5.245 -1.874 -7.399 1.00 0.00 H new ATOM 1828 N MET A 115 3.124 0.170 -8.408 1.00 0.00 N ATOM 1829 CA MET A 115 1.913 0.042 -7.606 1.00 0.00 C ATOM 1830 C MET A 115 0.793 0.912 -8.168 1.00 0.00 C ATOM 1831 O MET A 115 -0.371 0.511 -8.183 1.00 0.00 O ATOM 1832 CB MET A 115 2.195 0.428 -6.153 1.00 0.00 C ATOM 1833 CG MET A 115 3.355 -0.336 -5.535 1.00 0.00 C ATOM 1834 SD MET A 115 3.756 0.235 -3.872 1.00 0.00 S ATOM 1835 CE MET A 115 3.929 1.996 -4.151 1.00 0.00 C ATOM 0 H MET A 115 3.980 0.283 -7.865 1.00 0.00 H new ATOM 0 HA MET A 115 1.592 -0.999 -7.642 1.00 0.00 H new ATOM 0 HB2 MET A 115 2.407 1.496 -6.104 1.00 0.00 H new ATOM 0 HB3 MET A 115 1.298 0.254 -5.559 1.00 0.00 H new ATOM 0 HG2 MET A 115 3.109 -1.397 -5.501 1.00 0.00 H new ATOM 0 HG3 MET A 115 4.233 -0.233 -6.172 1.00 0.00 H new ATOM 0 HE1 MET A 115 4.832 2.356 -3.658 1.00 0.00 H new ATOM 0 HE2 MET A 115 3.999 2.190 -5.221 1.00 0.00 H new ATOM 0 HE3 MET A 115 3.062 2.516 -3.744 1.00 0.00 H new ATOM 1845 N LYS A 116 1.153 2.106 -8.628 1.00 0.00 N ATOM 1846 CA LYS A 116 0.179 3.034 -9.192 1.00 0.00 C ATOM 1847 C LYS A 116 -0.766 2.315 -10.150 1.00 0.00 C ATOM 1848 O LYS A 116 -1.983 2.481 -10.076 1.00 0.00 O ATOM 1849 CB LYS A 116 0.894 4.173 -9.922 1.00 0.00 C ATOM 1850 CG LYS A 116 1.498 3.758 -11.252 1.00 0.00 C ATOM 1851 CD LYS A 116 2.162 4.932 -11.953 1.00 0.00 C ATOM 1852 CE LYS A 116 1.141 5.804 -12.669 1.00 0.00 C ATOM 1853 NZ LYS A 116 0.724 6.965 -11.836 1.00 0.00 N ATOM 0 H LYS A 116 2.112 2.454 -8.621 1.00 0.00 H new ATOM 0 HA LYS A 116 -0.409 3.448 -8.373 1.00 0.00 H new ATOM 0 HB2 LYS A 116 0.187 4.985 -10.091 1.00 0.00 H new ATOM 0 HB3 LYS A 116 1.683 4.566 -9.281 1.00 0.00 H new ATOM 0 HG2 LYS A 116 2.231 2.968 -11.089 1.00 0.00 H new ATOM 0 HG3 LYS A 116 0.720 3.343 -11.893 1.00 0.00 H new ATOM 0 HD2 LYS A 116 2.707 5.532 -11.224 1.00 0.00 H new ATOM 0 HD3 LYS A 116 2.893 4.562 -12.671 1.00 0.00 H new ATOM 0 HE2 LYS A 116 1.564 6.163 -13.607 1.00 0.00 H new ATOM 0 HE3 LYS A 116 0.266 5.206 -12.922 1.00 0.00 H new ATOM 0 HZ1 LYS A 116 -0.311 7.058 -11.864 1.00 0.00 H new ATOM 0 HZ2 LYS A 116 1.032 6.816 -10.854 1.00 0.00 H new ATOM 0 HZ3 LYS A 116 1.160 7.833 -12.208 1.00 0.00 H new ATOM 1867 N SER A 117 -0.197 1.516 -11.047 1.00 0.00 N ATOM 1868 