USER MOD reduce.3.24.130724 H: found=0, std=0, add=751, rem=0, adj=33 USER MOD reduce.3.24.130724 removed 753 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 109 SER OG : rot 180:sc= 0 USER MOD Set 1.2: A 113 SER OG : rot 95:sc= 0.78 USER MOD Set 2.1: A 14 ASN :FLIP amide:sc= -6.88! C(o=-7.9!,f=-6.7!) USER MOD Set 2.2: A 104 THR OG1 : rot -43:sc= 0.147 USER MOD Set 3.1: A 21 SER OG : rot 124:sc= 1.23 USER MOD Set 3.2: A 102 GLN : amide:sc= 0.936 K(o=2.2,f=-3.3!) USER MOD Set 4.1: A 97 THR OG1 : rot 180:sc= -4.34! USER MOD Set 4.2: A 101 TYR OH : rot 0:sc= 0.0798 USER MOD Set 4.3: A 108 ASN : amide:sc= -10.4! C(o=-15!,f=-18!) USER MOD Set 5.1: A 27 SER OG : rot -40:sc= 0.224 USER MOD Set 5.2: A 28 ASN : amide:sc=-0.00698 K(o=0.22,f=-1.6!) USER MOD Set 6.1: A 20 ASN :FLIP amide:sc= -0.0941 F(o=-0.8,f=-0.096) USER MOD Set 6.2: A 45 ASN : amide:sc=-0.00186 K(o=-0.096,f=-2.5!) USER MOD Single : A 6 ASN : amide:sc=-0.00534 K(o=-0.0053,f=-1.4) USER MOD Single : A 7 THR OG1 : rot -129:sc= -3.08! USER MOD Single : A 10 SER OG : rot 175:sc= -3.57! USER MOD Single : A 11 SER OG : rot 180:sc= 0 USER MOD Single : A 12 LYS NZ :NH3+ -104:sc= -0.24 (180deg=-0.81) USER MOD Single : A 24 SER OG : rot 180:sc= 0 USER MOD Single : A 29 THR OG1 : rot 66:sc= 0.45 USER MOD Single : A 31 SER OG : rot 180:sc= 0 USER MOD Single : A 33 SER OG : rot 180:sc= -1.55! USER MOD Single : A 34 GLN :FLIP amide:sc= 0 F(o=-0.66,f=0) USER MOD Single : A 36 GLN : amide:sc= -2.79! C(o=-2.8!,f=-3.2!) USER MOD Single : A 37 MET CE :methyl -151:sc= -2! (180deg=-5.11!) USER MOD Single : A 39 ASN : amide:sc= -0.177 K(o=-0.18,f=-1.4) USER MOD Single : A 40 MET CE :methyl 179:sc= -2 (180deg=-2.02) USER MOD Single : A 41 SER OG : rot 180:sc= 0 USER MOD Single : A 46 THR OG1 : rot 159:sc= 1.23 USER MOD Single : A 48 MET CE :methyl -118:sc= -0.0665 (180deg=-0.607) USER MOD Single : A 51 MET CE :methyl -123:sc= -0.688 (180deg=-2.98!) USER MOD Single : A 64 GLN : amide:sc= 0 K(o=0,f=-1.7!) USER MOD Single : A 68 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 72 SER OG : rot 73:sc= 0.0478 USER MOD Single : A 73 SER OG : rot 140:sc= -0.512 USER MOD Single : A 76 GLN : amide:sc= 0.0193 K(o=0.019,f=-1.4!) USER MOD Single : A 80 SER OG : rot -22:sc= 0.166 USER MOD Single : A 81 GLN : amide:sc= -3.86! C(o=-3.9!,f=-7.9!) USER MOD Single : A 88 THR OG1 : rot 180:sc= -0.0925 USER MOD Single : A 89 THR OG1 : rot 180:sc= 0 USER MOD Single : A 90 ASN : amide:sc=-0.00242 K(o=-0.0024,f=-1.5) USER MOD Single : A 98 SER OG : rot 180:sc= 0 USER MOD Single : A 103 THR OG1 : rot -73:sc= -0.808! USER MOD Single : A 117 SER OG : rot 79:sc= 0.559 USER MOD Single : A 121 MET CE :methyl -155:sc= -0.18 (180deg=-1.49!) USER MOD ----------------------------------------------------------------- ATOM 61 N ASN A 6 -14.527 7.617 -5.347 1.00 0.00 N ATOM 62 CA ASN A 6 -15.154 8.832 -4.754 1.00 0.00 C ATOM 63 C ASN A 6 -14.253 9.382 -3.646 1.00 0.00 C ATOM 64 O ASN A 6 -14.402 10.506 -3.213 1.00 0.00 O ATOM 65 CB ASN A 6 -16.519 8.468 -4.166 1.00 0.00 C ATOM 66 CG ASN A 6 -17.413 7.899 -5.270 1.00 0.00 C ATOM 67 OD1 ASN A 6 -17.180 8.136 -6.438 1.00 0.00 O ATOM 68 ND2 ASN A 6 -18.433 7.151 -4.947 1.00 0.00 N ATOM 0 HA ASN A 6 -15.282 9.588 -5.528 1.00 0.00 H new ATOM 0 HB2 ASN A 6 -16.400 7.737 -3.367 1.00 0.00 H new ATOM 0 HB3 ASN A 6 -16.984 9.350 -3.725 1.00 0.00 H new ATOM 0 HD21 ASN A 6 -19.034 6.766 -5.676 1.00 0.00 H new ATOM 0 HD22 ASN A 6 -18.629 6.952 -3.966 1.00 0.00 H new ATOM 75 N THR A 7 -13.319 8.596 -3.185 1.00 0.00 N ATOM 76 CA THR A 7 -12.410 9.075 -2.106 1.00 0.00 C ATOM 77 C THR A 7 -11.088 8.296 -2.181 1.00 0.00 C ATOM 78 O THR A 7 -11.032 7.210 -2.724 1.00 0.00 O ATOM 79 CB THR A 7 -13.101 8.871 -0.742 1.00 0.00 C ATOM 80 OG1 THR A 7 -12.772 9.948 0.118 1.00 0.00 O ATOM 81 CG2 THR A 7 -12.665 7.550 -0.100 1.00 0.00 C ATOM 0 H THR A 7 -13.146 7.644 -3.508 1.00 0.00 H new ATOM 0 HA THR A 7 -12.192 10.136 -2.229 1.00 0.00 H new ATOM 0 HB THR A 7 -14.179 8.837 -0.900 1.00 0.00 H new ATOM 0 HG1 THR A 7 -12.449 9.596 0.974 1.00 0.00 H new ATOM 0 HG21 THR A 7 -13.166 7.429 0.861 1.00 0.00 H new ATOM 0 HG22 THR A 7 -12.933 6.721 -0.755 1.00 0.00 H new ATOM 0 HG23 THR A 7 -11.586 7.558 0.052 1.00 0.00 H new ATOM 89 N PRO A 8 -10.004 8.868 -1.633 1.00 0.00 N ATOM 90 CA PRO A 8 -8.681 8.230 -1.647 1.00 0.00 C ATOM 91 C PRO A 8 -8.615 6.988 -0.749 1.00 0.00 C ATOM 92 O PRO A 8 -7.928 6.034 -1.054 1.00 0.00 O ATOM 93 CB PRO A 8 -7.754 9.317 -1.104 1.00 0.00 C ATOM 94 CG PRO A 8 -8.640 10.188 -0.281 1.00 0.00 C ATOM 95 CD PRO A 8 -9.979 10.179 -0.959 1.00 0.00 C ATOM 0 HA PRO A 8 -8.417 7.877 -2.644 1.00 0.00 H new ATOM 0 HB2 PRO A 8 -6.950 8.890 -0.505 1.00 0.00 H new ATOM 0 HB3 PRO A 8 -7.285 9.879 -1.912 1.00 0.00 H new ATOM 0 HG2 PRO A 8 -8.717 9.812 0.739 1.00 0.00 H new ATOM 0 HG3 PRO A 8 -8.242 11.201 -0.218 1.00 0.00 H new ATOM 0 HD2 PRO A 8 -10.794 10.279 -0.243 1.00 0.00 H new ATOM 0 HD3 PRO A 8 -10.076 11.000 -1.670 1.00 0.00 H new ATOM 103 N TRP A 9 -9.312 6.989 0.358 1.00 0.00 N ATOM 104 CA TRP A 9 -9.262 5.798 1.256 1.00 0.00 C ATOM 105 C TRP A 9 -10.246 4.731 0.769 1.00 0.00 C ATOM 106 O TRP A 9 -10.376 3.681 1.364 1.00 0.00 O ATOM 107 CB TRP A 9 -9.605 6.203 2.695 1.00 0.00 C ATOM 108 CG TRP A 9 -10.950 6.852 2.744 1.00 0.00 C ATOM 109 CD1 TRP A 9 -12.120 6.197 2.910 1.00 0.00 C ATOM 110 CD2 TRP A 9 -11.285 8.268 2.645 1.00 0.00 C ATOM 111 NE1 TRP A 9 -13.153 7.117 2.913 1.00 0.00 N ATOM 112 CE2 TRP A 9 -12.689 8.408 2.752 1.00 0.00 C ATOM 113 CE3 TRP A 9 -10.515 9.432 2.471 1.00 0.00 C ATOM 114 CZ2 TRP A 9 -13.307 9.657 2.691 1.00 0.00 C ATOM 115 CZ3 TRP A 9 -11.133 10.691 2.408 1.00 0.00 C ATOM 116 CH2 TRP A 9 -12.526 10.803 2.518 1.00 0.00 C ATOM 0 H TRP A 9 -9.907 7.754 0.676 1.00 0.00 H new ATOM 0 HA TRP A 9 -8.252 5.388 1.235 1.00 0.00 H new ATOM 0 HB2 TRP A 9 -9.594 5.324 3.340 1.00 0.00 H new ATOM 0 HB3 TRP A 9 -8.849 6.889 3.077 1.00 0.00 H new ATOM 0 HD1 TRP A 9 -12.231 5.129 3.022 1.00 0.00 H new ATOM 0 HE1 TRP A 9 -14.137 6.872 3.021 1.00 0.00 H new ATOM 0 HE3 TRP A 9 -9.441 9.357 2.385 1.00 0.00 H new ATOM 0 HZ2 TRP A 9 -14.381 9.738 2.777 1.00 0.00 H new ATOM 0 HZ3 TRP A 9 -10.532 11.578 2.274 1.00 0.00 H new ATOM 0 HH2 TRP A 9 -12.995 11.774 2.469 1.00 0.00 H new ATOM 127 N SER A 10 -10.929 4.981 -0.316 1.00 0.00 N ATOM 128 CA SER A 10 -11.887 3.965 -0.837 1.00 0.00 C ATOM 129 C SER A 10 -11.154 3.049 -1.818 1.00 0.00 C ATOM 130 O SER A 10 -11.500 1.897 -1.988 1.00 0.00 O ATOM 131 CB SER A 10 -13.042 4.661 -1.560 1.00 0.00 C ATOM 132 OG SER A 10 -13.934 5.215 -0.604 1.00 0.00 O ATOM 0 H SER A 10 -10.865 5.841 -0.861 1.00 0.00 H new ATOM 0 HA SER A 10 -12.286 3.381 -0.007 1.00 0.00 H new ATOM 0 HB2 SER A 10 -12.657 5.446 -2.212 1.00 0.00 H new ATOM 0 HB3 SER A 10 -13.569 3.949 -2.195 1.00 0.00 H new ATOM 0 HG SER A 10 -14.629 5.730 -1.065 1.00 0.00 H new ATOM 138 N SER A 11 -10.137 3.555 -2.462 1.00 0.00 N ATOM 139 CA SER A 11 -9.375 2.719 -3.428 1.00 0.00 C ATOM 140 C SER A 11 -8.048 2.302 -2.793 1.00 0.00 C ATOM 141 O SER A 11 -7.536 2.965 -1.912 1.00 0.00 O ATOM 142 CB SER A 11 -9.101 3.527 -4.698 1.00 0.00 C ATOM 143 OG SER A 11 -9.117 2.660 -5.823 1.00 0.00 O ATOM 0 H SER A 11 -9.802 4.513 -2.359 1.00 0.00 H new ATOM 0 HA SER A 11 -9.955 1.832 -3.683 1.00 0.00 H new ATOM 0 HB2 SER A 11 -9.854 4.307 -4.815 1.00 0.00 H new ATOM 0 HB3 SER A 11 -8.135 4.026 -4.623 1.00 0.00 H new ATOM 0 HG SER A 11 -8.943 3.177 -6.637 1.00 0.00 H new ATOM 149 N LYS A 12 -7.488 1.208 -3.227 1.00 0.00 N ATOM 150 CA LYS A 12 -6.197 0.750 -2.644 1.00 0.00 C ATOM 151 C LYS A 12 -5.059 1.644 -3.143 1.00 0.00 C ATOM 152 O LYS A 12 -4.139 1.958 -2.414 1.00 0.00 O ATOM 153 CB LYS A 12 -5.932 -0.693 -3.071 1.00 0.00 C ATOM 154 CG LYS A 12 -5.280 -1.458 -1.916 1.00 0.00 C ATOM 155 CD LYS A 12 -5.000 -2.899 -2.349 1.00 0.00 C ATOM 156 CE LYS A 12 -4.310 -2.898 -3.715 1.00 0.00 C ATOM 157 NZ LYS A 12 -5.319 -3.157 -4.782 1.00 0.00 N ATOM 0 H LYS A 12 -7.869 0.611 -3.961 1.00 0.00 H new ATOM 0 HA LYS A 12 -6.251 0.807 -1.557 1.00 0.00 H new ATOM 0 HB2 LYS A 12 -6.866 -1.175 -3.359 1.00 0.00 H new ATOM 0 HB3 LYS A 12 -5.282 -0.711 -3.946 1.00 0.00 H new ATOM 0 HG2 LYS A 12 -4.352 -0.969 -1.621 1.00 0.00 H new ATOM 0 HG3 LYS A 12 -5.935 -1.450 -1.045 1.00 0.00 H new ATOM 0 HD2 LYS A 12 -4.369 -3.395 -1.612 1.00 0.00 H new ATOM 0 HD3 LYS A 12 -5.932 -3.462 -2.401 1.00 0.00 H new ATOM 0 HE2 LYS A 12 -3.821 -1.939 -3.887 1.00 0.00 H new ATOM 0 HE3 LYS A 12 -3.532 -3.661 -3.742 1.00 0.00 H new ATOM 0 HZ1 LYS A 12 -5.227 -4.137 -5.116 1.00 0.00 H new ATOM 0 HZ2 LYS A 12 -6.275 -3.010 -4.399 1.00 0.00 H new ATOM 0 HZ3 LYS A 12 -5.160 -2.504 -5.576 1.00 0.00 H new ATOM 171 N ALA A 13 -5.112 2.055 -4.381 1.00 0.00 N ATOM 172 CA ALA A 13 -4.030 2.923 -4.925 1.00 0.00 C ATOM 173 C ALA A 13 -4.300 4.381 -4.545 1.00 0.00 C ATOM 174 O ALA A 13 -3.390 5.144 -4.290 1.00 0.00 O ATOM 175 CB ALA A 13 -3.989 2.792 -6.450 1.00 0.00 C ATOM 0 H ALA A 13 -5.858 1.827 -5.039 1.00 0.00 H new ATOM 0 HA ALA A 13 -3.073 2.612 -4.507 1.00 0.00 H new ATOM 0 HB1 ALA A 13 -3.198 3.427 -6.849 1.00 0.00 H new ATOM 0 HB2 ALA A 13 -3.793 1.755 -6.721 1.00 0.00 H new ATOM 0 HB3 ALA A 13 -4.947 3.101 -6.868 1.00 0.00 H new ATOM 181 N ASN A 14 -5.543 4.773 -4.508 1.00 0.00 N ATOM 182 CA ASN A 14 -5.867 6.184 -4.147 1.00 0.00 C ATOM 183 C ASN A 14 -5.600 6.407 -2.656 1.00 0.00 C ATOM 184 O ASN A 14 -5.286 7.500 -2.230 1.00 0.00 O ATOM 185 CB ASN A 14 -7.343 6.463 -4.445 1.00 0.00 C ATOM 186 CG ASN A 14 -7.499 7.908 -4.925 1.00 0.00 C ATOM 187 OD1 ASN A 14 -8.592 8.263 -5.544 1.00 0.00 O flip ATOM 188 ND2 ASN A 14 -6.618 8.722 -4.737 1.00 0.00 N flip ATOM 0 H ASN A 14 -6.348 4.180 -4.711 1.00 0.00 H new ATOM 0 HA ASN A 14 -5.243 6.858 -4.733 1.00 0.00 H new ATOM 0 HB2 ASN A 14 -7.709 5.774 -5.206 1.00 0.00 H new ATOM 0 HB3 ASN A 14 -7.944 6.298 -3.551 1.00 0.00 H new ATOM 0 HD21 ASN A 14 -5.763 8.446 -4.253 1.00 0.00 H new ATOM 0 HD22 ASN A 14 -6.733 9.682 -5.063 1.00 0.00 H new ATOM 195 N ALA A 15 -5.729 5.382 -1.858 1.00 0.00 N ATOM 196 CA ALA A 15 -5.488 5.543 -0.395 1.00 0.00 C ATOM 197 C ALA A 15 -3.992 5.710 -0.128 1.00 0.00 C ATOM 198 O ALA A 15 -3.578 6.561 0.635 1.00 0.00 O ATOM 199 CB ALA A 15 -6.001 4.305 0.345 1.00 0.00 C ATOM 0 H ALA A 15 -5.990 4.442 -2.155 1.00 0.00 H new ATOM 0 HA ALA A 15 -6.016 6.428 -0.041 1.00 0.00 H new ATOM 0 HB1 ALA A 15 -5.825 4.422 1.414 1.00 0.00 H new ATOM 0 HB2 ALA