CA SER A 117 -0.989 0.774 -12.021 1.00 0.00 C ATOM 1869 C SER A 117 -0.817 -0.729 -11.828 1.00 0.00 C ATOM 1870 O SER A 117 -1.140 -1.521 -12.715 1.00 0.00 O ATOM 1871 CB SER A 117 -0.586 1.168 -13.443 1.00 0.00 C ATOM 1872 OG SER A 117 -1.306 2.307 -13.881 1.00 0.00 O ATOM 0 H SER A 117 0.809 1.366 -11.119 1.00 0.00 H new ATOM 0 HA SER A 117 -2.039 1.024 -11.867 1.00 0.00 H new ATOM 0 HB2 SER A 117 0.484 1.375 -13.477 1.00 0.00 H new ATOM 0 HB3 SER A 117 -0.771 0.335 -14.121 1.00 0.00 H new ATOM 0 HG SER A 117 -1.029 2.539 -14.792 1.00 0.00 H new ATOM 1878 N ASP A 118 -0.306 -1.116 -10.665 1.00 0.00 N ATOM 1879 CA ASP A 118 -0.092 -2.524 -10.354 1.00 0.00 C ATOM 1880 C ASP A 118 -1.148 -3.032 -9.377 1.00 0.00 C ATOM 1881 O ASP A 118 -1.918 -3.938 -9.696 1.00 0.00 O ATOM 1882 CB ASP A 118 1.305 -2.732 -9.767 1.00 0.00 C ATOM 1883 CG ASP A 118 2.306 -3.201 -10.805 1.00 0.00 C ATOM 1884 OD1 ASP A 118 2.824 -2.349 -11.557 1.00 0.00 O ATOM 1885 OD2 ASP A 118 2.569 -4.420 -10.867 1.00 0.00 O ATOM 0 H ASP A 118 -0.032 -0.474 -9.921 1.00 0.00 H new ATOM 0 HA ASP A 118 -0.177 -3.092 -11.281 1.00 0.00 H new ATOM 0 HB2 ASP A 118 1.654 -1.798 -9.327 1.00 0.00 H new ATOM 0 HB3 ASP A 118 1.252 -3.464 -8.961 1.00 0.00 H new ATOM 1890 N SER A 119 -1.176 -2.444 -8.186 1.00 0.00 N ATOM 1891 CA SER A 119 -2.134 -2.840 -7.160 1.00 0.00 C ATOM 1892 C SER A 119 -3.394 -1.983 -7.234 1.00 0.00 C ATOM 1893 O SER A 119 -4.507 -2.502 -7.328 1.00 0.00 O ATOM 1894 CB SER A 119 -1.504 -2.723 -5.771 1.00 0.00 C ATOM 1895 OG SER A 119 -0.317 -3.492 -5.683 1.00 0.00 O ATOM 0 H SER A 119 -0.546 -1.692 -7.907 1.00 0.00 H new ATOM 0 HA SER A 119 -2.411 -3.879 -7.338 1.00 0.00 H new ATOM 0 HB2 SER A 119 -1.281 -1.678 -5.556 1.00 0.00 H new ATOM 0 HB3 SER A 119 -2.215 -3.059 -5.016 1.00 0.00 H new ATOM 0 HG SER A 119 0.299 -3.072 -5.047 1.00 0.00 H new ATOM 1901 N TYR A 120 -3.211 -0.668 -7.189 1.00 0.00 N ATOM 1902 CA TYR A 120 -4.332 0.262 -7.248 1.00 0.00 C ATOM 1903 C TYR A 120 -5.443 -0.279 -8.142 1.00 0.00 C ATOM 1904 O TYR A 120 -6.611 -0.341 -7.757 1.00 0.00 O ATOM 1905 CB TYR A 120 -3.865 1.624 -7.764 1.00 0.00 C ATOM 1906 CG TYR A 120 -4.938 2.392 -8.503 1.00 0.00 C ATOM 1907 CD1 TYR A 120 -5.992 2.985 -7.819 1.00 0.00 C ATOM 1908 CD2 TYR A 120 -4.896 2.526 -9.885 1.00 0.00 C ATOM 1909 CE1 TYR A 120 -6.974 3.686 -8.490 1.00 0.00 C ATOM 1910 CE2 TYR A 120 -5.873 3.228 -10.565 1.00 0.00 C ATOM 1911 CZ TYR A 120 -6.910 3.805 -9.863 1.00 0.00 C ATOM 1912 OH TYR A 120 -7.886 4.505 -10.535 1.00 0.00 O ATOM 0 H TYR A 120 -2.297 -0.222 -7.112 1.00 0.00 H new ATOM 0 HA TYR A 120 -4.727 0.379 -6.239 1.00 0.00 H new ATOM 0 HB2 TYR A 120 -3.516 2.222 -6.922 1.00 0.00 H new ATOM 0 HB3 TYR A 120 -3.012 1.479 -8.427 1.00 0.00 H new ATOM 0 HD1 TYR A 120 -6.044 2.896 -6.744 1.00 0.00 H new ATOM 0 HD2 TYR A 120 -4.086 2.074 -10.438 1.00 0.00 H new ATOM 0 HE1 TYR A 120 -7.788 4.139 -7.943 1.00 0.00 H new ATOM 0 HE2 TYR A 120 -5.825 3.324 -11.640 1.00 0.00 H new ATOM 0 HH TYR A 120 -7.693 4.495 -11.496 1.00 0.00 H new ATOM 1922 N PRO A 121 -5.072 -0.681 -9.367 1.00 0.00 N ATOM 1923 CA PRO A 121 -6.021 -1.226 -10.342 1.00 0.00 C ATOM 1924 C PRO A 121 -6.925 -2.295 -9.737 1.00 0.00 C ATOM 1925 O PRO A 121 -8.150 -2.182 -9.779 1.00 0.00 O ATOM 1926 CB PRO A 121 -5.116 -1.836 -11.415 1.00 0.00 C ATOM 1927 CG PRO A 121 -3.844 -1.066 -11.321 1.00 0.00 C ATOM 1928 CD PRO A 121 -3.698 -0.636 -9.893 1.00 0.00 C ATOM 0 HA PRO A 121 -6.700 -0.462 -10.721 1.00 0.00 H new ATOM 0 HB2 PRO A 121 -4.950 -2.898 -11.236 1.00 0.00 H new ATOM 0 HB3 PRO A 121 -5.561 -1.746 -12.406 1.00 0.00 H new ATOM 0 HG2 PRO A 121 -2.997 -1.680 -11.627 1.00 0.00 H new ATOM 0 HG3 PRO A 121 -3.867 -0.201 -11.984 1.00 0.00 H new ATOM 0 HD2 PRO A 121 -3.037 -1.303 -9.340 1.00 0.00 H new ATOM 0 HD3 PRO A 121 -3.274 0.366 -9.819 1.00 0.00 H new ATOM 1936 N ARG A 122 -6.313 -3.332 -9.175 1.00 0.00 N ATOM 1937 CA ARG A 122 -7.063 -4.422 -8.562 1.00 0.00 C ATOM 1938 C ARG A 122 -8.075 -3.886 -7.555 1.00 0.00 C ATOM 1939 O ARG A 122 -9.214 -4.351 -7.495 1.00 0.00 O ATOM 1940 CB ARG A 122 -6.110 -5.400 -7.873 1.00 0.00 C ATOM 1941 CG ARG A 122 -5.504 -6.427 -8.816 1.00 0.00 C ATOM 1942 CD ARG A 122 -4.814 -7.546 -8.051 1.00 0.00 C ATOM 1943 NE ARG A 122 -4.489 -8.679 -8.915 1.00 0.00 N ATOM 1944 CZ ARG A 122 -3.271 -8.916 -9.388 1.00 0.00 C ATOM 1945 NH1 ARG A 122 -2.268 -8.105 -9.083 1.00 0.00 N ATOM 1946 NH2 ARG A 122 -3.055 -9.968 -10.168 1.00 0.00 N ATOM 0 H ARG A 122 -5.300 -3.441 -9.131 1.00 0.00 H new ATOM 0 HA ARG A 122 -7.604 -4.946 -9.350 1.00 0.00 H new ATOM 0 HB2 ARG A 122 -5.307 -4.837 -7.398 1.00 0.00 H new ATOM 0 HB3 ARG A 122 -6.647 -5.920 -7.080 1.00 0.00 H new ATOM 0 HG2 ARG A 122 -6.285 -6.846 -9.450 1.00 0.00 H new ATOM 0 HG3 ARG A 122 -4.786 -5.939 -9.475 1.00 0.00 H new ATOM 0 HD2 ARG A 122 -3.901 -7.164 -7.595 1.00 0.00 H new ATOM 0 HD3 ARG A 122 -5.459 -7.882 -7.239 1.00 0.00 H new ATOM 0 HE ARG A 122 -5.238 -9.323 -9.168 1.00 0.00 H new ATOM 0 HH11 ARG A 122 -2.431 -7.296 -8.483 1.00 0.00 H new ATOM 0 HH12 ARG A 122 -1.334 -8.290 -9.448 1.00 0.00 H new ATOM 0 HH21 ARG A 122 -3.825 -10.594 -10.404 1.00 0.00 H new ATOM 0 HH22 ARG A 122 -2.119 -10.150 -10.531 1.00 0.00 H new ATOM 1960 N PHE A 123 -7.653 -2.905 -6.764 1.00 0.00 N ATOM 1961 CA PHE A 123 -8.522 -2.306 -5.757 1.00 0.00 C ATOM 1962 C PHE A 123 -9.913 -2.044 -6.327 1.00 0.00 C ATOM 1963 O PHE A 123 -10.922 -2.277 -5.660 1.00 0.00 O ATOM 1964 CB PHE A 123 -7.915 -0.999 -5.241 1.00 0.00 C ATOM 1965 CG PHE A 123 -8.366 -0.636 -3.855 1.00 0.00 C ATOM 1966 CD1 PHE A 123 -8.268 -1.549 -2.819 1.00 0.00 C ATOM 1967 CD2 PHE A 123 -8.887 0.620 -3.590 1.00 0.00 C ATOM 1968 CE1 PHE A 123 -8.681 -1.218 -1.542 1.00 0.00 C ATOM 1969 CE2 PHE A 123 -9.302 0.958 -2.315 1.00 0.00 C ATOM 1970 CZ PHE A 123 -9.200 0.037 -1.290 1.00 0.00 C ATOM 0 H PHE A 123 -6.714 -2.508 -6.801 1.00 0.00 H new ATOM 0 HA PHE A 123 -8.614 -3.008 -4.928 1.00 0.00 H new ATOM 0 HB2 PHE A 123 -6.828 -1.083 -5.251 1.00 0.00 H new ATOM 0 HB3 PHE A 123 -8.178 -0.191 -5.924 1.00 0.00 H new ATOM 0 HD1 PHE A 123 -7.864 -2.532 -3.011 1.00 0.00 H new ATOM 0 HD2 PHE A 123 -8.970 1.343 -4.388 1.00 0.00 H new ATOM 0 HE1 PHE A 123 -8.598 -1.939 -0.743 1.00 0.00 H new ATOM 0 HE2 PHE A 123 -9.705 1.941 -2.121 1.00 0.00 H new ATOM 0 HZ PHE A 123 -9.525 0.298 -0.294 1.00 0.00 H new ATOM 1980 N ILE A 124 -9.958 -1.557 -7.562 1.00 0.00 N ATOM 1981 CA ILE A 124 -11.225 -1.264 -8.221 1.00 0.00 C ATOM 1982 C ILE A 124 -11.975 -2.546 -8.565 1.00 0.00 C ATOM 1983 O ILE A 124 -13.203 -2.598 -8.490 1.00 0.00 O ATOM 1984 CB ILE A 124 -11.013 -0.445 -9.508 1.00 0.00 C ATOM 1985 CG1 ILE A 124 -10.437 0.932 -9.173 1.00 0.00 C ATOM 1986 CG2 ILE A 124 -12.323 -0.306 -10.269 1.00 0.00 C ATOM 1987 CD1 ILE A 124 -8.925 0.967 -9.159 1.00 0.00 C ATOM 0 