A 15 -7.069 4.189 0.163 1.00 0.00 H new ATOM 0 HB3 ALA A 15 -5.474 3.421 -0.015 1.00 0.00 H new ATOM 205 N ASP A 16 -3.179 4.901 -0.743 1.00 0.00 N ATOM 206 CA ASP A 16 -1.708 5.003 -0.521 1.00 0.00 C ATOM 207 C ASP A 16 -1.227 6.420 -0.844 1.00 0.00 C ATOM 208 O ASP A 16 -0.589 7.067 -0.038 1.00 0.00 O ATOM 209 CB ASP A 16 -0.990 4.004 -1.431 1.00 0.00 C ATOM 210 CG ASP A 16 0.496 3.958 -1.068 1.00 0.00 C ATOM 211 OD1 ASP A 16 0.872 4.611 -0.108 1.00 0.00 O ATOM 212 OD2 ASP A 16 1.232 3.270 -1.756 1.00 0.00 O ATOM 0 H ASP A 16 -3.469 4.170 -1.393 1.00 0.00 H new ATOM 0 HA ASP A 16 -1.486 4.780 0.523 1.00 0.00 H new ATOM 0 HB2 ASP A 16 -1.432 3.014 -1.322 1.00 0.00 H new ATOM 0 HB3 ASP A 16 -1.111 4.294 -2.475 1.00 0.00 H new ATOM 217 N ALA A 17 -1.520 6.905 -2.019 1.00 0.00 N ATOM 218 CA ALA A 17 -1.070 8.277 -2.391 1.00 0.00 C ATOM 219 C ALA A 17 -1.491 9.268 -1.304 1.00 0.00 C ATOM 220 O ALA A 17 -0.726 10.121 -0.900 1.00 0.00 O ATOM 221 CB ALA A 17 -1.706 8.679 -3.724 1.00 0.00 C ATOM 0 H ALA A 17 -2.051 6.412 -2.737 1.00 0.00 H new ATOM 0 HA ALA A 17 0.016 8.288 -2.488 1.00 0.00 H new ATOM 0 HB1 ALA A 17 -1.377 9.682 -3.996 1.00 0.00 H new ATOM 0 HB2 ALA A 17 -1.403 7.975 -4.499 1.00 0.00 H new ATOM 0 HB3 ALA A 17 -2.792 8.667 -3.628 1.00 0.00 H new ATOM 227 N PHE A 18 -2.702 9.165 -0.829 1.00 0.00 N ATOM 228 CA PHE A 18 -3.168 10.105 0.230 1.00 0.00 C ATOM 229 C PHE A 18 -2.230 10.025 1.437 1.00 0.00 C ATOM 230 O PHE A 18 -1.923 11.021 2.062 1.00 0.00 O ATOM 231 CB PHE A 18 -4.587 9.725 0.661 1.00 0.00 C ATOM 232 CG PHE A 18 -5.100 10.736 1.659 1.00 0.00 C ATOM 233 CD1 PHE A 18 -5.679 11.929 1.211 1.00 0.00 C ATOM 234 CD2 PHE A 18 -4.996 10.480 3.032 1.00 0.00 C ATOM 235 CE1 PHE A 18 -6.156 12.866 2.137 1.00 0.00 C ATOM 236 CE2 PHE A 18 -5.474 11.417 3.957 1.00 0.00 C ATOM 237 CZ PHE A 18 -6.053 12.610 3.509 1.00 0.00 C ATOM 0 H PHE A 18 -3.388 8.472 -1.128 1.00 0.00 H new ATOM 0 HA PHE A 18 -3.166 11.122 -0.163 1.00 0.00 H new ATOM 0 HB2 PHE A 18 -5.245 9.690 -0.207 1.00 0.00 H new ATOM 0 HB3 PHE A 18 -4.589 8.729 1.103 1.00 0.00 H new ATOM 0 HD1 PHE A 18 -5.758 12.127 0.152 1.00 0.00 H new ATOM 0 HD2 PHE A 18 -4.547 9.560 3.377 1.00 0.00 H new ATOM 0 HE1 PHE A 18 -6.603 13.786 1.792 1.00 0.00 H new ATOM 0 HE2 PHE A 18 -5.396 11.219 5.016 1.00 0.00 H new ATOM 0 HZ PHE A 18 -6.420 13.333 4.222 1.00 0.00 H new ATOM 247 N ILE A 19 -1.775 8.849 1.771 1.00 0.00 N ATOM 248 CA ILE A 19 -0.860 8.708 2.940 1.00 0.00 C ATOM 249 C ILE A 19 0.497 9.341 2.618 1.00 0.00 C ATOM 250 O ILE A 19 1.083 10.024 3.435 1.00 0.00 O ATOM 251 CB ILE A 19 -0.664 7.223 3.257 1.00 0.00 C ATOM 252 CG1 ILE A 19 -2.028 6.547 3.408 1.00 0.00 C ATOM 253 CG2 ILE A 19 0.122 7.081 4.562 1.00 0.00 C ATOM 254 CD1 ILE A 19 -2.868 7.316 4.431 1.00 0.00 C ATOM 0 H ILE A 19 -1.997 7.980 1.286 1.00 0.00 H new ATOM 0 HA ILE A 19 -1.298 9.213 3.801 1.00 0.00 H new ATOM 0 HB ILE A 19 -0.112 6.749 2.445 1.00 0.00 H new ATOM 0 HG12 ILE A 19 -2.541 6.520 2.447 1.00 0.00 H new ATOM 0 HG13 ILE A 19 -1.900 5.513 3.730 1.00 0.00 H new ATOM 0 HG21 ILE A 19 0.262 6.024 4.789 1.00 0.00 H new ATOM 0 HG22 ILE A 19 1.095 7.561 4.455 1.00 0.00 H new ATOM 0 HG23 ILE A 19 -0.430 7.556 5.373 1.00 0.00 H new ATOM 0 HD11 ILE A 19 -3.840 6.835 4.539 1.00 0.00 H new ATOM 0 HD12 ILE A 19 -2.356 7.320 5.393 1.00 0.00 H new ATOM 0 HD13 ILE A 19 -3.007 8.342 4.090 1.00 0.00 H new ATOM 266 N ASN A 20 1.005 9.112 1.438 1.00 0.00 N ATOM 267 CA ASN A 20 2.328 9.693 1.068 1.00 0.00 C ATOM 268 C ASN A 20 2.236 11.221 1.024 1.00 0.00 C ATOM 269 O ASN A 20 3.056 11.917 1.586 1.00 0.00 O ATOM 270 CB ASN A 20 2.744 9.172 -0.309 1.00 0.00 C ATOM 271 CG ASN A 20 2.717 7.641 -0.305 1.00 0.00 C ATOM 272 OD1 ASN A 20 2.083 7.009 -1.255 1.00 0.00 O flip ATOM 273 ND2 ASN A 20 3.281 7.015 0.570 1.00 0.00 N flip ATOM 0 H ASN A 20 0.561 8.548 0.713 1.00 0.00 H new ATOM 0 HA ASN A 20 3.067 9.400 1.813 1.00 0.00 H new ATOM 0 HB2 ASN A 20 2.069 9.556 -1.074 1.00 0.00 H new ATOM 0 HB3 ASN A 20 3.744 9.528 -0.558 1.00 0.00 H new ATOM 0 HD21 ASN A 20 3.776 7.509 1.312 1.00 0.00 H new ATOM 0 HD22 ASN A 20 3.259 5.995 0.562 1.00 0.00 H new ATOM 280 N SER A 21 1.250 11.746 0.351 1.00 0.00 N ATOM 281 CA SER A 21 1.111 13.227 0.261 1.00 0.00 C ATOM 282 C SER A 21 0.896 13.822 1.655 1.00 0.00 C ATOM 283 O SER A 21 1.286 14.938 1.928 1.00 0.00 O ATOM 284 CB SER A 21 -0.088 13.571 -0.624 1.00 0.00 C ATOM 285 OG SER A 21 -0.013 14.934 -1.016 1.00 0.00 O ATOM 0 H SER A 21 0.533 11.213 -0.141 1.00 0.00 H new ATOM 0 HA SER A 21 2.022 13.644 -0.169 1.00 0.00 H new ATOM 0 HB2 SER A 21 -0.100 12.929 -1.505 1.00 0.00 H new ATOM 0 HB3 SER A 21 -1.017 13.388 -0.084 1.00 0.00 H new ATOM 0 HG SER A 21 -0.036 14.995 -1.994 1.00 0.00 H new ATOM 291 N PHE A 22 0.271 13.091 2.536 1.00 0.00 N ATOM 292 CA PHE A 22 0.025 13.626 3.906 1.00 0.00 C ATOM 293 C PHE A 22 1.354 13.856 4.629 1.00 0.00 C ATOM 294 O PHE A 22 1.608 14.920 5.156 1.00 0.00 O ATOM 295 CB PHE A 22 -0.813 12.624 4.700 1.00 0.00 C ATOM 296 CG PHE A 22 -1.001 13.134 6.107 1.00 0.00 C ATOM 297 CD1 PHE A 22 0.061 13.083 7.020 1.00 0.00 C ATOM 298 CD2 PHE A 22 -2.238 13.659 6.501 1.00 0.00 C ATOM 299 CE1 PHE A 22 -0.115 13.558 8.326 1.00 0.00 C ATOM 300 CE2 PHE A 22 -2.412 14.134 7.806 1.00 0.00 C ATOM 301 CZ PHE A 22 -1.351 14.083 8.718 1.00 0.00 C ATOM 0 H PHE A 22 -0.080 12.148 2.368 1.00 0.00 H new ATOM 0 HA PHE A 22 -0.507 14.574 3.826 1.00 0.00 H new ATOM 0 HB2 PHE A 22 -1.781 12.482 4.220 1.00 0.00 H new ATOM 0 HB3 PHE A 22 -0.320 11.652 4.716 1.00 0.00 H new ATOM 0 HD1 PHE A 22 1.015 12.678 6.717 1.00 0.00 H new ATOM 0 HD2 PHE A 22 -3.057 13.697 5.798 1.00 0.00 H new ATOM 0 HE1 PHE A 22 0.703 13.519 9.030 1.00 0.00 H new ATOM 0 HE2 PHE A 22 -3.366 14.540 8.110 1.00 0.00 H new ATOM 0 HZ PHE A 22 -1.487 14.449 9.725 1.00 0.00 H new ATOM 311 N ILE A 23 2.198 12.863 4.671 1.00 0.00 N ATOM 312 CA ILE A 23 3.504 13.021 5.374 1.00 0.00 C ATOM 313 C ILE A 23 4.303 14.169 4.752 1.00 0.00 C ATOM 314 O ILE A 23 4.707 15.094 5.430 1.00 0.00 O ATOM 315 CB ILE A 23 4.305 11.726 5.247 1.00 0.00 C ATOM 316 CG1 ILE A 23 3.449 10.547 5.715 1.00 0.00 C ATOM 317 CG2 ILE A 23 5.563 11.818 6.111 1.00 0.00 C ATOM 318 CD1 ILE A 23 2.939 10.816 7.133 1.00 0.00 C ATOM 0 H ILE A 23 2.041 11.948 4.249 1.00 0.00 H new ATOM 0 HA ILE A 23 3.317 13.244 6.425 1.00 0.00 H new ATOM 0 HB ILE A 23 4.590 11.576 4.206 1.00 0.00 H new ATOM 0 HG12 ILE A 23 2.608 10.402 5.036 1.00 0.00 H new ATOM 0 HG13 ILE A 23 4.035 9.628 5.696 1.00 0.00 H new ATOM 0 HG21 ILE A 23 6.135 10.894 6.021 1.00 0.00 H new ATOM 0 HG22 ILE A 23 6.173 12.657 5.777 1.00 0.00 H new ATOM 0 HG23 ILE A 23 5.279 11.968 7.153 1.00 0.00 H new ATOM 0 HD11 ILE A 23 2.329 9.976 7.466 1.00 0.00 H new ATOM 0 HD12 ILE A 23 3.787 10.939 7.807 1.00 0.00 H new ATOM 0 HD13 ILE A 23 2.337 11.725 7.137 1.00 0.00 H new ATOM 330 N SER A 24 4.544 14.114 3.472 1.00 0.00 N ATOM 331 CA SER A 24 5.328 15.199 2.816 1.00 0.00 C ATOM 332 C SER A 24 4.556 16.518 2.891 1.00 0.00 C ATOM 333 O SER A 24 5.135 17.585 2.914 1.00 0.00 O ATOM 334 CB SER A 24 5.570 14.834 1.349 1.00 0.00 C ATOM 335 OG SER A 24 4.346 14.910 0.634 1.00 0.00 O ATOM 0 H SER A 24 4.233 13.366 2.852 1.00 0.00 H new ATOM 0 HA SER A 24 6.283 15.313 3.329 1.00 0.00 H new ATOM 0 HB2 SER A 24 6.302 15.512 0.911 1.00 0.00 H new ATOM 0 HB3 SER A 24 5.984 13.828 1.277 1.00 0.00 H new ATOM 0 HG SER A 24 4.501 14.678 -0.305 1.00 0.00 H new ATOM 341 N ALA A 25 3.253 16.456 2.923 1.00 0.00 N ATOM 342 CA ALA A 25 2.450 17.709 2.988 1.00 0.00 C ATOM 343 C ALA A 25 2.450 18.264 4.416 1.00 0.00 C ATOM 344 O ALA A 25 2.582 19.452 4.625 1.00 0.00 O ATOM 345 CB ALA A 25 1.011 17.414 2.560 1.00 0.00 C ATOM 0 H ALA A 25 2.710 15.592 2.907 1.00 0.00 H new ATOM 0 HA ALA A 25 2.891 18.447 2.319 1.00 0.00 H new ATOM 0 HB1 ALA A 25 0.422 18.330 2.607 1.00 0.00 H new ATOM 0 HB2 ALA A 25 1.006 17.032 1.539 1.00 0.00 H new ATOM 0 HB3 ALA A 25 0.578 16.670 3.228 1.00 0.00 H new ATOM 351 N ALA A 26 2.289 17.419 5.398 1.00 0.00 N ATOM 352 CA ALA A 26 2.265 17.912 6.807 1.00 0.00 C ATOM 353 C ALA A 26 3.678 18.286 7.263 1.00 0.00 C ATOM 354 O ALA A 26 3.860 19.143 8.104 1.00 0.00 O ATOM 355 CB ALA A 26 1.716 16.815 7.722 1.00 0.00 C ATOM 0 H ALA A 26 2.173 16.412 5.287 1.00 0.00 H new ATOM 0 HA ALA A 26 1.627 18.794 6.860 1.00 0.00 H new ATOM 0 HB1 ALA A 26 1.698 17.174 8.751 1.00 0.00 H new ATOM 0 HB2 ALA A 26 0.704 16.554 7.411 1.00 0.00 H new ATOM 0 HB3 ALA A 26 2.354 15.934 7.657 1.00 0.00 H new ATOM 361 N SER A 27 4.677 17.645 6.726 1.00 0.00 N ATOM 362 CA SER A 27 6.073 17.958 7.143 1.00 0.00 C ATOM 363 C SER A 27 6.427 19.401 6.768 1.00 0.00 C ATOM 364 O SER A 27 7.260 20.026 7.394 1.00 0.00 O ATOM 365 CB SER A 27 7.037 17.001 6.440 1.00 0.00 C ATOM 366 OG SER A 27 7.020 17.255 5.043 1.00 0.00 O ATOM 0 H SER A 27 4.588 16.918 6.016 1.00 0.00 H new ATOM 0 HA SER A 27 6.156 17.842 8.224 1.00 0.00 H new ATOM 0 HB2 SER A 27 8.046 17.131 6.832 1.00 0.00 H new ATOM 0 HB3 SER A 27 6.749 15.968 6.636 1.00 0.00 H new ATOM 0 HG SER A 27 6.100 17.425 4.753 1.00 0.00 H new ATOM 372 N ASN A 28 5.813 19.931 5.745 1.00 0.00 N ATOM 373 CA ASN A 28 6.134 21.327 5.329 1.00 0.00 C ATOM 374 C ASN A 28 4.999 22.279 5.723 1.00 0.00 C ATOM 375 O ASN A 28 4.997 23.436 5.351 1.00 0.00 O ATOM 376 CB ASN A 28 6.323 21.372 3.812 1.00 0.00 C ATOM 377 CG ASN A 28 7.562 20.560 3.427 1.00 0.00 C ATOM 378 OD1 ASN A 28 8.371 20.229 4.270 1.00 0.00 O ATOM 379 ND2 ASN A 28 7.742 20.222 2.179 1.00 0.00 N ATOM 0 H ASN A 28 5.106 19.460 5.181 1.00 0.00 H new ATOM 0 HA ASN A 28 7.049 21.641 5.831 1.00 0.00 H new ATOM 0 HB2 ASN A 28 5.442 20.969 3.313 1.00 0.00 H new ATOM 0 HB3 ASN A 28 6.434 22.404 3.479 1.00 0.00 H new ATOM 0 HD21 ASN A 28 8.563 19.679 1.911 1.00 0.00 H new ATOM 0 HD22 ASN A 28 7.062 20.501 1.472 1.00 0.00 H new ATOM 386 N THR A 29 4.027 21.811 6.460 1.00 0.00 N ATOM 387 CA THR A 29 2.903 22.711 6.848 1.00 0.00 C ATOM 388 C THR A 29 3.195 23.374 8.197 1.00 0.00 C ATOM 389 O THR A 29 3.562 24.530 8.263 1.00 0.00 O ATOM 390 CB THR A 29 1.605 21.908 6.943 1.00 0.00 C ATOM 391 OG1 THR A 29 1.450 21.123 5.771 1.00 0.00 O ATOM 392 CG2 THR A 29 0.424 22.869 7.079 1.00 0.00 C ATOM 0 H THR A 29 3.963 20.854 6.807 1.00 0.00 H new ATOM 0 HA THR A 29 2.797 23.485 6.088 1.00 0.00 H new ATOM 0 HB THR A 29 1.641 21.253 7.814 1.00 0.00 H new ATOM 0 HG1 THR A 29 2.154 20.442 5.738 1.00 0.00 H new ATOM 0 HG21 THR A 29 -0.503 22.299 7.147 1.00 0.00 H new ATOM 0 HG22 THR A 29 0.547 23.471 7.979 1.00 0.00 H new ATOM 0 HG23 THR A 29 0.385 23.523 6.208 1.00 0.00 H new ATOM 400 N GLY A 30 3.025 22.658 9.276 1.00 0.00 N ATOM 401 CA GLY A 30 3.281 23.259 10.614 1.00 0.00 C ATOM 402 C GLY A 30 4.778 23.216 10.925 1.00 0.00 C ATOM 403 O GLY A 30 5.554 23.991 10.403 1.00 0.00 O ATOM 0 H GLY A 30 2.720 21.685 9.288 1.00 0.00 H new ATOM 0 HA2 GLY A 30 2.926 24.289 10.634 1.00 0.00 H new ATOM 0 HA3 GLY A 30 2.726 22.716 11.379 1.00 0.00 H new ATOM 407 N SER A 31 5.186 22.316 11.775 1.00 0.00 N ATOM 408 CA SER A 31 6.630 22.222 12.125 1.00 0.00 C ATOM 409 C SER A 31 7.086 20.768 12.013 1.00 0.00 C ATOM 410 O SER A 31 7.940 20.436 11.216 1.00 0.00 O ATOM 411 CB SER A 31 6.838 22.713 13.559 1.00 0.00 C ATOM 412 OG SER A 31 8.222 22.680 13.874 1.00 0.00 O ATOM 0 H SER A 31 4.581 21.641 12.243 1.00 0.00 H new ATOM 0 HA SER A 31 7.212 22.839 11.441 1.00 0.00 H new ATOM 0 HB2 SER A 31 6.454 23.727 13.667 1.00 0.00 H new ATOM 0 HB3 SER A 31 6.281 22.085 14.254 1.00 0.00 H new ATOM 0 HG SER A 31 8.356 22.996 14.792 1.00 0.00 H new ATOM 418 N PHE A 32 6.522 19.896 12.805 1.00 0.00 N ATOM 419 CA PHE A 32 6.927 18.464 12.743 1.00 0.00 C ATOM 420 C PHE A 32 8.452 18.374 12.649 1.00 0.00 C ATOM 421 O PHE A 32 9.014 18.315 11.573 1.00 0.00 O ATOM 422 CB PHE A 32 6.303 17.812 11.507 1.00 0.00 C ATOM 423 CG PHE A 32 4.864 17.446 11.793 1.00 0.00 C ATOM 424 CD1 PHE A 32 4.553 16.636 12.893 1.00 0.00 C ATOM 425 CD2 PHE A 32 3.840 17.909 10.953 1.00 0.00 C ATOM 426 CE1 PHE A 32 3.223 16.288 13.152 1.00 0.00 C ATOM 427 CE2 PHE A 32 2.509 17.561 11.216 1.00 0.00 C ATOM 428 CZ PHE A 32 2.201 16.750 12.314 1.00 0.00 C ATOM 0 H PHE A 32 5.799 20.114 13.491 1.00 0.00 H new ATOM 0 HA PHE A 32 6.584 17.948 13.639 1.00 0.00 H new ATOM 0 HB2 PHE A 32 6.352 18.496 10.660 1.00 0.00 H new ATOM 0 HB3 PHE A 32 6.867 16.921 11.231 1.00 0.00 H new ATOM 0 HD1 PHE A 32 5.340 16.280 13.541 1.00 0.00 H new ATOM 0 HD2 PHE A 32 4.078 18.533 10.104 1.00 0.00 H new ATOM 0 HE1 PHE A 32 2.984 15.662 13.999 1.00 0.00 H new ATOM 0 HE2 PHE A 32 1.720 17.919 10.571 1.00 0.00 H new ATOM 0 HZ PHE A 32 1.175 16.480 12.515 1.00 0.00 H new ATOM 438 N SER A 33 9.126 18.366 13.765 1.00 0.00 N ATOM 439 CA SER A 33 10.615 18.285 13.735 1.00 0.00 C ATOM 440 C SER A 33 11.043 16.998 13.028 1.00 0.00 C ATOM 441 O SER A 33 10.279 16.063 12.904 1.00 0.00 O ATOM 442 CB SER A 33 11.154 18.284 15.166 1.00 0.00 C ATOM 443 OG SER A 33 10.963 17.001 15.744 1.00 0.00 O ATOM 0 H SER A 33 8.712 18.412 14.696 1.00 0.00 H new ATOM 0 HA SER A 33 11.014 19.144 13.196 1.00 0.00 H new ATOM 0 HB2 SER A 33 12.213 18.541 15.167 1.00 0.00 H new ATOM 0 HB3 SER A 33 10.642 19.042 15.759 1.00 0.00 H new ATOM 0 HG SER A 33 11.310 17.000 16.660 1.00 0.00 H new ATOM 449 N GLN A 34 12.263 16.943 12.568 1.00 0.00 N ATOM 450 CA GLN A 34 12.739 15.716 11.873 1.00 0.00 C ATOM 451 C GLN A 34 12.473 14.501 12.759 1.00 0.00 C ATOM 452 O GLN A 34 12.150 13.430 12.284 1.00 0.00 O ATOM 453 CB GLN A 34 14.242 15.831 11.609 1.00 0.00 C ATOM 454 CG GLN A 34 14.512 17.046 10.719 1.00 0.00 C ATOM 455 CD GLN A 34 15.925 16.948 10.140 1.00 0.00 C ATOM 456 OE1 GLN A 34 16.831 16.258 10.778 1.00 0.00 O flip ATOM 457 NE2 GLN A 34 16.206 17.502 9.096 1.00 0.00 N flip ATOM 0 H GLN A 34 12.949 17.694 12.644 1.00 0.00 H new ATOM 0 HA GLN A 34 12.211 15.604 10.926 1.00 0.00 H new ATOM 0 HB2 GLN A 34 14.781 15.930 12.551 1.00 0.00 H new ATOM 0 HB3 GLN A 34 14.608 14.925 11.126 1.00 0.00 H new ATOM 0 HG2 GLN A 34 13.779 17.090 9.913 1.00 0.00 H new ATOM 0 HG3 GLN A 34 14.407 17.964 11.297 1.00 0.00 H new ATOM 0 HE21 GLN A 34 15.498 18.041 8.598 1.00 0.00 H new ATOM 0 HE22 GLN A 34 17.150 17.428 8.718 1.00 0.00 H new ATOM 466 N ASP A 35 12.603 14.659 14.048 1.00 0.00 N ATOM 467 CA ASP A 35 12.354 13.515 14.965 1.00 0.00 C ATOM 468 C ASP A 35 10.880 13.114 14.886 1.00 0.00 C ATOM 469 O ASP A 35 10.539 11.950 14.961 1.00 0.00 O ATOM 470 CB ASP A 35 12.694 13.926 16.399 1.00 0.00 C ATOM 471 CG ASP A 35 14.208 14.097 16.535 1.00 0.00 C ATOM 472 OD1 ASP A 35 14.913 13.719 15.614 1.00 0.00 O ATOM 473 OD2 ASP A 35 14.638 14.602 17.559 1.00 0.00 O ATOM 0 H ASP A 35 12.871 15.531 14.504 1.00 0.00 H new ATOM 0 HA ASP A 35 12.979 12.671 14.672 1.00 0.00 H new ATOM 0 HB2 ASP A 35 12.188 14.858 16.651 1.00 0.00 H new ATOM 0 HB3 ASP A 35 12.338 13.170 17.099 1.00 0.00 H new ATOM 478 N GLN A 36 10.003 14.069 14.731 1.00 0.00 N ATOM 479 CA GLN A 36 8.554 13.740 14.643 1.00 0.00 C ATOM 480 C GLN A 36 8.268 13.105 13.282 1.00 0.00 C ATOM 481 O GLN A 36 7.404 12.262 13.148 1.00 0.00 O ATOM 482 CB GLN A 36 7.730 15.020 14.798 1.00 0.00 C ATOM 483 CG GLN A 36 8.069 15.681 16.136 1.00 0.00 C ATOM 484 CD GLN A 36 7.821 14.687 17.274 1.00 0.00 C ATOM 485 OE1 GLN A 36 6.763 14.098 17.362 1.00 0.00 O ATOM 486 NE2 GLN A 36 8.760 14.476 18.156 1.00 0.00 N ATOM 0 H GLN A 36 10.228 15.061 14.662 1.00 0.00 H new ATOM 0 HA GLN A 36 8.285 13.042 15.436 1.00 0.00 H new ATOM 0 HB2 GLN A 36 7.943 15.705 13.977 1.00 0.00 H new ATOM 0 HB3 GLN A 36 6.666 14.789 14.753 1.00 0.00 H new ATOM 0 HG2 GLN A 36 9.110 16.003 16.141 1.00 0.00 H new ATOM 0 HG3 GLN A 36 7.458 16.573 16.278 1.00 0.00 H new ATOM 0 HE21 GLN A 36 9.649 14.971 18.083 1.00 0.00 H new ATOM 0 HE22 GLN A 36 8.605 13.817 18.919 1.00 0.00 H new ATOM 495 N MET A 37 8.995 13.500 12.274 1.00 0.00 N ATOM 496 CA MET A 37 8.774 12.916 10.922 1.00 0.00 C ATOM 497 C MET A 37 9.091 11.421 10.965 1.00 0.00 C ATOM 498 O MET A 37 8.502 10.631 10.254 1.00 0.00 O ATOM 499 CB MET A 37 9.691 13.607 9.913 1.00 0.00 C ATOM 500 CG MET A 37 9.294 15.080 9.790 1.00 0.00 C ATOM 501 SD MET A 37 10.270 15.862 8.482 1.00 0.00 S ATOM 502 CE MET A 37 9.593 17.530 8.660 1.00 0.00 C ATOM 0 H MET A 37 9.733 14.202 12.328 1.00 0.00 H new ATOM 0 HA MET A 37 7.736 13.061 10.622 1.00 0.00 H new ATOM 0 HB2 MET A 37 10.730 13.525 10.233 1.00 0.00 H new ATOM 0 HB3 MET A 37 9.617 13.117 8.942 1.00 0.00 H new ATOM 0 HG2 MET A 37 8.231 15.163 9.564 1.00 0.00 H new ATOM 0 HG3 MET A 37 9.460 15.593 10.738 1.00 0.00 H new ATOM 0 HE1 MET A 37 9.632 18.043 7.699 1.00 0.00 H new ATOM 0 HE2 MET A 37 8.558 17.469 8.997 1.00 0.00 H new ATOM 0 HE3 MET A 37 10.180 18.085 9.391 1.00 0.00 H new ATOM 512 N GLU A 38 10.015 11.028 11.797 1.00 0.00 N ATOM 513 CA GLU A 38 10.365 9.584 11.890 1.00 0.00 C ATOM 514 C GLU A 38 9.110 8.785 12.238 1.00 0.00 C ATOM 515 O GLU A 38 8.836 7.753 11.657 1.00 0.00 O ATOM 516 CB GLU A 38 11.418 9.383 12.980 1.00 0.00 C ATOM 517 CG GLU A 38 12.737 10.017 12.535 1.00 0.00 C ATOM 518 CD GLU A 38 13.838 9.670 13.540 1.00 0.00 C ATOM 519 OE1 GLU A 38 13.512 9.110 14.574 1.00 0.00 O ATOM 520 OE2 GLU A 38 14.986 9.971 13.259 1.00 0.00 O ATOM 0 H GLU A 38 10.542 11.644 12.416 1.00 0.00 H new ATOM 0 HA GLU A 38 10.765 9.241 10.936 1.00 0.00 H new ATOM 0 HB2 GLU A 38 11.082 9.834 13.914 1.00 0.00 H new ATOM 0 HB3 GLU A 38 11.560 8.320 13.173 1.00 0.00 H new ATOM 0 HG2 GLU A 38 13.009 9.656 11.543 1.00 0.00 H new ATOM 0 HG3 GLU A 38 12.626 11.099 12.461 1.00 0.00 H new ATOM 527 N ASN A 39 8.339 9.257 13.179 1.00 0.00 N ATOM 528 CA ASN A 39 7.098 8.526 13.558 1.00 0.00 C ATOM 529 C ASN A 39 6.225 8.343 12.319 1.00 0.00 C ATOM 530 O ASN A 39 5.643 7.297 12.105 1.00 0.00 O ATOM 531 CB ASN A 39 6.331 9.329 14.611 1.00 0.00 C ATOM 532 CG ASN A 39 7.211 9.520 15.848 1.00 0.00 C ATOM 533 OD1 ASN A 39 8.165 8.794 16.048 1.00 0.00 O ATOM 534 ND2 ASN A 39 6.930 10.475 16.692 1.00 0.00 N ATOM 0 H ASN A 39 8.515 10.116 13.701 1.00 0.00 H new ATOM 0 HA ASN A 39 7.359 7.551 13.969 1.00 0.00 H new ATOM 0 HB2 ASN A 39 6.041 10.298 14.205 1.00 0.00 H new ATOM 0 HB3 ASN A 39 5.412 8.809 14.882 1.00 0.00 H new ATOM 0 HD21 ASN A 39 7.511 10.612 17.519 1.00 0.00 H new ATOM 0 HD22 ASN A 39 6.129 11.084 16.524 1.00 0.00 H new ATOM 541 N MET A 40 6.135 9.349 11.496 1.00 0.00 N ATOM 542 CA MET A 40 5.306 9.233 10.264 1.00 0.00 C ATOM 543 C MET A 40 5.893 8.142 9.369 1.00 0.00 C ATOM 544 O MET A 40 5.185 7.456 8.663 1.00 0.00 O ATOM 545 CB MET A 40 5.308 10.568 9.517 1.00 0.00 C ATOM 546 CG MET A 40 4.630 11.633 10.380 1.00 0.00 C ATOM 547 SD MET A 40 4.489 13.173 9.441 1.00 0.00 S ATOM 548 CE MET A 40 3.905 14.213 10.802 1.00 0.00 C ATOM 0 H MET A 40 6.600 10.248 11.623 1.00 0.00 H new ATOM 0 HA MET A 40 4.281 8.976 10.532 1.00 0.00 H new ATOM 0 HB2 MET A 40 6.331 10.867 9.287 1.00 0.00 H new ATOM 0 HB3 MET A 40 4.784 10.466 8.567 1.00 0.00 H new ATOM 0 HG2 MET A 40 3.642 11.291 10.688 1.00 0.00 H new ATOM 0 HG3 MET A 40 5.207 11.801 11.289 1.00 0.00 H new ATOM 0 HE1 MET A 40 3.765 15.234 10.446 1.00 0.00 H new ATOM 0 HE2 MET A 40 2.957 13.826 11.175 1.00 0.00 H new ATOM 0 HE3 MET A 40 4.641 14.207 11.606 1.00 0.00 H new ATOM 558 N SER A 41 7.183 7.972 9.399 1.00 0.00 N ATOM 559 CA SER A 41 7.817 6.919 8.556 1.00 0.00 C ATOM 560 C SER A 41 7.445 5.541 9.109 1.00 0.00 C ATOM 561 O SER A 41 7.472 4.551 8.405 1.00 0.00 O ATOM 562 CB SER A 41 9.336 7.087 8.582 1.00 0.00 C ATOM 563 OG SER A 41 9.676 8.392 8.138 1.00 0.00 O ATOM 0 H SER A 41 7.828 8.517 9.971 1.00 0.00 H new ATOM 0 HA SER A 41 7.463 7.010 7.529 1.00 0.00 H new ATOM 0 HB2 SER A 41 9.713 6.925 9.592 1.00 0.00 H new ATOM 0 HB3 SER A 41 9.806 6.340 7.943 1.00 0.00 H new ATOM 0 HG SER A 41 10.650 8.500 8.156 1.00 0.00 H new ATOM 569 N LEU A 42 7.104 5.468 10.368 1.00 0.00 N ATOM 570 CA LEU A 42 6.737 4.154 10.967 1.00 0.00 C ATOM 571 C LEU A 42 5.237 3.909 10.793 1.00 0.00 C ATOM 572 O LEU A 42 4.781 2.782 10.771 1.00 0.00 O ATOM 573 CB LEU A 42 7.082 4.161 12.458 1.00 0.00 C ATOM 574 CG LEU A 42 6.713 2.810 13.074 1.00 0.00 C ATOM 575 CD1 LEU A 42 7.809 1.790 12.761 1.00 0.00 C ATOM 576 CD2 LEU A 42 6.574 2.962 14.590 1.00 0.00 C ATOM 0 H LEU A 42 7.064 6.262 11.007 1.00 0.00 H new ATOM 0 HA LEU A 42 7.293 3.361 10.466 1.00 0.00 H new ATOM 0 HB2 LEU A 42 8.145 4.357 12.595 1.00 0.00 H new ATOM 0 HB3 LEU A 42 6.543 4.962 12.963 1.00 0.00 H new ATOM 0 HG LEU A 42 5.767 2.466 12.655 1.00 0.00 H new ATOM 0 HD11 LEU A 42 7.546 0.827 13.200 1.00 0.00 H new ATOM 0 HD12 LEU A 42 7.907 1.682 11.681 1.00 0.00 H new ATOM 0 HD13 LEU A 42 8.755 2.133 13.179 1.00 0.00 H new ATOM 0 HD21 LEU A 42 6.311 2.000 15.030 1.00 0.00 H new ATOM 0 HD22 LEU A 42 7.519 3.306 15.009 1.00 0.00 H new ATOM 0 HD23 LEU A 42 5.792 3.688 14.813 1.00 0.00 H new ATOM 588 N ILE A 43 4.465 4.953 10.676 1.00 0.00 N ATOM 589 CA ILE A 43 2.994 4.778 10.511 1.00 0.00 C ATOM 590 C ILE