H ILE A 124 -9.132 -1.357 -8.127 1.00 0.00 H new ATOM 0 HA ILE A 124 -11.818 -0.677 -7.520 1.00 0.00 H new ATOM 0 HB ILE A 124 -10.300 -0.972 -10.143 1.00 0.00 H new ATOM 0 HG12 ILE A 124 -10.802 1.657 -9.901 1.00 0.00 H new ATOM 0 HG13 ILE A 124 -10.809 1.245 -8.197 1.00 0.00 H new ATOM 0 HG21 ILE A 124 -12.157 0.275 -11.176 1.00 0.00 H new ATOM 0 HG22 ILE A 124 -12.696 -1.295 -10.535 1.00 0.00 H new ATOM 0 HG23 ILE A 124 -13.056 0.202 -9.642 1.00 0.00 H new ATOM 0 HD11 ILE A 124 -8.587 1.974 -8.914 1.00 0.00 H new ATOM 0 HD12 ILE A 124 -8.552 0.267 -8.411 1.00 0.00 H new ATOM 0 HD13 ILE A 124 -8.545 0.685 -10.141 1.00 0.00 H new ATOM 1999 N ARG A 125 -11.229 -3.579 -8.942 1.00 0.00 N ATOM 2000 CA ARG A 125 -11.823 -4.862 -9.297 1.00 0.00 C ATOM 2001 C ARG A 125 -12.431 -5.537 -8.071 1.00 0.00 C ATOM 2002 O ARG A 125 -13.557 -6.033 -8.117 1.00 0.00 O ATOM 2003 CB ARG A 125 -10.773 -5.778 -9.928 1.00 0.00 C ATOM 2004 CG ARG A 125 -9.886 -5.077 -10.945 1.00 0.00 C ATOM 2005 CD ARG A 125 -10.695 -4.553 -12.122 1.00 0.00 C ATOM 2006 NE ARG A 125 -9.915 -4.535 -13.357 1.00 0.00 N ATOM 2007 CZ ARG A 125 -10.420 -4.831 -14.549 1.00 0.00 C ATOM 2008 NH1 ARG A 125 -11.698 -5.166 -14.667 1.00 0.00 N ATOM 2009 NH2 ARG A 125 -9.647 -4.793 -15.627 1.00 0.00 N ATOM 0 H ARG A 125 -10.212 -3.552 -9.009 1.00 0.00 H new ATOM 0 HA ARG A 125 -12.617 -4.678 -10.021 1.00 0.00 H new ATOM 0 HB2 ARG A 125 -10.147 -6.196 -9.140 1.00 0.00 H new ATOM 0 HB3 ARG A 125 -11.277 -6.614 -10.413 1.00 0.00 H new ATOM 0 HG2 ARG A 125 -9.363 -4.250 -10.465 1.00 0.00 H new ATOM 0 HG3 ARG A 125 -9.125 -5.770 -11.305 1.00 0.00 H new ATOM 0 HD2 ARG A 125 -11.579 -5.176 -12.260 1.00 0.00 H new ATOM 0 HD3 ARG A 125 -11.047 -3.545 -11.900 1.00 0.00 H new ATOM 0 HE ARG A 125 -8.929 -4.281 -13.301 1.00 0.00 H new ATOM 0 HH11 ARG A 125 -12.296 -5.197 -13.841 1.00 0.00 H new ATOM 0 HH12 ARG A 125 -12.083 -5.393 -15.584 1.00 0.00 H new ATOM 0 HH21 ARG A 125 -8.664 -4.536 -15.541 1.00 0.00 H new ATOM 0 HH22 ARG A 125 -10.036 -5.021 -16.542 1.00 0.00 H new ATOM 2023 N SER A 126 -11.678 -5.553 -6.976 1.00 0.00 N ATOM 2024 CA SER A 126 -12.141 -6.172 -5.739 1.00 0.00 C ATOM 2025 C SER A 126 -13.370 -5.448 -5.196 1.00 0.00 C ATOM 2026 O SER A 126 -13.801 -4.435 -5.748 1.00 0.00 