A 43 2.530 5.505 9.246 1.00 0.00 C ATOM 591 O ILE A 43 3.098 6.499 8.846 1.00 0.00 O ATOM 592 CB ILE A 43 2.277 5.361 11.730 1.00 0.00 C ATOM 593 CG1 ILE A 43 2.484 4.435 12.931 1.00 0.00 C ATOM 594 CG2 ILE A 43 0.781 5.488 11.438 1.00 0.00 C ATOM 595 CD1 ILE A 43 1.960 5.115 14.196 1.00 0.00 C ATOM 0 H ILE A 43 4.789 5.920 10.687 1.00 0.00 H new ATOM 0 HA ILE A 43 2.760 3.717 10.422 1.00 0.00 H new ATOM 0 HB ILE A 43 2.685 6.347 11.952 1.00 0.00 H new ATOM 0 HG12 ILE A 43 1.963 3.491 12.770 1.00 0.00 H new ATOM 0 HG13 ILE A 43 3.542 4.199 13.044 1.00 0.00 H new ATOM 0 HG21 ILE A 43 0.274 5.904 12.309 1.00 0.00 H new ATOM 0 HG22 ILE A 43 0.632 6.147 10.583 1.00 0.00 H new ATOM 0 HG23 ILE A 43 0.369 4.504 11.214 1.00 0.00 H new ATOM 0 HD11 ILE A 43 2.107 4.456 15.051 1.00 0.00 H new ATOM 0 HD12 ILE A 43 2.501 6.047 14.359 1.00 0.00 H new ATOM 0 HD13 ILE A 43 0.897 5.328 14.081 1.00 0.00 H new ATOM 607 N GLY A 44 1.507 5.012 8.609 1.00 0.00 N ATOM 608 CA GLY A 44 1.019 5.672 7.367 1.00 0.00 C ATOM 609 C GLY A 44 1.463 4.839 6.166 1.00 0.00 C ATOM 610 O GLY A 44 0.708 4.048 5.635 1.00 0.00 O ATOM 0 H GLY A 44 0.988 4.182 8.894 1.00 0.00 H new ATOM 0 HA2 GLY A 44 -0.067 5.759 7.386 1.00 0.00 H new ATOM 0 HA3 GLY A 44 1.418 6.684 7.294 1.00 0.00 H new ATOM 614 N ASN A 45 2.686 4.995 5.743 1.00 0.00 N ATOM 615 CA ASN A 45 3.177 4.194 4.591 1.00 0.00 C ATOM 616 C ASN A 45 3.133 2.714 4.971 1.00 0.00 C ATOM 617 O ASN A 45 2.958 1.850 4.136 1.00 0.00 O ATOM 618 CB ASN A 45 4.616 4.595 4.260 1.00 0.00 C ATOM 619 CG ASN A 45 4.639 6.039 3.753 1.00 0.00 C ATOM 620 OD1 ASN A 45 3.608 6.600 3.436 1.00 0.00 O ATOM 621 ND2 ASN A 45 5.779 6.667 3.663 1.00 0.00 N ATOM 0 H ASN A 45 3.365 5.642 6.145 1.00 0.00 H new ATOM 0 HA ASN A 45 2.549 4.375 3.719 1.00 0.00 H new ATOM 0 HB2 ASN A 45 5.244 4.499 5.145 1.00 0.00 H new ATOM 0 HB3 ASN A 45 5.027 3.926 3.504 1.00 0.00 H new ATOM 0 HD21 ASN A 45 5.806 7.630 3.326 1.00 0.00 H new ATOM 0 HD22 ASN A 45 6.643 6.195 3.929 1.00 0.00 H new ATOM 628 N THR A 46 3.281 2.421 6.236 1.00 0.00 N ATOM 629 CA THR A 46 3.238 1.002 6.683 1.00 0.00 C ATOM 630 C THR A 46 1.845 0.437 6.411 1.00 0.00 C ATOM 631 O THR A 46 1.686 -0.719 6.072 1.00 0.00 O ATOM 632 CB THR A 46 3.535 0.930 8.184 1.00 0.00 C ATOM 633 OG1 THR A 46 4.799 1.526 8.443 1.00 0.00 O ATOM 634 CG2 THR A 46 3.557 -0.532 8.632 1.00 0.00 C ATOM 0 H THR A 46 3.430 3.105 6.978 1.00 0.00 H new ATOM 0 HA THR A 46 3.984 0.421 6.140 1.00 0.00 H new ATOM 0 HB THR A 46 2.761 1.464 8.735 1.00 0.00 H new ATOM 0 HG1 THR A 46 4.849 1.790 9.385 1.00 0.00 H new ATOM 0 HG21 THR A 46 3.768 -0.582 9.700 1.00 0.00 H new ATOM 0 HG22 THR A 46 2.588 -0.988 8.432 1.00 0.00 H new ATOM 0 HG23 THR A 46 4.331 -1.069 8.083 1.00 0.00 H new ATOM 642 N LEU A 47 0.832 1.249 6.552 1.00 0.00 N ATOM 643 CA LEU A 47 -0.553 0.766 6.297 1.00 0.00 C ATOM 644 C LEU A 47 -0.624 0.155 4.898 1.00 0.00 C ATOM 645 O LEU A 47 -1.321 -0.813 4.668 1.00 0.00 O ATOM 646 CB LEU A 47 -1.529 1.940 6.390 1.00 0.00 C ATOM 647 CG LEU A 47 -1.407 2.599 7.766 1.00 0.00 C ATOM 648 CD1 LEU A 47 -2.478 3.682 7.908 1.00 0.00 C ATOM 649 CD2 LEU A 47 -1.602 1.544 8.856 1.00 0.00 C ATOM 0 H LEU A 47 0.905 2.227 6.833 1.00 0.00 H new ATOM 0 HA LEU A 47 -0.820 0.014 7.039 1.00 0.00 H new ATOM 0 HB2 LEU A 47 -1.315 2.667 5.607 1.00 0.00 H new ATOM 0 HB3 LEU A 47 -2.550 1.592 6.231 1.00 0.00 H new ATOM 0 HG LEU A 47 -0.419 3.048 7.868 1.00 0.00 H new ATOM 0 HD11 LEU A 47 -2.392 4.152 8.888 1.00 0.00 H new ATOM 0 HD12 LEU A 47 -2.340 4.434 7.131 1.00 0.00 H new ATOM 0 HD13 LEU A 47 -3.466 3.232 7.807 1.00 0.00 H new ATOM 0 HD21 LEU A 47 -1.515 2.013 9.836 1.00 0.00 H new ATOM 0 HD22 LEU A 47 -2.590 1.095 8.755 1.00 0.00 H new ATOM 0 HD23 LEU A 47 -0.840 0.771 8.755 1.00 0.00 H new ATOM 661 N MET A 48 0.094 0.712 3.959 1.00 0.00 N ATOM 662 CA MET A 48 0.066 0.159 2.578 1.00 0.00 C ATOM 663 C MET A 48 0.370 -1.337 2.633 1.00 0.00 C ATOM 664 O MET A 48 -0.237 -2.130 1.939 1.00 0.00 O ATOM 665 CB MET A 48 1.118 0.864 1.720 1.00 0.00 C ATOM 666 CG MET A 48 1.044 0.336 0.285 1.00 0.00 C ATOM 667 SD MET A 48 2.409 1.027 -0.682 1.00 0.00 S ATOM 668 CE MET A 48 3.718 -0.028 -0.014 1.00 0.00 C ATOM 0 H MET A 48 0.697 1.524 4.090 1.00 0.00 H new ATOM 0 HA MET A 48 -0.919 0.319 2.139 1.00 0.00 H new ATOM 0 HB2 MET A 48 0.950 1.941 1.732 1.00 0.00 H new ATOM 0 HB3 MET A 48 2.113 0.692 2.131 1.00 0.00 H new ATOM 0 HG2 MET A 48 1.097 -0.753 0.283 1.00 0.00 H new ATOM 0 HG3 MET A 48 0.090 0.609 -0.166 1.00 0.00 H new ATOM 0 HE1 MET A 48 4.460 0.589 0.493 1.00 0.00 H new ATOM 0 HE2 MET A 48 3.289 -0.735 0.695 1.00 0.00 H new ATOM 0 HE3 MET A 48 4.195 -0.574 -0.827 1.00 0.00 H new ATOM 678 N ALA A 49 1.296 -1.734 3.462 1.00 0.00 N ATOM 679 CA ALA A 49 1.624 -3.182 3.567 1.00 0.00 C ATOM 680 C ALA A 49 0.375 -3.929 4.031 1.00 0.00 C ATOM 681 O ALA A 49 0.098 -5.031 3.600 1.00 0.00 O ATOM 682 CB ALA A 49 2.747 -3.383 4.585 1.00 0.00 C ATOM 0 H ALA A 49 1.838 -1.119 4.069 1.00 0.00 H new ATOM 0 HA ALA A 49 1.951 -3.561 2.599 1.00 0.00 H new ATOM 0 HB1 ALA A 49 2.985 -4.444 4.660 1.00 0.00 H new ATOM 0 HB2 ALA A 49 3.632 -2.834 4.263 1.00 0.00 H new ATOM 0 HB3 ALA A 49 2.426 -3.014 5.559 1.00 0.00 H new ATOM 688 N ALA A 50 -0.388 -3.327 4.902 1.00 0.00 N ATOM 689 CA ALA A 50 -1.628 -3.988 5.389 1.00 0.00 C ATOM 690 C ALA A 50 -2.568 -4.206 4.205 1.00 0.00 C ATOM 691 O ALA A 50 -3.420 -5.071 4.223 1.00 0.00 O ATOM 692 CB ALA A 50 -2.309 -3.090 6.421 1.00 0.00 C ATOM 0 H ALA A 50 -0.204 -2.405 5.297 1.00 0.00 H new ATOM 0 HA ALA A 50 -1.383 -4.945 5.849 1.00 0.00 H new ATOM 0 HB1 ALA A 50 -3.218 -3.572 6.779 1.00 0.00 H new ATOM 0 HB2 ALA A 50 -1.633 -2.921 7.259 1.00 0.00 H new ATOM 0 HB3 ALA A 50 -2.562 -2.135 5.961 1.00 0.00 H new ATOM 698 N MET A 51 -2.416 -3.421 3.173 1.00 0.00 N ATOM 699 CA MET A 51 -3.296 -3.577 1.983 1.00 0.00 C ATOM 700 C MET A 51 -3.223 -5.019 1.484 1.00 0.00 C ATOM 701 O MET A 51 -4.165 -5.536 0.927 1.00 0.00 O ATOM 702 CB MET A 51 -2.830 -2.632 0.873 1.00 0.00 C ATOM 703 CG MET A 51 -3.028 -1.179 1.316 1.00 0.00 C ATOM 704 SD MET A 51 -2.569 -0.070 -0.038 1.00 0.00 S ATOM 705 CE MET A 51 -2.841 1.489 0.840 1.00 0.00 C ATOM 0 H MET A 51 -1.720 -2.679 3.104 1.00 0.00 H new ATOM 0 HA MET A 51 -4.323 -3.336 2.258 1.00 0.00 H new ATOM 0 HB2 MET A 51 -1.780 -2.813 0.645 1.00 0.00 H new ATOM 0 HB3 MET A 51 -3.392 -2.824 -0.041 1.00 0.00 H new ATOM 0 HG2 MET A 51 -4.067 -1.012 1.601 1.00 0.00 H new ATOM 0 HG3 MET A 51 -2.419 -0.969 2.195 1.00 0.00 H new ATOM 0 HE1 MET A 51 -3.560 2.096 0.290 1.00 0.00 H new ATOM 0 HE2 MET A 51 -3.229 1.282 1.837 1.00 0.00 H new ATOM 0 HE3 MET A 51 -1.898 2.030 0.922 1.00 0.00 H new ATOM 876 N LEU A 63 -11.642 -0.370 4.490 1.00 0.00 N ATOM 877 CA LEU A 63 -10.812 0.861 4.362 1.00 0.00 C ATOM 878 C LEU A 63 -11.376 1.957 5.266 1.00 0.00 C ATOM 879 O LEU A 63 -10.645 2.710 5.873 1.00 0.00 O ATOM 880 CB LEU A 63 -10.830 1.342 2.913 1.00 0.00 C ATOM 881 CG LEU A 63 -9.464 1.085 2.277 1.00 0.00 C ATOM 882 CD1 LEU A 63 -9.622 0.997 0.761 1.00 0.00 C ATOM 883 CD2 LEU A 63 -8.515 2.234 2.626 1.00 0.00 C ATOM 0 HA LEU A 63 -9.788 0.636 4.659 1.00 0.00 H new ATOM 0 HB2 LEU A 63 -11.608 0.821 2.355 1.00 0.00 H new ATOM 0 HB3 LEU A 63 -11.068 2.405 2.874 1.00 0.00 H new ATOM 0 HG LEU A 63 -9.054 0.149 2.656 1.00 0.00 H new ATOM 0 HD11 LEU A 63 -8.650 0.814 0.304 1.00 0.00 H new ATOM 0 HD12 LEU A 63 -10.299 0.180 0.513 1.00 0.00 H new ATOM 0 HD13 LEU A 63 -10.030 1.934 0.383 1.00 0.00 H new ATOM 0 HD21 LEU A 63 -7.541 2.052 2.173 1.00 0.00 H new ATOM 0 HD22 LEU A 63 -8.922 3.171 2.246 1.00 0.00 H new ATOM 0 HD23 LEU A 63 -8.405 2.299 3.708 1.00 0.00 H new ATOM 895 N GLN A 64 -12.672 2.052 5.360 1.00 0.00 N ATOM 896 CA GLN A 64 -13.274 3.103 6.228 1.00 0.00 C ATOM 897 C GLN A 64 -12.694 2.977 7.637 1.00 0.00 C ATOM 898 O GLN A 64 -12.409 3.960 8.292 1.00 0.00 O ATOM 899 CB GLN A 64 -14.793 2.919 6.282 1.00 0.00 C ATOM 900 CG GLN A 64 -15.433 3.590 5.066 1.00 0.00 C ATOM 901 CD GLN A 64 -16.910 3.198 4.991 1.00 0.00 C ATOM 902 OE1 GLN A 64 -17.384 2.419 5.794 1.00 0.00 O ATOM 903 NE2 GLN A 64 -17.662 3.707 4.054 1.00 0.00 N ATOM 0 H GLN A 64 -13.339 1.451 4.876 1.00 0.00 H new ATOM 0 HA GLN A 64 -13.047 4.089 5.822 1.00 0.00 H new ATOM 0 HB2 GLN A 64 -15.041 1.858 6.297 1.00 0.00 H new ATOM 0 HB3 GLN A 64 -15.190 3.352 7.200 1.00 0.00 H new ATOM 0 HG2 GLN A 64 -15.336 4.673 5.141 1.00 0.00 H new ATOM 0 HG3 GLN A 64 -14.917 3.286 4.155 1.00 0.00 H new ATOM 0 HE21 GLN A 64 -17.264 4.361 3.380 1.00 0.00 H new ATOM 0 HE22 GLN A 64 -18.648 3.451 3.996 1.00 0.00 H new ATOM 912 N ALA A 65 -12.506 1.773 8.106 1.00 0.00 N ATOM 913 CA ALA A 65 -11.933 1.587 9.467 1.00 0.00 C ATOM 914 C ALA A 65 -10.445 1.949 9.437 1.00 0.00 C ATOM 915 O ALA A 65 -9.913 2.513 10.373 1.00 0.00 O ATOM 916 CB ALA A 65 -12.097 0.127 9.897 1.00 0.00 C ATOM 0 H ALA A 65 -12.725 0.912 7.605 1.00 0.00 H new ATOM 0 HA ALA A 65 -12.454 2.230 10.176 1.00 0.00 H new ATOM 0 HB1 ALA A 65 -11.677 -0.008 10.894 1.00 0.00 H new ATOM 0 HB2 ALA A 65 -13.156 -0.131 9.911 1.00 0.00 H new ATOM 0 HB3 ALA A 65 -11.575 -0.521 9.193 1.00 0.00 H new ATOM 922 N LEU A 66 -9.772 1.634 8.362 1.00 0.00 N ATOM 923 CA LEU A 66 -8.321 1.961 8.262 1.00 0.00 C ATOM 924 C LEU A 66 -8.151 3.463 8.026 1.00 0.00 C ATOM 925 O LEU A 66 -7.365 4.119 8.680 1.00 0.00 O ATOM 926 CB LEU A 66 -7.707 1.192 7.091 1.00 0.00 C ATOM 927 CG LEU A 66 -6.201 1.452 7.040 1.00 0.00 C ATOM 928 CD1 LEU A 66 -5.578 1.128 8.399 1.00 0.00 C ATOM 929 CD2 LEU A 66 -5.569 0.566 5.964 1.00 0.00 C ATOM 0 H LEU A 66 -10.166 1.163 7.548 1.00 0.00 H new ATOM 0 HA LEU A 66 -7.820 1.679 9.188 1.00 0.00 H new ATOM 0 HB2 LEU A 66 -7.898 0.125 7.203 1.00 0.00 H new ATOM 0 HB3 LEU A 66 -8.172 1.502 6.155 1.00 0.00 H new ATOM 0 HG LEU A 66 -6.021 2.500 6.801 1.00 0.00 H new ATOM 0 HD11 LEU A 66 -4.505 1.314 8.361 1.00 0.00 H new ATOM 0 HD12 LEU A 66 -6.028 1.759 9.165 1.00 0.00 H new ATOM 0 HD13 LEU A 66 -5.756 0.080 8.641 1.00 0.00 H new ATOM 0 HD21 LEU A 66 -4.495 0.750 5.926 1.00 0.00 H new ATOM 0 HD22 LEU A 66 -5.750 -0.482 6.203 1.00 0.00 H new ATOM 0 HD23 LEU A 66 -6.011 0.798 4.995 1.00 0.00 H new ATOM 941 N ASP A 67 -8.880 4.011 7.092 1.00 0.00 N ATOM 942 CA ASP A 67 -8.759 5.469 6.811 1.00 0.00 C ATOM 943 C ASP A 67 -8.820 6.254 8.123 1.00 0.00 C ATOM 944 O ASP A 67 -8.131 7.238 8.301 1.00 0.00 O ATOM 945 CB ASP A 67 -9.913 5.907 5.908 1.00 0.00 C ATOM 946 CG ASP A 67 -9.590 7.271 5.294 1.00 0.00 C ATOM 947 OD1 ASP A 67 -8.423 7.523 5.040 1.00 0.00 O ATOM 948 OD2 ASP A 67 -10.515 8.039 5.088 1.00 0.00 O ATOM 0 H ASP A 67 -9.554 3.512 6.512 1.00 0.00 H new ATOM 0 HA ASP A 67 -7.808 5.664 6.316 1.00 0.00 H new ATOM 0 HB2 ASP A 67 -10.073 5.170 5.121 1.00 0.00 H new ATOM 0 HB3 ASP A 67 -10.837 5.965 6.483 1.00 0.00 H new ATOM 953 N MET A 68 -9.642 5.830 9.042 1.00 0.00 N ATOM 954 CA MET A 68 -9.748 6.555 10.339 1.00 0.00 C ATOM 955 C MET A 68 -8.489 6.304 11.174 1.00 0.00 C ATOM 956 O MET A 68 -8.052 7.153 11.925 1.00 0.00 O ATOM 957 CB MET A 68 -10.975 6.054 11.102 1.00 0.00 C ATOM 958 CG MET A 68 -12.245 6.529 10.393 1.00 0.00 C ATOM 959 SD MET A 68 -13.693 6.092 11.386 1.00 0.00 S ATOM 960 CE MET A 68 -14.952 6.653 10.213 1.00 0.00 C ATOM 0 H MET A 68 -10.245 5.013 8.951 1.00 0.00 H new ATOM 0 HA MET A 68 -9.847 7.624 10.149 1.00 0.00 H new ATOM 0 HB2 MET A 68 -10.962 4.966 11.158 1.00 0.00 H new ATOM 0 HB3 MET A 68 -10.957 6.426 12.126 1.00 0.00 H new ATOM 0 HG2 MET A 68 -12.207 7.608 10.241 1.00 0.00 H new ATOM 0 HG3 MET A 68 -12.316 6.071 9.407 1.00 0.00 H new ATOM 0 HE1 MET A 68 -15.943 6.475 10.630 1.00 0.00 H new ATOM 0 HE2 MET A 68 -14.824 7.719 10.024 1.00 0.00 H new ATOM 0 HE3 MET A 68 -14.848 6.103 9.277 1.00 0.00 H new ATOM 970 N ALA A 69 -7.905 5.141 11.053 1.00 0.00 N ATOM 971 CA ALA A 69 -6.679 4.837 11.844 1.00 0.00 C ATOM 972 C ALA A 69 -5.552 5.785 11.431 1.00 0.00 C ATOM 973 O ALA A 69 -4.859 6.340 12.260 1.00 0.00 O ATOM 974 CB ALA A 69 -6.250 3.392 11.581 1.00 0.00 C ATOM 0 H ALA A 69 -8.224 4.390 10.441 1.00 0.00 H new ATOM 0 HA ALA A 69 -6.891 4.969 12.905 1.00 0.00 H new ATOM 0 HB1 ALA A 69 -5.353 3.168 12.159 1.00 0.00 H new ATOM 0 HB2 ALA A 69 -7.051 2.715 11.877 1.00 0.00 H new ATOM 0 HB3 ALA A 69 -6.039 3.262 10.519 1.00 0.00 H new ATOM 980 N PHE A 70 -5.360 5.974 10.154 1.00 0.00 N ATOM 981 CA PHE A 70 -4.275 6.884 9.690 1.00 0.00 C ATOM 982 C PHE A 70 -4.422 8.247 10.371 1.00 0.00 C ATOM 983 O PHE A 70 -3.449 8.894 10.703 1.00 0.00 O ATOM 984 CB PHE A 70 -4.372 7.059 8.173 1.00 0.00 C ATOM 985 CG PHE A 70 -3.308 8.024 7.709 1.00 0.00 C ATOM 986 CD1 PHE A 70 -1.993 7.581 7.521 1.00 0.00 C ATOM 987 CD2 PHE A 70 -3.636 9.363 7.467 1.00 0.00 C ATOM 988 CE1 PHE A 70 -1.007 8.477 7.092 1.00 0.00 C ATOM 989 CE2 PHE A 70 -2.650 10.259 7.038 1.00 0.00 C ATOM 990 CZ PHE A 70 -1.336 9.816 6.851 1.00 0.00 C ATOM 0 H PHE A 70 -5.908 5.538 9.412 1.00 0.00 H new ATOM 0 HA PHE A 70 -3.307 6.454 9.947 1.00 0.00 H new ATOM 0 HB2 PHE A 70 -4.247 6.097 7.676 1.00 0.00 H new ATOM 0 HB3 PHE A 70 -5.360 7.432 7.902 1.00 0.00 H new ATOM 0 HD1 PHE A 70 -1.740 6.548 7.707 1.00 0.00 H new ATOM 0 HD2 PHE A 70 -4.650 9.705 7.611 1.00 0.00 H new ATOM 0 HE1 PHE A 70 0.007 8.135 6.947 1.00 0.00 H new ATOM 0 HE2 PHE A 70 -2.903 11.292 6.851 1.00 0.00 H new ATOM 0 HZ PHE A 70 -0.575 10.508 6.521 1.00 0.00 H new ATOM 1000 N ALA A 71 -5.631 8.689 10.581 1.00 0.00 N ATOM 1001 CA ALA A 71 -5.838 10.010 11.239 1.00 0.00 C ATOM 1002 C ALA A 71 -5.438 9.919 12.715 1.00 0.00 C ATOM 1003 O ALA A 71 -4.918 10.858 13.285 1.00 0.00 O ATOM 1004 CB ALA A 71 -7.311 10.407 11.135 1.00 0.00 C ATOM 0 H ALA A 71 -6.485 8.193 10.325 1.00 0.00 H new ATOM 0 HA ALA A 71 -5.222 10.760 10.743 1.00 0.00 H new ATOM 0 HB1 ALA A 71 -7.462 11.373 11.616 1.00 0.00 H new ATOM 0 HB2 ALA A 71 -7.596 10.476 10.085 1.00 0.00 H new ATOM 0 HB3 ALA A 71 -7.926 9.655 11.629 1.00 0.00 H new ATOM 1010 N SER A 72 -5.678 8.797 13.337 1.00 0.00 N ATOM 1011 CA SER A 72 -5.313 8.651 14.775 1.00 0.00 C ATOM 1012 C SER A 72 -3.790 8.624 14.922 1.00 0.00 C ATOM 1013 O SER A 72 -3.242 9.126 15.883 1.00 0.00 O ATOM 1014 CB SER A 72 -5.899 7.346 15.320 1.00 0.00 C ATOM 1015 OG SER A 72 -7.299 7.321 15.088 1.00 0.00 O ATOM 0 H SER A 72 -6.110 7.976 12.913 1.00 0.00 H new ATOM 0 HA SER A 72 -5.715 9.495 15.335 1.00 0.00 H new ATOM 0 HB2 SER A 72 -5.424 6.492 14.836 1.00 0.00 H new ATOM 0 HB3 SER A 72 -5.695 7.262 16.387 1.00 0.00 H new ATOM 0 HG SER A 72 -7.470 7.176 14.134 1.00 0.00 H new ATOM 1021 N SER A 73 -3.103 8.038 13.980 1.00 0.00 N ATOM 1022 CA SER A 73 -1.617 7.976 14.072 1.00 0.00 C ATOM 1023 C SER A 73 -1.029 9.372 13.867 1.00 0.00 C ATOM 1024 O SER A 73 -0.204 9.829 14.632 1.00 0.00 O ATOM 1025 CB SER A 73 -1.079 7.033 12.993 1.00 0.00 C ATOM 1026 OG SER A 73 -1.622 5.736 13.185 1.00 0.00 O ATOM 0 H SER A 73 -3.506 7.600 13.152 1.00 0.00 H new ATOM 0 HA SER A 73 -1.332 7.606 15.057 1.00 0.00 H new ATOM 0 HB2 SER A 73 -1.343 7.407 12.004 1.00 0.00 H new ATOM 0 HB3 SER A 73 0.009 6.994 13.039 1.00 0.00 H new ATOM 0 HG SER A 73 -1.848 5.344 12.316 1.00 0.00 H new ATOM 1032 N VAL A 74 -1.447 10.052 12.839 1.00 0.00 N ATOM 1033 CA VAL A 74 -0.911 11.418 12.580 1.00 0.00 C ATOM 1034 C VAL A 74 -1.201 12.316 13.784 1.00 0.00 C ATOM 1035 O VAL A 74 -0.416 13.178 14.130 1.00 0.00 O ATOM 1036 CB VAL A 74 -1.580 12.002 11.335 1.00 0.00 C ATOM 1037 CG1 VAL A 74 -1.408 11.034 10.161 1.00 0.00 C ATOM 1038 CG2 VAL A 74 -3.070 12.213 11.607 1.00 0.00 C ATOM 0 H VAL A 74 -2.138 9.722 12.165 1.00 0.00 H new ATOM 0 HA VAL A 74 0.166 11.361 12.420 1.00 0.00 H new ATOM 0 HB VAL A 74 -1.117 12.958 11.089 1.00 0.00 H new ATOM 0 HG11 VAL A 74 -1.885 11.450 9.274 1.00 0.00 H new ATOM 0 HG12 VAL A 74 -0.346 10.884 9.966 1.00 0.00 H new ATOM 0 HG13 VAL A 74 -1.870 10.078 10.407 1.00 0.00 H new ATOM 0 HG21 VAL A 74 -3.547 12.629 10.719 1.00 0.00 H new ATOM 0 HG22 VAL A 74 -3.534 11.258 11.854 1.00 0.00 H new ATOM 0 HG23 VAL A 74 -3.193 12.903 12.442 1.00 0.00 H new ATOM 1048 N ALA A 75 -2.319 12.122 14.426 1.00 0.00 N ATOM 1049 CA ALA A 75 -2.655 12.967 15.607 1.00 0.00 C ATOM 1050 C ALA A 75 -1.684 12.658 16.748 1.00 0.00 C ATOM 1051 O ALA A 75 -1.193 13.548 17.416 1.00 0.00 O ATOM 1052 CB ALA A 75 -4.085 12.664 16.058 1.00 0.00 C ATOM 0 H ALA A 75 -3.014 11.416 14.185 1.00 0.00 H new ATOM 0 HA ALA A 75 -2.574 14.020 15.337 1.00 0.00 H new ATOM 0 HB1 ALA A 75 -4.333 13.281 16.922 1.00 0.00 H new ATOM 0 HB2 ALA A 75 -4.777 12.883 15.245 1.00 0.00 H new ATOM 0 HB3 ALA A 75 -4.166 11.611 16.329 1.00 0.00 H new ATOM 1058 N GLN A 76 -1.402 11.405 16.979 1.00 0.00 N ATOM 1059 CA GLN A 76 -0.464 11.041 18.079 1.00 0.00 C ATOM 1060 C GLN A 76 0.937 11.565 17.751 1.00 0.00 C ATOM 1061 O GLN A 76 1.607 12.142 18.584 1.00 0.00 O ATOM 1062 CB GLN A 76 -0.417 9.519 18.227 1.00 0.00 C ATOM 1063 CG GLN A 76 -1.784 9.007 18.688 1.00 0.00 C ATOM 1064 CD GLN A 76 -1.750 7.480 18.783 1.00 0.00 C ATOM 1065 OE1 GLN A 76 -0.878 6.844 18.226 1.00 0.00 O ATOM 1066 NE2 GLN A 76 -2.670 6.860 19.473 1.00 0.00 N ATOM 0 H GLN A 76 -1.781 10.617 16.453 1.00 0.00 H new ATOM 0 HA GLN A 76 -0.809 11.487 19.012 1.00 0.00 H new ATOM 0 HB2 GLN A 76 -0.146 9.059 17.277 1.00 0.00 H new ATOM 0 HB3 GLN A 76 0.351 9.237 18.948 1.00 0.00 H new ATOM 0 HG2 GLN A 76 -2.038 9.437 19.657 1.00 0.00 H new ATOM 0 HG3 GLN A 76 -2.557 9.322 17.987 1.00 0.00 H new ATOM 0 HE21 GLN A 76 -3.403 7.393 19.941 1.00 0.00 H new ATOM 0 HE22 GLN A 76 -2.656 5.843 19.544 1.00 0.00 H new ATOM 1075 N ILE A 77 1.386 11.363 16.542 1.00 0.00 N ATOM 1076 CA ILE A 77 2.743 11.846 16.158 1.00 0.00 C ATOM 1077 C ILE A 77 2.859 13.341 16.450 1.00 0.00 C ATOM 1078 O ILE A 77 3.787 13.791 17.092 1.00 0.00 O ATOM 1079 CB ILE A 77 2.966 11.601 14.665 1.00 0.00 C ATOM 1080 CG1 ILE A 77 2.877 10.102 14.373 1.00 0.00 C ATOM 1081 CG2 ILE A 77 4.350 12.118 14.263 1.00 0.00 C ATOM 1082 CD1 ILE A 77 2.906 9.875 12.860 1.00 0.00 C ATOM 0 H ILE A 77 0.871 10.884 15.803 1.00 0.00 H new ATOM 0 HA ILE A 77 3.495 11.306 16.734 1.00 0.00 H new ATOM 0 HB ILE A 77 2.201 12.128 14.094 1.00 0.00 H new ATOM 0 HG12 ILE A 77 3.708 9.578 14.846 1.00 0.00 H new ATOM 0 HG13 ILE A 77 1.960 9.692 14.796 1.00 0.00 H new ATOM 0 HG21 ILE A 77 4.509 11.943 13.199 1.00 0.00 H new ATOM 0 HG22 ILE A 77 4.413 13.187 14.469 1.00 0.00 H new ATOM 0 HG23 ILE A 77 5.115 11.593 14.835 1.00 0.00 H new ATOM 0 HD11 ILE A 77 2.843 8.807 12.651 1.00 0.00 H new ATOM 0 HD12 ILE A 77 2.060 10.386 12.399 1.00 0.00 H new ATOM 0 HD13 ILE A 77 3.836 10.270 12.451 1.00 0.00 H new ATOM 1094 N ALA A 78 1.924 14.113 15.978 1.00 0.00 N ATOM 1095 CA ALA A 78 1.975 15.583 16.218 1.00 0.00 C ATOM 1096 C ALA A 78 1.507 15.890 17.642 1.00 0.00 C ATOM 1097 O ALA A 78 2.149 16.616 18.374 1.00 0.00 O ATOM 1098 CB ALA A 78 1.060 16.289 15.219 1.00 0.00 C ATOM 0 H ALA A 78 1.123 13.790 15.434 1.00 0.00 H new ATOM 0 HA ALA A 78 2.999 15.936 16.092 1.00 0.00 H new ATOM 0 HB1 ALA A 78 1.094 17.365 15.391 1.00 0.00 H new ATOM 0 HB2 ALA A 78 1.394 16.073 14.204 1.00 0.00 H new ATOM 0 HB3 ALA A 78 0.038 15.934 15.348 1.00 0.00 H new ATOM 1104 N ALA A 79 0.389 15.346 18.040 1.00 0.00 N ATOM 1105 CA ALA A 79 -0.119 15.612 19.415 1.00 0.00 C ATOM 1106 C ALA A 79 0.931 15.175 20.439 1.00 0.00 C ATOM 1107 O ALA A 79 0.965 15.656 21.554 1.00 0.00 O ATOM 1108 CB ALA A 79 -1.412 14.827 19.641 1.00 0.00 C ATOM 0 H ALA A 79 -0.193 14.730 17.473 1.00 0.00 H new ATOM 0 HA ALA A 79 -0.317 16.678 19.531 1.00 0.00 H new ATOM 0 HB1 ALA A 79 -1.784 15.021 20.647 1.00 0.00 H new ATOM 0 HB2 ALA A 79 -2.159 15.139 18.911 1.00 0.00 H new ATOM 0 HB3 ALA A 79 -1.215 13.761 19.526 1.00 0.00 H new ATOM 1114 N SER A 80 1.790 14.267 20.066 1.00 0.00 N ATOM 1115 CA SER A 80 2.841 13.799 21.014 1.00 0.00 C ATOM 1116 C SER A 80 3.993 14.808 21.035 1.00 0.00 C ATOM 1117 O SER A 80 4.776 14.851 21.962 1.00 0.00 O ATOM 1118 CB SER A 80 3.365 12.434 20.562 1.00 0.00 C ATOM 1119 OG SER A 80 3.962 12.556 19.280 1.00 0.00 O ATOM 0 H SER A 80 1.810 13.828 19.145 1.00 0.00 H new ATOM 0 HA SER A 80 2.416 13.711 22.014 1.00 0.00 H new ATOM 0 HB2 SER A 80 4.094 12.057 21.280 1.00 0.00 H new ATOM 0 HB3 SER A 80 2.549 11.713 20.527 1.00 0.00 H new ATOM 0 HG SER A 80 3.610 13.352 18.830 1.00 0.00 H new ATOM 1125 N GLN A 81 4.100 15.619 20.019 1.00 0.00 N ATOM 1126 CA GLN A 81 5.198 16.625 19.977 1.00 0.00 C ATOM 1127 C GLN A 81 5.196 17.443 21.271 1.00 0.00 C ATOM 1128 O GLN A 81 6.223 17.900 21.729 1.00 0.00 O ATOM 1129 CB GLN A 81 4.988 17.559 18.784 1.00 0.00 C ATOM 1130 CG GLN A 81 5.140 16.767 17.484 1.00 0.00 C ATOM 1131 CD GLN A 81 5.127 17.730 16.295 1.00 0.00 C ATOM 1132 OE1 GLN A 81 4.144 17.828 15.588 1.00 0.00 O ATOM 1133 NE2 GLN A 81 6.186 18.451 16.043 1.00 0.00 N ATOM 0 H GLN A 81 3.473 15.628 19.214 1.00 0.00 H new ATOM 0 HA GLN A 81 6.154 16.112 19.875 1.00 0.00 H new ATOM 0 HB2 GLN A 81 3.998 18.012 18.833 1.00 0.00 H