O ATOM 2027 CB SER A 126 -11.026 -6.163 -4.692 1.00 0.00 C ATOM 2028 OG SER A 126 -10.560 -4.846 -4.453 1.00 0.00 O ATOM 0 H SER A 126 -10.745 -5.145 -6.920 1.00 0.00 H new ATOM 0 HA SER A 126 -12.416 -7.204 -5.958 1.00 0.00 H new ATOM 0 HB2 SER A 126 -11.393 -6.596 -3.762 1.00 0.00 H new ATOM 0 HB3 SER A 126 -10.200 -6.788 -5.031 1.00 0.00 H new ATOM 0 HG SER A 126 -10.986 -4.229 -5.083 1.00 0.00 H new ATOM 2034 N SER A 127 -13.928 -5.975 -4.112 1.00 0.00 N ATOM 2035 CA SER A 127 -15.110 -5.382 -3.495 1.00 0.00 C ATOM 2036 C SER A 127 -14.723 -4.519 -2.298 1.00 0.00 C ATOM 2037 O SER A 127 -15.374 -3.517 -2.005 1.00 0.00 O ATOM 2038 CB SER A 127 -16.084 -6.477 -3.056 1.00 0.00 C ATOM 2039 OG SER A 127 -16.703 -7.088 -4.175 1.00 0.00 O ATOM 0 H SER A 127 -13.582 -6.811 -3.642 1.00 0.00 H new ATOM 0 HA SER A 127 -15.597 -4.747 -4.235 1.00 0.00 H new ATOM 0 HB2 SER A 127 -15.552 -7.230 -2.475 1.00 0.00 H new ATOM 0 HB3 SER A 127 -16.846 -6.050 -2.403 1.00 0.00 H new ATOM 0 HG SER A 127 -17.319 -7.785 -3.868 1.00 0.00 H new ATOM 2045 N ALA A 128 -13.657 -4.916 -1.610 1.00 0.00 N ATOM 2046 CA ALA A 128 -13.181 -4.179 -0.447 1.00 0.00 C ATOM 2047 C ALA A 128 -13.344 -2.676 -0.645 1.00 0.00 C ATOM 2048 O ALA A 128 -13.832 -1.972 0.240 1.00 0.00 O ATOM 2049 CB ALA A 128 -11.726 -4.522 -0.163 1.00 0.00 C ATOM 0 H ALA A 128 -13.107 -5.744 -1.839 1.00 0.00 H new ATOM 0 HA ALA A 128 -13.786 -4.473 0.411 1.00 0.00 H new ATOM 0 HB1 ALA A 128 -11.384 -3.964 0.709 1.00 0.00 H new ATOM 0 HB2 ALA A 128 -11.635 -5.591 0.032 1.00 0.00 H new ATOM 0 HB3 ALA A 128 -11.115 -4.258 -1.026 1.00 0.00 H new ATOM 2055 N TYR A 129 -12.931 -2.190 -1.810 1.00 0.00 N ATOM 2056 CA TYR A 129 -13.028 -0.769 -2.123 1.00 0.00 C ATOM 2057 C TYR A 129 -14.486 -0.325 -2.192 1.00 0.00 C ATOM 2058 O TYR A 129 -14.862 0.699 -1.621 1.00 0.00 O ATOM 2059 CB TYR A 129 -12.328 -0.468 -3.449 1.00 0.00 C ATOM 2060 CG TYR A 129 -12.839 0.780 -4.134 1.00 0.00 C ATOM 2061 CD1 TYR A 129 -13.944 0.732 -4.975 1.00 0.00 C ATOM 2062 CD2 TYR A 129 -12.215 2.006 -3.940 1.00 0.00 C ATOM 2063 CE1 TYR A 129 -14.413 1.869 -5.603 1.00 0.00 C ATOM 2064 CE2 TYR A 129 -12.679 3.149 -4.563 1.00 0.00 C ATOM 2065 CZ TYR A 129 -13.777 3.075 -5.394 1.00 0.00 C ATOM 2066 OH TYR A 129 -14.241 4.211 -6.017 1.00 0.00 O ATOM 0 H TYR A 129 -12.526 -2.759 -2.553 1.00 0.00 H new ATOM 0 HA TYR A 129 -12.535 -0.213 -1.326 1.00 0.00 H new ATOM 0 HB2 TYR A 129 -11.258 -0.362 -3.269 1.00 0.00 H new ATOM 0 HB3 TYR A 129 -12.456 -1.318 -4.119 1.00 0.00 H new ATOM 0 HD1 TYR A 129 -14.445 -0.211 -5.140 1.00 0.00 H new ATOM 0 HD2 TYR A 129 -11.353 2.067 -3.292 1.00 0.00 H new ATOM 0 HE1 TYR A 129 -15.273 1.814 -6.254 1.00 0.00 H new ATOM 0 HE2 TYR A 129 -12.184 4.095 -4.400 1.00 0.00 H new ATOM 0 HH TYR A 129 -14.854 3.961 -6.740 1.00 0.00 H new ATOM 2076 N GLN A 130 -15.302 -1.103 -2.895 1.00 0.00 N ATOM 2077 CA GLN A 130 -16.719 -0.790 -3.039 1.00 0.00 C ATOM 2078 C GLN A 130 -17.406 -0.737 -1.679 1.00 0.00 C ATOM 2079 O GLN A 130 -18.248 0.126 -1.432 1.00 0.00 O ATOM 2080 CB GLN A 130 -17.404 -1.829 -3.929 1.00 0.00 C ATOM 2081 CG GLN A 130 -16.740 -2.001 -5.285 1.00 0.00 C ATOM 2082 CD GLN A 130 -17.262 -1.023 -6.319 1.00 0.00 C ATOM 2083 OE1 GLN A 130 -18.129 -0.198 -6.028 1.00 0.00 O ATOM 2084 NE2 GLN A 130 -16.736 -1.109 -7.535 1.00 0.00 N ATOM 0 H GLN A 130 -15.007 -1.954 -3.374 1.00 0.00 H new ATOM 0 HA GLN A 130 -16.803 0.191 -3.506 1.00 0.00 H new ATOM 0 HB2 GLN A 130 -17.411 -2.789 -3.413 1.00 0.00 H new ATOM 0 HB3 GLN A 130 -18.444 -1.539 -4.077 1.00 0.00 H new ATOM 0 HG2 GLN A 130 -15.663 -1.870 -5.177 1.00 0.00 H new ATOM 0 HG3 GLN A 130 -16.903 -3.019 -5.639 1.00 0.00 H new ATOM 0 HE21 GLN A 130 -16.020 -1.808 -7.733 1.00 0.00 H new ATOM 0 HE22 GLN A 130 -17.048 -0.476 -8.272 1.00 0.00 H new ATOM 2093 N GLU A 131 -17.041 -1.665 -0.800 1.00 0.00 N ATOM 2094 CA GLU A 131 -17.624 -1.723 0.536 1.00 0.00 C ATOM 2095 C GLU A 131 -17.816 -0.321 1.107 1.00 0.00 C ATOM 2096 O GLU A 131 -18.921 0.054 1.502 1.00 0.00 O ATOM 2097 CB GLU A 131 -16.736 -2.549 1.469 1.00 0.00 C ATOM 2098 CG GLU A 131 -16.506 -3.972 0.989 1.00 0.00 C ATOM 2099 CD GLU A 131 -17.681 -4.884 1.286 1.00 0.00 C ATOM 2100 OE1 GLU A 131 -18.803 -4.366 1.466 1.00 0.00 O ATOM 2101 OE2 GLU A 131 -17.478 -6.115 1.339 1.00 0.00 O ATOM 0 H GLU A 131 -16.345 -2.386 -0.988 1.00 0.00 H new ATOM 0 HA GLU A 131 -18.600 -2.202 0.458 1.00 0.00 H new ATOM 0 HB2 GLU A 131 -15.773 -2.050 1.575 1.00 0.00 H new ATOM 0 HB3 GLU A 131 -17.191 -2.578 2.459 1.00 0.00 H new ATOM 0 HG2 GLU A 131 -16.319 -3.964 -0.085 1.00 0.00 H new ATOM 0 HG3 GLU A 131 -15.611 -4.372 1.465 1.00 0.00 H new ATOM 2108 N LEU A 132 -16.734 0.448 1.148 1.00 0.00 N ATOM 2109 CA LEU A 132 -16.782 1.809 1.671 1.00 0.00 C ATOM 2110 C LEU A 132 -17.864 2.624 0.971 1.00 0.00 C ATOM 2111 O LEU A 132 -18.698 3.256 1.621 1.00 0.00 O ATOM 2112 CB LEU A 132 -15.423 2.490 1.499 1.00 0.00 C ATOM 2113 CG LEU A 132 -14.261 1.879 2.282 1.00 0.00 C ATOM 2114 CD1 LEU A 132 -14.744 1.341 3.621 1.00 0.00 C ATOM 2115 CD2 LEU A 132 -13.593 0.777 1.473 1.00 0.00 C ATOM 0 H LEU A 132 -15.813 0.153 0.825 1.00 0.00 H new ATOM 0 HA LEU A 132 -17.024 1.756 2.733 1.00 0.00 H new ATOM 0 HB2 LEU A 132 -15.166 2.480 0.440 1.00 0.00 H new ATOM 0 HB3 LEU A 132 -15.523 3.535 1.793 1.00 0.00 H new ATOM 0 HG LEU A 132 -13.525 2.661 2.471 1.00 0.00 H new ATOM 0 HD11 LEU A 132 -13.903 0.910 4.165 1.00 0.00 H new ATOM 0 HD12 LEU A 132 -15.176 2.154 4.205 1.00 0.00 H new ATOM 0 HD13 LEU A 132 -15.500 0.574 3.454 1.00 0.00 H new ATOM 0 HD21 LEU A 132 -12.768 0.354 2.046 1.00 0.00 H new ATOM 0 HD22 LEU A 132 -14.320 -0.004 1.253 1.00 0.00 H new ATOM 0 HD23 LEU A 132 -13.211 1.191 0.540 1.00 0.00 H new ATOM 2127 N LEU A 133 -17.847 2.603 -0.357 1.00 0.00 N ATOM 2128 CA LEU A 133 -18.829 3.338 -1.147 1.00 0.00 C ATOM 2129 C LEU A 133 -20.244 3.064 -0.647 1.00 0.00 C ATOM 2130 O LEU A 133 -20.983 3.989 -0.308 1.00 0.00 O ATOM 2131 CB LEU A 133 -18.714 2.957 -2.624 1.00 0.00 C ATOM 2132 CG LEU A 133 -17.739 3.787 -3.458 1.00 0.00 C ATOM 2133 CD1 LEU A 133 -17.380 3.058 -4.743 1.00 0.00 C ATOM 2134 CD2 LEU A 133 -18.330 5.155 -3.765 1.00 0.00 C ATOM 0 H LEU A 133 -17.164 2.085 -0.910 1.00 0.00 H new ATOM 0 HA LEU A 133 -18.624 4.403 -1.037 1.00 0.00 H new ATOM 0 HB2 LEU A 133 -18.414 1.911 -2.686 1.00 0.00 H new ATOM 0 HB3 LEU A 133 -19.703 3.033 -3.076 1.00 0.00 H new ATOM 0 HG LEU A 133 -16.826 3.930 -2.879 1.00 0.00 H new ATOM 0 HD11 LEU A 133 -16.685 3.665 -5.323 1.00 0.00 H new ATOM 0 HD12 LEU A 133 -16.914 2.103 -4.501 1.00 0.00 H new ATOM 0 HD13 LEU A 133 -18.284 2.883 -5.327 1.00 0.00 H new ATOM 0 HD21 LEU A 133 -17.622 5.732 -4.360 1.00 0.00 H new ATOM 0 HD22 LEU A 133 -19.258 5.033 -4.323 1.00 0.00 H new ATOM 0 HD23 LEU A 133 -18.534 5.681 -2.832 1.00 0.00 H new