new ATOM 0 HB3 GLN A 81 5.713 18.373 18.814 1.00 0.00 H new ATOM 0 HG2 GLN A 81 6.072 16.201 17.497 1.00 0.00 H new ATOM 0 HG3 GLN A 81 4.330 16.044 17.389 1.00 0.00 H new ATOM 0 HE21 GLN A 81 7.012 18.369 16.636 1.00 0.00 H new ATOM 0 HE22 GLN A 81 6.188 19.096 15.253 1.00 0.00 H new ATOM 1142 N GLY A 82 4.049 17.631 21.862 1.00 0.00 N ATOM 1143 CA GLY A 82 3.981 18.420 23.124 1.00 0.00 C ATOM 1144 C GLY A 82 4.013 19.914 22.791 1.00 0.00 C ATOM 1145 O GLY A 82 4.312 20.741 23.629 1.00 0.00 O ATOM 0 H GLY A 82 3.155 17.272 21.526 1.00 0.00 H new ATOM 0 HA2 GLY A 82 3.069 18.177 23.669 1.00 0.00 H new ATOM 0 HA3 GLY A 82 4.818 18.163 23.773 1.00 0.00 H new ATOM 1149 N GLY A 83 3.705 20.264 21.573 1.00 0.00 N ATOM 1150 CA GLY A 83 3.716 21.703 21.184 1.00 0.00 C ATOM 1151 C GLY A 83 2.277 22.214 21.092 1.00 0.00 C ATOM 1152 O GLY A 83 1.355 21.588 21.577 1.00 0.00 O ATOM 0 H GLY A 83 3.446 19.616 20.829 1.00 0.00 H new ATOM 0 HA2 GLY A 83 4.274 22.285 21.917 1.00 0.00 H new ATOM 0 HA3 GLY A 83 4.220 21.829 20.226 1.00 0.00 H new ATOM 1156 N ASP A 84 2.075 23.346 20.475 1.00 0.00 N ATOM 1157 CA ASP A 84 0.694 23.891 20.354 1.00 0.00 C ATOM 1158 C ASP A 84 -0.180 22.891 19.594 1.00 0.00 C ATOM 1159 O ASP A 84 0.222 22.336 18.590 1.00 0.00 O ATOM 1160 CB ASP A 84 0.731 25.221 19.598 1.00 0.00 C ATOM 1161 CG ASP A 84 1.416 26.280 20.465 1.00 0.00 C ATOM 1162 OD1 ASP A 84 1.701 25.983 21.612 1.00 0.00 O ATOM 1163 OD2 ASP A 84 1.643 27.370 19.965 1.00 0.00 O ATOM 0 H ASP A 84 2.806 23.916 20.050 1.00 0.00 H new ATOM 0 HA ASP A 84 0.278 24.055 21.348 1.00 0.00 H new ATOM 0 HB2 ASP A 84 1.268 25.102 18.657 1.00 0.00 H new ATOM 0 HB3 ASP A 84 -0.282 25.539 19.349 1.00 0.00 H new ATOM 1168 N LEU A 85 -1.373 22.654 20.067 1.00 0.00 N ATOM 1169 CA LEU A 85 -2.272 21.686 19.377 1.00 0.00 C ATOM 1170 C LEU A 85 -3.014 22.392 18.239 1.00 0.00 C ATOM 1171 O LEU A 85 -3.535 21.760 17.341 1.00 0.00 O ATOM 1172 CB LEU A 85 -3.286 21.138 20.384 1.00 0.00 C ATOM 1173 CG LEU A 85 -4.072 19.987 19.749 1.00 0.00 C ATOM 1174 CD1 LEU A 85 -3.341 18.668 20.003 1.00 0.00 C ATOM 1175 CD2 LEU A 85 -5.468 19.922 20.371 1.00 0.00 C ATOM 0 H LEU A 85 -1.764 23.089 20.902 1.00 0.00 H new ATOM 0 HA LEU A 85 -1.681 20.868 18.966 1.00 0.00 H new ATOM 0 HB2 LEU A 85 -2.772 20.790 21.280 1.00 0.00 H new ATOM 0 HB3 LEU A 85 -3.968 21.929 20.695 1.00 0.00 H new ATOM 0 HG LEU A 85 -4.157 20.154 18.675 1.00 0.00 H new ATOM 0 HD11 LEU A 85 -3.901 17.849 19.551 1.00 0.00 H new ATOM 0 HD12 LEU A 85 -2.345 18.713 19.563 1.00 0.00 H new ATOM 0 HD13 LEU A 85 -3.256 18.500 21.077 1.00 0.00 H new ATOM 0 HD21 LEU A 85 -6.029 19.103 19.920 1.00 0.00 H new ATOM 0 HD22 LEU A 85 -5.381 19.754 21.444 1.00 0.00 H new ATOM 0 HD23 LEU A 85 -5.990 20.862 20.192 1.00 0.00 H new ATOM 1187 N GLY A 86 -3.067 23.695 18.269 1.00 0.00 N ATOM 1188 CA GLY A 86 -3.778 24.437 17.189 1.00 0.00 C ATOM 1189 C GLY A 86 -2.973 24.356 15.889 1.00 0.00 C ATOM 1190 O GLY A 86 -3.528 24.295 14.809 1.00 0.00 O ATOM 0 H GLY A 86 -2.649 24.278 18.994 1.00 0.00 H new ATOM 0 HA2 GLY A 86 -4.772 24.016 17.039 1.00 0.00 H new ATOM 0 HA3 GLY A 86 -3.914 25.479 17.479 1.00 0.00 H new ATOM 1194 N VAL A 87 -1.672 24.359 15.980 1.00 0.00 N ATOM 1195 CA VAL A 87 -0.841 24.286 14.745 1.00 0.00 C ATOM 1196 C VAL A 87 -0.986 22.903 14.111 1.00 0.00 C ATOM 1197 O VAL A 87 -1.184 22.777 12.918 1.00 0.00 O ATOM 1198 CB VAL A 87 0.627 24.543 15.096 1.00 0.00 C ATOM 1199 CG1 VAL A 87 1.224 23.306 15.774 1.00 0.00 C ATOM 1200 CG2 VAL A 87 1.407 24.850 13.815 1.00 0.00 C ATOM 0 H VAL A 87 -1.149 24.409 16.854 1.00 0.00 H new ATOM 0 HA VAL A 87 -1.178 25.043 14.037 1.00 0.00 H new ATOM 0 HB VAL A 87 0.692 25.391 15.778 1.00 0.00 H new ATOM 0 HG11 VAL A 87 2.269 23.495 16.021 1.00 0.00 H new ATOM 0 HG12 VAL A 87 0.669 23.088 16.686 1.00 0.00 H new ATOM 0 HG13 VAL A 87 1.160 22.454 15.098 1.00 0.00 H new ATOM 0 HG21 VAL A 87 2.453 25.034 14.061 1.00 0.00 H new ATOM 0 HG22 VAL A 87 1.338 24.001 13.135 1.00 0.00 H new ATOM 0 HG23 VAL A 87 0.986 25.734 13.336 1.00 0.00 H new ATOM 1210 N THR A 88 -0.893 21.863 14.893 1.00 0.00 N ATOM 1211 CA THR A 88 -1.032 20.500 14.315 1.00 0.00 C ATOM 1212 C THR A 88 -2.317 20.447 13.496 1.00 0.00 C ATOM 1213 O THR A 88 -2.383 19.812 12.464 1.00 0.00 O ATOM 1214 CB THR A 88 -1.100 19.461 15.435 1.00 0.00 C ATOM 1215 OG1 THR A 88 0.108 19.490 16.182 1.00 0.00 O ATOM 1216 CG2 THR A 88 -1.294 18.074 14.823 1.00 0.00 C ATOM 0 H THR A 88 -0.728 21.898 15.899 1.00 0.00 H new ATOM 0 HA THR A 88 -0.172 20.281 13.682 1.00 0.00 H new ATOM 0 HB THR A 88 -1.936 19.687 16.096 1.00 0.00 H new ATOM 0 HG1 THR A 88 0.064 18.825 16.901 1.00 0.00 H new ATOM 0 HG21 THR A 88 -1.343 17.329 15.617 1.00 0.00 H new ATOM 0 HG22 THR A 88 -2.221 18.055 14.250 1.00 0.00 H new ATOM 0 HG23 THR A 88 -0.456 17.847 14.164 1.00 0.00 H new ATOM 1224 N THR A 89 -3.336 21.127 13.941 1.00 0.00 N ATOM 1225 CA THR A 89 -4.609 21.129 13.174 1.00 0.00 C ATOM 1226 C THR A 89 -4.307 21.611 11.759 1.00 0.00 C ATOM 1227 O THR A 89 -4.728 21.019 10.785 1.00 0.00 O ATOM 1228 CB THR A 89 -5.613 22.072 13.841 1.00 0.00 C ATOM 1229 OG1 THR A 89 -5.771 21.707 15.205 1.00 0.00 O ATOM 1230 CG2 THR A 89 -6.960 21.972 13.124 1.00 0.00 C ATOM 0 H THR A 89 -3.342 21.679 14.799 1.00 0.00 H new ATOM 0 HA THR A 89 -5.038 20.127 13.148 1.00 0.00 H new ATOM 0 HB THR A 89 -5.246 23.097 13.781 1.00 0.00 H new ATOM 0 HG1 THR A 89 -6.413 22.312 15.633 1.00 0.00 H new ATOM 0 HG21 THR A 89 -7.676 22.643 13.599 1.00 0.00 H new ATOM 0 HG22 THR A 89 -6.837 22.253 12.078 1.00 0.00 H new ATOM 0 HG23 THR A 89 -7.329 20.948 13.184 1.00 0.00 H new ATOM 1238 N ASN A 90 -3.561 22.675 11.638 1.00 0.00 N ATOM 1239 CA ASN A 90 -3.208 23.189 10.289 1.00 0.00 C ATOM 1240 C ASN A 90 -2.217 22.223 9.639 1.00 0.00 C ATOM 1241 O ASN A 90 -2.292 21.936 8.461 1.00 0.00 O ATOM 1242 CB ASN A 90 -2.567 24.573 10.416 1.00 0.00 C ATOM 1243 CG ASN A 90 -3.576 25.550 11.021 1.00 0.00 C ATOM 1244 OD1 ASN A 90 -4.767 25.311 10.988 1.00 0.00 O ATOM 1245 ND2 ASN A 90 -3.148 26.651 11.576 1.00 0.00 N ATOM 0 H ASN A 90 -3.181 23.210 12.419 1.00 0.00 H new ATOM 0 HA ASN A 90 -4.106 23.268 9.677 1.00 0.00 H new ATOM 0 HB2 ASN A 90 -1.678 24.517 11.044 1.00 0.00 H new ATOM 0 HB3 ASN A 90 -2.244 24.927 9.437 1.00 0.00 H new ATOM 0 HD21 ASN A 90 -3.813 27.310 11.981 1.00 0.00 H new ATOM 0 HD22 ASN A 90 -2.149 26.853 11.604 1.00 0.00 H new ATOM 1252 N ALA A 91 -1.288 21.715 10.405 1.00 0.00 N ATOM 1253 CA ALA A 91 -0.289 20.762 9.842 1.00 0.00 C ATOM 1254 C ALA A 91 -1.000 19.489 9.383 1.00 0.00 C ATOM 1255 O ALA A 91 -0.940 19.113 8.229 1.00 0.00 O ATOM 1256 CB ALA A 91 0.739 20.409 10.920 1.00 0.00 C ATOM 0 H ALA A 91 -1.178 21.920 11.398 1.00 0.00 H new ATOM 0 HA ALA A 91 0.215 21.223 8.993 1.00 0.00 H new ATOM 0 HB1 ALA A 91 1.471 19.712 10.511 1.00 0.00 H new ATOM 0 HB2 ALA A 91 1.246 21.316 11.250 1.00 0.00 H new ATOM 0 HB3 ALA A 91 0.233 19.947 11.768 1.00 0.00 H new ATOM 1262 N ILE A 92 -1.671 18.820 10.279 1.00 0.00 N ATOM 1263 CA ILE A 92 -2.384 17.568 9.900 1.00 0.00 C ATOM 1264 C ILE A 92 -3.476 17.887 8.878 1.00 0.00 C ATOM 1265 O ILE A 92 -3.587 17.246 7.851 1.00 0.00 O ATOM 1266 CB ILE A 92 -3.022 16.954 11.147 1.00 0.00 C ATOM 1267 CG1 ILE A 92 -1.943 16.701 12.202 1.00 0.00 C ATOM 1268 CG2 ILE A 92 -3.696 15.631 10.777 1.00 0.00 C ATOM 1269 CD1 ILE A 92 -1.044 15.550 11.748 1.00 0.00 C ATOM 0 H ILE A 92 -1.757 19.087 11.260 1.00 0.00 H new ATOM 0 HA ILE A 92 -1.675 16.864 9.464 1.00 0.00 H new ATOM 0 HB ILE A 92 -3.767 17.641 11.549 1.00 0.00 H new ATOM 0 HG12 ILE A 92 -1.349 17.602 12.353 1.00 0.00 H new ATOM 0 HG13 ILE A 92 -2.405 16.460 13.159 1.00 0.00 H new ATOM 0 HG21 ILE A 92 -4.151 15.193 11.666 1.00 0.00 H new ATOM 0 HG22 ILE A 92 -4.466 15.812 10.027 1.00 0.00 H new ATOM 0 HG23 ILE A 92 -2.952 14.944 10.374 1.00 0.00 H new ATOM 0 HD11 ILE A 92 -0.276 15.370 12.500 1.00 0.00 H new ATOM 0 HD12 ILE A 92 -1.644 14.649 11.619 1.00 0.00 H new ATOM 0 HD13 ILE A 92 -0.571 15.809 10.801 1.00 0.00 H new ATOM 1281 N ALA A 93 -4.288 18.869 9.153 1.00 0.00 N ATOM 1282 CA ALA A 93 -5.380 19.225 8.202 1.00 0.00 C ATOM 1283 C ALA A 93 -4.788 19.626 6.848 1.00 0.00 C ATOM 1284 O ALA A 93 -5.203 19.145 5.813 1.00 0.00 O ATOM 1285 CB ALA A 93 -6.190 20.393 8.768 1.00 0.00 C ATOM 0 H ALA A 93 -4.243 19.442 9.996 1.00 0.00 H new ATOM 0 HA ALA A 93 -6.029 18.360 8.066 1.00 0.00 H new ATOM 0 HB1 ALA A 93 -6.988 20.653 8.073 1.00 0.00 H new ATOM 0 HB2 ALA A 93 -6.623 20.105 9.726 1.00 0.00 H new ATOM 0 HB3 ALA A 93 -5.537 21.254 8.909 1.00 0.00 H new ATOM 1291 N ASP A 94 -3.827 20.510 6.843 1.00 0.00 N ATOM 1292 CA ASP A 94 -3.222 20.941 5.551 1.00 0.00 C ATOM 1293 C ASP A 94 -2.718 19.717 4.783 1.00 0.00 C ATOM 1294 O ASP A 94 -2.921 19.595 3.592 1.00 0.00 O ATOM 1295 CB ASP A 94 -2.050 21.886 5.826 1.00 0.00 C ATOM 1296 CG ASP A 94 -2.588 23.249 6.270 1.00 0.00 C ATOM 1297 OD1 ASP A 94 -3.798 23.398 6.320 1.00 0.00 O ATOM 1298 OD2 ASP A 94 -1.781 24.119 6.553 1.00 0.00 O ATOM 0 H ASP A 94 -3.436 20.951 7.675 1.00 0.00 H new ATOM 0 HA ASP A 94 -3.975 21.457 4.955 1.00 0.00 H new ATOM 0 HB2 ASP A 94 -1.405 21.468 6.599 1.00 0.00 H new ATOM 0 HB3 ASP A 94 -1.441 21.998 4.929 1.00 0.00 H new ATOM 1303 N ALA A 95 -2.062 18.811 5.454 1.00 0.00 N ATOM 1304 CA ALA A 95 -1.546 17.599 4.756 1.00 0.00 C ATOM 1305 C ALA A 95 -2.719 16.816 4.162 1.00 0.00 C ATOM 1306 O ALA A 95 -2.667 16.361 3.037 1.00 0.00 O ATOM 1307 CB ALA A 95 -0.798 16.715 5.756 1.00 0.00 C ATOM 0 H ALA A 95 -1.861 18.857 6.453 1.00 0.00 H new ATOM 0 HA ALA A 95 -0.867 17.900 3.958 1.00 0.00 H new ATOM 0 HB1 ALA A 95 -0.420 15.828 5.247 1.00 0.00 H new ATOM 0 HB2 ALA A 95 0.037 17.272 6.181 1.00 0.00 H new ATOM 0 HB3 ALA A 95 -1.477 16.413 6.554 1.00 0.00 H new ATOM 1313 N LEU A 96 -3.776 16.659 4.909 1.00 0.00 N ATOM 1314 CA LEU A 96 -4.952 15.907 4.387 1.00 0.00 C ATOM 1315 C LEU A 96 -5.635 16.726 3.290 1.00 0.00 C ATOM 1316 O LEU A 96 -6.097 16.194 2.300 1.00 0.00 O ATOM 1317 CB LEU A 96 -5.947 15.656 5.523 1.00 0.00 C ATOM 1318 CG LEU A 96 -5.203 15.117 6.746 1.00 0.00 C ATOM 1319 CD1 LEU A 96 -5.895 15.604 8.021 1.00 0.00 C ATOM 1320 CD2 LEU A 96 -5.214 13.589 6.715 1.00 0.00 C ATOM 0 H LEU A 96 -3.877 17.019 5.858 1.00 0.00 H new ATOM 0 HA LEU A 96 -4.617 14.953 3.978 1.00 0.00 H new ATOM 0 HB2 LEU A 96 -6.465 16.581 5.778 1.00 0.00 H new ATOM 0 HB3 LEU A 96 -6.707 14.943 5.204 1.00 0.00 H new ATOM 0 HG LEU A 96 -4.174 15.475 6.731 1.00 0.00 H new ATOM 0 HD11 LEU A 96 -5.365 15.220 8.892 1.00 0.00 H new ATOM 0 HD12 LEU A 96 -5.890 16.694 8.044 1.00 0.00 H new ATOM 0 HD13 LEU A 96 -6.924 15.246 8.036 1.00 0.00 H new ATOM 0 HD21 LEU A 96 -4.684 13.204 7.586 1.00 0.00 H new ATOM 0 HD22 LEU A 96 -6.244 13.232 6.730 1.00 0.00 H new ATOM 0 HD23 LEU A 96 -4.722 13.240 5.807 1.00 0.00 H new ATOM 1332 N THR A 97 -5.709 18.016 3.464 1.00 0.00 N ATOM 1333 CA THR A 97 -6.369 18.872 2.439 1.00 0.00 C ATOM 1334 C THR A 97 -5.638 18.746 1.101 1.00 0.00 C ATOM 1335 O THR A 97 -6.239 18.489 0.077 1.00 0.00 O ATOM 1336 CB THR A 97 -6.341 20.331 2.900 1.00 0.00 C ATOM 1337 OG1 THR A 97 -7.145 20.474 4.063 1.00 0.00 O ATOM 1338 CG2 THR A 97 -6.883 21.231 1.789 1.00 0.00 C ATOM 0 H THR A 97 -5.340 18.515 4.273 1.00 0.00 H new ATOM 0 HA THR A 97 -7.401 18.546 2.313 1.00 0.00 H new ATOM 0 HB THR A 97 -5.315 20.620 3.129 1.00 0.00 H new ATOM 0 HG1 THR A 97 -7.127 21.408 4.360 1.00 0.00 H new ATOM 0 HG21 THR A 97 -6.862 22.270 2.119 1.00 0.00 H new ATOM 0 HG22 THR A 97 -6.265 21.121 0.898 1.00 0.00 H new ATOM 0 HG23 THR A 97 -7.909 20.945 1.557 1.00 0.00 H new ATOM 1346 N SER A 98 -4.347 18.930 1.097 1.00 0.00 N ATOM 1347 CA SER A 98 -3.584 18.828 -0.177 1.00 0.00 C ATOM 1348 C SER A 98 -3.746 17.425 -0.769 1.00 0.00 C ATOM 1349 O SER A 98 -4.018 17.265 -1.941 1.00 0.00 O ATOM 1350 CB SER A 98 -2.102 19.097 0.095 1.00 0.00 C ATOM 1351 OG SER A 98 -1.410 19.227 -1.138 1.00 0.00 O ATOM 0 H SER A 98 -3.788 19.147 1.922 1.00 0.00 H new ATOM 0 HA SER A 98 -3.967 19.563 -0.885 1.00 0.00 H new ATOM 0 HB2 SER A 98 -1.989 20.006 0.685 1.00 0.00 H new ATOM 0 HB3 SER A 98 -1.675 18.282 0.680 1.00 0.00 H new ATOM 0 HG SER A 98 -0.461 19.401 -0.964 1.00 0.00 H new ATOM 1357 N ALA A 99 -3.576 16.409 0.030 1.00 0.00 N ATOM 1358 CA ALA A 99 -3.712 15.018 -0.491 1.00 0.00 C ATOM 1359 C ALA A 99 -5.112 14.810 -1.074 1.00 0.00 C ATOM 1360 O ALA A 99 -5.274 14.202 -2.113 1.00 0.00 O ATOM 1361 CB ALA A 99 -3.479 14.024 0.647 1.00 0.00 C ATOM 0 H ALA A 99 -3.349 16.481 1.022 1.00 0.00 H new ATOM 0 HA ALA A 99 -2.973 14.857 -1.276 1.00 0.00 H new ATOM 0 HB1 ALA A 99 -3.578 13.007 0.268 1.00 0.00 H new ATOM 0 HB2 ALA A 99 -2.477 14.164 1.053 1.00 0.00 H new ATOM 0 HB3 ALA A 99 -4.215 14.192 1.433 1.00 0.00 H new ATOM 1367 N PHE A 100 -6.128 15.306 -0.420 1.00 0.00 N ATOM 1368 CA PHE A 100 -7.509 15.125 -0.950 1.00 0.00 C ATOM 1369 C PHE A 100 -7.520 15.456 -2.442 1.00 0.00 C ATOM 1370 O PHE A 100 -7.955 14.674 -3.263 1.00 0.00 O ATOM 1371 CB PHE A 100 -8.466 16.074 -0.225 1.00 0.00 C ATOM 1372 CG PHE A 100 -9.312 15.296 0.751 1.00 0.00 C ATOM 1373 CD1 PHE A 100 -10.241 14.360 0.282 1.00 0.00 C ATOM 1374 CD2 PHE A 100 -9.169 15.514 2.125 1.00 0.00 C ATOM 1375 CE1 PHE A 100 -11.028 13.641 1.190 1.00 0.00 C ATOM 1376 CE2 PHE A 100 -9.954 14.797 3.032 1.00 0.00 C ATOM 1377 CZ PHE A 100 -10.885 13.861 2.565 1.00 0.00 C ATOM 0 H PHE A 100 -6.061 15.826 0.455 1.00 0.00 H new ATOM 0 HA PHE A 100 -7.826 14.094 -0.792 1.00 0.00 H new ATOM 0 HB2 PHE A 100 -7.901 16.843 0.301 1.00 0.00 H new ATOM 0 HB3 PHE A 100 -9.103 16.585 -0.947 1.00 0.00 H new ATOM 0 HD1 PHE A 100 -10.351 14.192 -0.779 1.00 0.00 H new ATOM 0 HD2 PHE A 100 -8.452 16.237 2.485 1.00 0.00 H new ATOM 0 HE1 PHE A 100 -11.744 12.918 0.830 1.00 0.00 H new ATOM 0 HE2 PHE A 100 -9.843 14.965 4.093 1.00 0.00 H new ATOM 0 HZ PHE A 100 -11.493 13.309 3.266 1.00 0.00 H new ATOM 1387 N TYR A 101 -7.048 16.618 -2.792 1.00 0.00 N ATOM 1388 CA TYR A 101 -7.026 17.026 -4.223 1.00 0.00 C ATOM 1389 C TYR A 101 -5.955 16.235 -4.976 1.00 0.00 C ATOM 1390 O TYR A 101 -6.093 15.947 -6.148 1.00 0.00 O ATOM 1391 CB TYR A 101 -6.728 18.524 -4.298 1.00 0.00 C ATOM 1392 CG TYR A 101 -7.456 19.221 -3.172 1.00 0.00 C ATOM 1393 CD1 TYR A 101 -8.811 18.948 -2.945 1.00 0.00 C ATOM 1394 CD2 TYR A 101 -6.777 20.128 -2.349 1.00 0.00 C ATOM 1395 CE1 TYR A 101 -9.489 19.584 -1.897 1.00 0.00 C ATOM 1396 CE2 TYR A 101 -7.455 20.764 -1.302 1.00 0.00 C ATOM 1397 CZ TYR A 101 -8.811 20.492 -1.076 1.00 0.00 C ATOM 1398 OH TYR A 101 -9.478 21.118 -0.042 1.00 0.00 O ATOM 0 H TYR A 101 -6.673 17.309 -2.142 1.00 0.00 H new ATOM 0 HA TYR A 101 -7.992 16.819 -4.684 1.00 0.00 H new ATOM 0 HB2 TYR A 101 -5.655 18.700 -4.220 1.00 0.00 H new ATOM 0 HB3 TYR A 101 -7.048 18.925 -5.260 1.00 0.00 H new ATOM 0 HD1 TYR A 101 -9.334 18.247 -3.579 1.00 0.00 H new ATOM 0 HD2 TYR A 101 -5.732 20.337 -2.522 1.00 0.00 H new ATOM 0 HE1 TYR A 101 -10.534 19.374 -1.723 1.00 0.00 H new ATOM 0 HE2 TYR A 101 -6.932 21.465 -0.668 1.00 0.00 H new ATOM 0 HH TYR A 101 -10.410 20.816 -0.024 1.00 0.00 H new ATOM 1408 N GLN A 102 -4.889 15.886 -4.315 1.00 0.00 N ATOM 1409 CA GLN A 102 -3.809 15.117 -4.994 1.00 0.00 C ATOM 1410 C GLN A 102 -4.205 13.643 -5.110 1.00 0.00 C ATOM 1411 O GLN A 102 -3.636 12.901 -5.887 1.00 0.00 O ATOM 1412 CB GLN A 102 -2.519 15.222 -4.177 1.00 0.00 C ATOM 1413 CG GLN A 102 -2.020 16.666 -4.186 1.00 0.00 C ATOM 1414 CD GLN A 102 -0.519 16.686 -3.887 1.00 0.00 C ATOM 1415 OE1 GLN A 102 0.077 15.655 -3.646 1.00 0.00 O ATOM 1416 NE2 GLN A 102 0.119 17.823 -3.894 1.00 0.00 N ATOM 0 H GLN A 102 -4.718 16.100 -3.332 1.00 0.00 H new ATOM 0 HA GLN A 102 -3.655 15.530 -5.991 1.00 0.00 H new ATOM 0 HB2 GLN A 102 -2.698 14.895 -3.153 1.00 0.00 H new ATOM 0 HB3 GLN A 102 -1.758 14.562 -4.594 1.00 0.00 H new ATOM 0 HG2 GLN A 102 -2.215 17.124 -5.156 1.00 0.00 H new ATOM 0 HG3 GLN A 102 -2.558 17.253 -3.442 1.00 0.00 H new ATOM 0 HE21 GLN A 102 -0.382 18.688 -4.096 1.00 0.00 H new ATOM 0 HE22 GLN A 102 1.120 17.848 -3.697 1.00 0.00 H new ATOM 1425 N THR A 103 -5.155 13.199 -4.332 1.00 0.00 N ATOM 1426 CA THR A 103 -5.545 11.761 -4.394 1.00 0.00 C ATOM 1427 C THR A 103 -6.888 11.579 -5.111 1.00 0.00 C ATOM 1428 O THR A 103 -6.977 10.871 -6.095 1.00 0.00 O ATOM 1429 CB THR A 103 -5.647 11.207 -2.972 1.00 0.00 C ATOM 1430 OG1 THR A 103 -6.717 11.848 -2.291 1.00 0.00 O ATOM 1431 CG2 THR A 103 -4.336 11.468 -2.229 1.00 0.00 C ATOM 0 H THR A 103 -5.675 13.765 -3.661 1.00 0.00 H new ATOM 0 HA THR A 103 -4.784 11.221 -4.957 1.00 0.00 H new ATOM 0 HB THR A 103 -5.834 10.134 -3.011 1.00 0.00 H new ATOM 0 HG1 THR A 103 -6.460 12.767 -2.069 1.00 0.00 H new ATOM 0 HG21 THR A 103 -4.408 11.074 -1.215 1.00 0.00 H new ATOM 0 HG22 THR A 103 -3.517 10.976 -2.753 1.00 0.00 H new ATOM 0 HG23 THR A 103 -4.148 12.541 -2.188 1.00 0.00 H new ATOM 1439 N THR A 104 -7.942 12.185 -4.627 1.00 0.00 N ATOM 1440 CA THR A 104 -9.263 11.997 -5.298 1.00 0.00 C ATOM 1441 C THR A 104 -9.887 13.348 -5.654 1.00 0.00 C ATOM 1442 O THR A 104 -10.434 13.524 -6.725 1.00 0.00 O ATOM 1443 CB THR A 104 -10.203 11.245 -4.352 1.00 0.00 C ATOM 1444 OG1 THR A 104 -9.664 9.960 -4.076 1.00 0.00 O ATOM 1445 CG2 THR A 104 -11.579 11.095 -5.000 1.00 0.00 C ATOM 0 H THR A 104 -7.947 12.793 -3.808 1.00 0.00 H new ATOM 0 HA THR A 104 -9.112 11.428 -6.215 1.00 0.00 H new ATOM 0 HB THR A 104 -10.305 11.806 -3.423 1.00 0.00 H new ATOM 0 HG1 THR A 104 -9.320 9.565 -4.904 1.00 0.00 H new ATOM 0 HG21 THR A 104 -12.244 10.559 -4.322 1.00 0.00 H new ATOM 0 HG22 THR A 104 -11.992 12.082 -5.209 1.00 0.00 H new ATOM 0 HG23 THR A 104 -11.484 10.537 -5.931 1.00 0.00 H new ATOM 1453 N GLY A 105 -9.821 14.303 -4.770 1.00 0.00 N ATOM 1454 CA GLY A 105 -10.425 15.631 -5.071 1.00 0.00 C ATOM 1455 C GLY A 105 -11.726 15.786 -4.284 1.00 0.00 C ATOM 1456 O GLY A 105 -12.748 16.165 -4.821 1.00 0.00 O ATOM 0 H GLY A 105 -9.377 14.223 -3.855 1.00 0.00 H new ATOM 0 HA2 GLY A 105 -9.730 16.428 -4.806 1.00 0.00 H new ATOM 0 HA3 GLY A 105 -10.620 15.720 -6.140 1.00 0.00 H new ATOM 1460 N VAL A 106 -11.693 15.499 -3.012 1.00 0.00 N ATOM 1461 CA VAL A 106 -12.922 15.632 -2.188 1.00 0.00 C ATOM 1462 C VAL A 106 -12.741 16.785 -1.202 1.00 0.00 C ATOM 1463 O VAL A 106 -11.671 17.348 -1.080 1.00 0.00 O ATOM 1464 CB VAL A 106 -13.163 14.335 -1.415 1.00 0.00 C ATOM 1465 CG1 VAL A 106 -14.591 14.326 -0.868 1.00 0.00 C ATOM 1466 CG2 VAL A 106 -12.966 13.138 -2.347 1.00 0.00 C ATOM 0 H VAL A 106 -10.866 15.178 -2.509 1.00 0.00 H new ATOM 0 HA VAL A 106 -13.777 15.831 -2.835 1.00 0.00 H new ATOM 0 HB VAL A 106 -12.456 14.270 -0.588 1.00 0.00 H new ATOM 0 HG11 VAL A 106 -14.764 13.402 -0.317 1.00 0.00 H new ATOM 0 HG12 VAL A 106 -14.731 15.177 -0.202 1.00 0.00 H new ATOM 0 HG13 VAL A 106 -15.298 14.393 -1.695 1.00 0.00 H new ATOM 0 HG21 VAL A 106 -13.138 12.214 -1.794 1.00 0.00 H new ATOM 0 HG22 VAL A 106 -13.671 13.202 -3.176 1.00 0.00 H new ATOM 0 HG23 VAL A 106 -11.948 13.144 -2.736 1.00 0.00 H new ATOM 1476 N VAL A 107 -13.775 17.140 -0.499 1.00 0.00 N ATOM 1477 CA VAL A 107 -13.661 18.256 0.479 1.00 0.00 C ATOM 1478 C VAL A 107 -12.856 17.788 1.692 1.00 0.00 C ATOM 1479 O VAL A 107 -13.220 16.843 2.364 1.00 0.00 O ATOM 1480 CB VAL A 107 -15.057 18.668 0.929 1.00 0.00 C ATOM 1481 CG1 VAL A 107 -15.838 19.223 -0.264 1.00 0.00 C ATOM 1482 CG2 VAL A 107 -15.782 17.442 1.488 1.00 0.00 C ATOM 0 H VAL A 107 -14.696 16.706 -0.558 1.00 0.00 H new ATOM 0 HA VAL A 107 -13.158 19.103 0.014 1.00 0.00 H new ATOM 0 HB VAL A 107 -14.983 19.437 1.698 1.00 0.00 H new ATOM 0 HG11 VAL A 107 -16.836 19.517 0.060 1.00 0.00 H new ATOM 0 HG12 VAL A 107 -15.317 20.091 -0.668 1.00 0.00 H new ATOM 0 HG13 VAL A 107 -15.918 18.457 -1.035 1.00 0.00 H new ATOM 0 HG21 VAL A 107 -16.783 17.728 1.813 1.00 0.00 H new ATOM 0 HG22 VAL A 107 -15.856 16.679 0.714 1.00 0.00 H new ATOM 0 HG23 VAL A 107 -15.225 17.045 2.337 1.00 0.00 H new ATOM 1492 N ASN A 108 -11.767 18.441 1.977 1.00 0.00 N ATOM 1493 CA ASN A 108 -10.936 18.039 3.146 1.00 0.00 C ATOM 1494 C ASN A 108 -11.657 18.399 4.447 1.00 0.00 C ATOM 1495 O ASN A 108 -11.473 17.766 5.468 1.00 0.00 O ATOM 1496 CB ASN A 108 -9.594 18.771 3.082 1.00 0.00 C ATOM 1497 CG ASN A 108 -9.786 20.238 3.473 1.00 0.00 C ATOM 1498 OD1 ASN A 108 -10.079 20.542 4.611 1.00 0.00 O ATOM 1499 ND2 ASN A 108 -9.632 21.166 2.568 1.00 0.00 N ATOM 0 H ASN A 108 -11.414 19.239 1.449 1.00 0.00 H new ATOM 0 HA ASN A 108 -10.770 16.962 3.120 1.00 0.00 H new ATOM 0 HB2 ASN A 108 -8.878 18.297 3.753 1.00 0.00 H new ATOM 0 HB3 ASN A 108 -9.180 18.704 2.076 1.00 0.00 H new ATOM 0 HD21 ASN A 108 -9.758 22.147 2.817 1.00 0.00 H new ATOM 0 HD22 ASN A 108 -9.386 20.910 1.612 1.00 0.00 H new ATOM 1506 N SER A 109 -12.462 19.424 4.419 1.00 0.00 N ATOM 1507 CA SER A 109 -13.183 19.850 5.652 1.00 0.00 C ATOM 1508 C SER A 109 -14.045 18.706 6.198 1.00 0.00 C ATOM 1509 O SER A 109 -14.273 18.609 7.387 1.00 0.00 O ATOM 1510 CB SER A 109 -14.080 21.045 5.323 1.00 0.00 C ATOM 1511 OG SER A 109 -14.631 21.567 6.523 1.00 0.00 O ATOM 0 H SER A 109 -12.653 19.988 3.591 1.00 0.00 H new ATOM 0 HA SER A 109 -12.449 20.127 6.409 1.00 0.00 H new ATOM 0 HB2 SER A 109 -13.504 21.815 4.809 1.00 0.00 H new ATOM 0 HB3 SER A 109 -14.878 20.739 4.647 1.00 0.00 H new ATOM 0 HG SER A 109 -15.205 22.333 6.313 1.00 0.00 H new ATOM 1517 N ARG A 110 -14.539 17.847 5.349 1.00 0.00 N ATOM 1518 CA ARG A 110 -15.396 16.732 5.850 1.00 0.00 C ATOM 1519 C ARG A 110 -14.540 15.715 6.612 1.00 0.00 C ATOM 1520 O ARG A 110 -14.816 15.390 7.749 1.00 0.00 O ATOM 1521 CB ARG A 110 -16.073 16.042 4.664 1.00 0.00 C ATOM 1522 CG ARG A 110 -17.030 14.964 5.177 1.00 0.00 C ATOM 1523 CD ARG A 110 -17.626 14.203 3.990 1.00 0.00 C ATOM 1524 NE ARG A 110 -18.389 15.145 3.124 1.00 0.00 N ATOM 1525 CZ ARG A 110 -18.890 14.733 1.992 1.00 0.00 C ATOM 1526 NH1 ARG A 110 -19.464 13.563 1.919 1.00 0.00 N ATOM 1527 NH2 ARG A 110 -18.817 15.491 0.931 1.00 0.00 N ATOM 0 H ARG A 110 -14.389 17.867 4.340 1.00 0.00 H new ATOM 0 HA ARG A 110 -16.153 17.135 6.523 1.00 0.00 H new ATOM 0 HB2 ARG A 110 -16.619 16.773 4.068 1.00 0.00 H new ATOM 0 HB3 ARG A 110 -15.322 15.596 4.012 1.00 0.00 H new ATOM 0 HG2 ARG A 110 -16.500 14.275 5.835 1.00 0.00 H new ATOM 0 HG3 ARG A 110 -17.825 15.420 5.767 1.00 0.00 H new ATOM 0 HD2 ARG A 110 -16.832 13.727 3.415 1.00 0.00 H new ATOM 0 HD3 ARG A 110 -18.282 13.409 4.347 1.00 0.00 H new ATOM 0 HE ARG A 110 -18.520 16.113 3.416 1.00 0.00 H new ATOM 0 HH11 ARG A 110 -19.521 12.970 2.747 1.00 0.00 H new ATOM 0 HH12 ARG A 110 -19.856 13.241 1.034 1.00 0.00 H new ATOM 0 HH21 ARG A 110 -18.368 16.405 0.987 1.00 0.00 H new ATOM 0 HH22 ARG A 110 -19.209 15.169 0.046 1.00 0.00 H new ATOM 1541 N PHE A 111 -13.505 15.213 5.998 1.00 0.00 N ATOM 1542 CA PHE A 111 -12.637 14.220 6.694 1.00 0.00 C ATOM 1543 C PHE A 111 -11.749 14.934 7.717 1.00 0.00 C ATOM 1544 O PHE A 111 -11.640 14.522 8.854 1.00 0.00 O ATOM 1545 CB PHE A 111 -11.761 13.502 5.667 1.00 0.00 C ATOM 1546 CG PHE A 111 -11.007 12.379 6.340 1.00 0.00 C ATOM 1547 CD1 PHE A 111 -11.703 11.276 6.850 1.00 0.00 C ATOM 1548 CD2 PHE A 111 -9.613 12.439 6.451 1.00 0.00 C ATOM 1549 CE1 PHE A 111 -11.004 10.234 7.472 1.00 0.00 C ATOM 1550 CE2 PHE A 111 -8.914 11.398 7.072 1.00 0.00 C ATOM 1551 CZ PHE A 111 -9.610 10.295 7.583 1.00 0.00 C ATOM 0 H PHE A 111 -13.222 15.446 5.046 1.00 0.00 H new ATOM 0 HA PHE A 111 -13.264 13.493 7.210 1.00 0.00 H new ATOM 0 HB2 PHE A 111 -12.379 13.107 4.860 1.00 0.00 H new ATOM 0 HB3 PHE A 111 -11.060 14.205 5.217 1.00 0.00 H new ATOM 0 HD1 PHE A 111 -12.779 11.229 6.764 1.00 0.00 H new ATOM 0 HD2 PHE A 111 -9.076 13.289 6.057 1.00 0.00 H new ATOM 0 HE1 PHE A 111 -11.540 9.383 7.866 1.00 0.00 H new ATOM 0 HE2 PHE A 111 -7.838 11.445 7.157 1.00 0.00 H new ATOM 0 HZ PHE A 111 -9.071 9.491 8.063 1.00 0.00 H new ATOM 1561 N ILE A 112 -11.105 15.997 7.315 1.00 0.00 N ATOM 1562 CA ILE A 112 -10.214 16.735 8.256 1.00 0.00 C ATOM 1563 C ILE A 112 -11.002 17.157 9.499 1.00 0.00 C ATOM 1564 O ILE A 112 -10.494 17.133 10.602 1.00 0.00 O ATOM 1565 CB ILE A 112 -9.656 17.975 7.554 1.00 0.00 C ATOM 1566 CG1 ILE A 112 -8.712 17.542 6.430 1.00 0.00 C ATOM 1567 CG2 ILE A 112 -8.887 18.833 8.560 1.00 0.00 C ATOM 1568 CD1 ILE A 112 -7.942 18.759 5.913 1.00 0.00 C ATOM 0 H ILE A 112 -11.158 16.387 6.374 1.00 0.00 H new ATOM 0 HA ILE A 112 -9.393 16.086 8.561 1.00 0.00 H new ATOM 0 HB ILE A 112 -10.479 18.555 7.137 1.00 0.00 H new ATOM 0 HG12 ILE A 112 -8.016 16.787 6.796 1.00 0.00 H new ATOM 0 HG13 ILE A 112 -9.280 17.086 5.619 1.00 0.00 H new ATOM 0 HG21 ILE A 112 -8.491 19.715 8.058 1.00 0.00 H new ATOM 0 HG22 ILE A 112 -9.557 19.142 9.362 1.00 0.00 H new ATOM 0 HG23 ILE A 112 -8.064 18.253 8.978 1.00 0.00 H new ATOM 0 HD11 ILE A 112 -7.270 18.451 5.112 1.00 0.00 H new ATOM 0 HD12 ILE A 112 -8.645 19.499 5.531 1.00 0.00 H new ATOM 0 HD13 ILE A 112 -7.362 19.195 6.726 1.00 0.00 H new ATOM 1580 N SER A 113 -12.236 17.544 9.333 1.00 0.00 N ATOM 1581 CA SER A 113 -13.046 17.966 10.512 1.00 0.00 C ATOM 1582 C SER A 113 -13.063 16.839 11.549 1.00 0.00 C ATOM 1583 O SER A 113 -12.980 17.077 12.738 1.00 0.00 O ATOM 1584 CB SER A 113 -14.477 18.271 10.065 1.00 0.00 C ATOM 1585 OG SER A 113 -14.530 19.575 9.507 1.00 0.00 O ATOM 0 H SER A 113 -12.718 17.587 8.435 1.00 0.00 H new ATOM 0 HA SER A 113 -12.606 18.860 10.954 1.00 0.00 H new ATOM 0 HB2 SER A 113 -14.804 17.536 9.330 1.00 0.00 H new ATOM 0 HB3 SER A 113 -15.158 18.199 10.913 1.00 0.00 H new ATOM 0 HG SER A 113 -14.440 19.518 8.533 1.00 0.00 H new ATOM 1591 N GLU A 114 -13.170 15.616 11.108 1.00 0.00 N ATOM 1592 CA GLU A 114 -13.192 14.477 12.070 1.00 0.00 C ATOM 1593 C GLU A 114 -11.793 14.277 12.658 1.00 0.00 C ATOM 1594 O GLU A 114 -11.636 13.990 13.829 1.00 0.00 O ATOM 1595 CB GLU A 114 -13.629 13.205 11.340 1.00 0.00 C ATOM 1596 CG GLU A 114 -15.039 13.404 10.780 1.00 0.00 C ATOM 1597 CD GLU A 114 -15.489 12.131 10.059 1.00 0.00 C ATOM 1598 OE1 GLU A 114 -14.657 11.261 9.860 1.00 0.00 O ATOM 1599 OE2 GLU A 114 -16.658 12.048 9.718 1.00 0.00 O ATOM 0 H GLU A 114 -13.243 15.356 10.124 1.00 0.00 H new ATOM 0 HA GLU A 114 -13.894 14.693 12.875 1.00 0.00 H new ATOM 0 HB2 GLU A 114 -12.933 12.978 10.532 1.00 0.00 H new ATOM 0 HB3 GLU A 114 -13.613 12.356 12.023 1.00 0.00 H new ATOM 0 HG2 GLU A 114 -15.732 13.641 11.587 1.00 0.00 H new ATOM 0 HG3 GLU A 114 -15.052 14.248 10.091 1.00 0.00 H new ATOM 1606 N ILE A 115 -10.775 14.429 11.856 1.00 0.00 N ATOM 1607 CA ILE A 115 -9.386 14.251 12.370 1.00 0.00 C ATOM 1608 C ILE A 115 -9.034 15.420 13.291 1.00 0.00 C ATOM 1609 O ILE A 115 -8.461 15.241 14.348 1.00 0.00 O ATOM 1610 CB ILE A 115 -8.409 14.221 11.194 1.00 0.00 C ATOM 1611 CG1 ILE A 115 -8.810 13.112 10.220 1.00 0.00 C ATOM 1612 CG2 ILE A 115 -6.996 13.958 11.715 1.00 0.00 C ATOM 1613 CD1 ILE A 115 -7.800 13.054 9.073 1.00 0.00 C ATOM 0 H ILE A 115 -10.844 14.669 10.867 1.00 0.00 H new ATOM 0 HA ILE A 115 -9.319 13.315 12.924 1.00 0.00 H new ATOM 0 HB ILE A 115 -8.434 15.180 10.677 1.00 0.00 H new ATOM 0 HG12 ILE A 115 -8.845 12.153 10.737 1.00 0.00 H new ATOM 0 HG13 ILE A 115 -9.810 13.300 9.829 1.00 0.00 H new ATOM 0 HG21 ILE A 115 -6.298 13.936 10.878 1.00 0.00 H new ATOM 0 HG22 ILE A 115 -6.710 14.751 12.406 1.00 0.00 H new ATOM 0 HG23 ILE A 115 -6.972 12.999 12.233 1.00 0.00 H new ATOM 0 HD11 ILE A 115 -8.084 12.264 8.378 1.00 0.00 H new ATOM 0 HD12 ILE A 115 -7.788 14.010 8.550 1.00 0.00 H new ATOM 0 HD13 ILE A 115 -6.807 12.846 9.472 1.00 0.00 H new ATOM 1625 N ARG A 116 -9.371 16.616 12.896 1.00 0.00 N ATOM 1626 CA ARG A 116 -9.059 17.802 13.742 1.00 0.00 C ATOM 1627 C ARG A 116 -9.630 17.588 15.147 1.00 0.00 C ATOM 1628 O ARG A 116 -9.029 17.956 16.135 1.00 0.00 O ATOM 1629 CB ARG A 116 -9.685 19.049 13.106 1.00 0.00 C ATOM 1630 CG ARG A 116 -9.790 20.172 14.142 1.00 0.00 C ATOM 1631 CD ARG A 116 -10.110 21.490 13.435 1.00 0.00 C ATOM 1632 NE ARG A 116 -11.580 21.586 13.208 1.00 0.00 N ATOM 1633 CZ ARG A 116 -12.368 21.954 14.180 1.00 0.00 C ATOM 1634 NH1 ARG A 116 -12.753 21.084 15.074 1.00 0.00 N ATOM 1635 NH2 ARG A 116 -12.771 23.193 14.260 1.00 0.00 N ATOM 0 H ARG A 116 -9.851 16.824 12.020 1.00 0.00 H new ATOM 0 HA ARG A 116 -7.980 17.936 13.813 1.00 0.00 H new ATOM 0 HB2 ARG A 116 -9.080 19.378 12.261 1.00 0.00 H new ATOM 0 HB3 ARG A 116 -10.674 18.810 12.716 1.00 0.00 H new ATOM 0 HG2 ARG A 116 -10.568 19.939 14.869 1.00 0.00 H new ATOM 0 HG3 ARG A 116 -8.854 20.261 14.694 1.00 0.00 H new ATOM 0 HD2 ARG A 116 -9.768 22.331 14.038 1.00 0.00 H new ATOM 0 HD3 ARG A 116 -9.580 21.543 12.484 1.00 0.00 H new ATOM 0 HE ARG A 116 -11.970 21.364 12.292 1.00 0.00 H new ATOM 0 HH11 ARG A 116 -12.438 20.116 15.013 1.00 0.00 H new ATOM 0 HH12 ARG A 116 -13.369 21.372 15.834 1.00 0.00 H new ATOM 0 HH21 ARG A 116 -12.470 23.873 13.562 1.00 0.00 H new ATOM 0 HH22 ARG A 116 -13.387 23.481 15.020 1.00 0.00 H new ATOM 1649 N SER A 117 -10.789 16.997 15.241 1.00 0.00 N ATOM 1650 CA SER A 117 -11.399 16.763 16.580 1.00 0.00 C ATOM 1651 C SER A 117 -10.640 15.651 17.311 1.00 0.00 C ATOM 1652 O SER A 117 -10.508 15.669 18.520 1.00 0.00 O ATOM 1653 CB SER A 117 -12.863 16.351 16.405 1.00 0.00 C ATOM 1654 OG SER A 117 -13.543 17.335 15.641 1.00 0.00 O ATOM 0 H SER A 117 -11.340 16.666 14.449 1.00 0.00 H new ATOM 0 HA SER A 117 -11.343 17.680 17.166 1.00 0.00 H new ATOM 0 HB2 SER A 117 -12.923 15.383 15.907 1.00 0.00 H new ATOM 0 HB3 SER A 117 -13.339 16.238 17.379 1.00 0.00 H new ATOM 0 HG SER A 117 -13.330 17.217 14.692 1.00 0.00 H new ATOM 1660 N LEU A 118 -10.145 14.681 16.593 1.00 0.00 N ATOM 1661 CA LEU A 118 -9.403 13.567 17.251 1.00 0.00 C ATOM 1662 C LEU A 118 -8.075 14.084 17.814 1.00 0.00 C ATOM 1663 O LEU A 118 -7.649 13.687 18.881 1.00 0.00 O ATOM 1664 CB LEU A 118 -9.126 12.465 16.227 1.00 0.00 C ATOM 1665 CG LEU A 118 -10.452 11.898 15.715 1.00 0.00 C ATOM 1666 CD1 LEU A 118 -10.195 11.035 14.478 1.00 0.00 C ATOM 1667 CD2 LEU A 118 -11.096 11.043 16.808 1.00 0.00 C ATOM 0 H LEU A 118 -10.222 14.611 15.578 1.00 0.00 H new ATOM 0 HA LEU A 118 -10.007 13.168 18.066 1.00 0.00 H new ATOM 0 HB2 LEU A 118 -8.544 12.864 15.396 1.00 0.00 H new ATOM 0 HB3 LEU A 118 -8.531 11.673 16.682 1.00 0.00 H new ATOM 0 HG LEU A 118 -11.121 12.718 15.453 1.00 0.00 H new ATOM 0 HD11 LEU A 118 -11.140 10.631 14.113 1.00 0.00 H new ATOM 0 HD12 LEU A 118 -9.736 11.643 13.699 1.00 0.00 H new ATOM 0 HD13 LEU A 118 -9.526 10.215 14.739 1.00 0.00 H new ATOM 0 HD21 LEU A 118 -12.041 10.639 16.444 1.00 0.00 H new ATOM 0 HD22 LEU A 118 -10.427 10.223 17.070 1.00 0.00 H new ATOM 0 HD23 LEU A 118 -11.280 11.657 17.690 1.00 0.00 H new ATOM 1679 N ILE A 119 -7.415 14.961 17.108 1.00 0.00 N ATOM 1680 CA ILE A 119 -6.114 15.489 17.611 1.00 0.00 C ATOM 1681 C ILE A 119 -6.317 16.133 18.984 1.00 0.00 C ATOM 1682 O ILE A 119 -5.467 16.056 19.849 1.00 0.00 O ATOM 1683 CB ILE A 119 -5.567 16.534 16.634 1.00 0.00 C ATOM 1684 CG1 ILE A 119 -5.482 15.930 15.231 1.00 0.00 C ATOM 1685 CG2 ILE A 119 -4.170 16.970 17.085 1.00 0.00 C ATOM 1686 CD1 ILE A 119 -5.120 17.025 14.225 1.00 0.00 C ATOM 0 H ILE A 119 -7.718 15.334 16.208 1.00 0.00 H new ATOM 0 HA ILE A 119 -5.403 14.667 17.696 1.00 0.00 H new ATOM 0 HB ILE A 119 -6.232 17.397 16.617 1.00 0.00 H new ATOM 0 HG12 ILE A 119 -4.733 15.139 15.209 1.00 0.00 H new ATOM 0 HG13 ILE A 119 -6.435 15.474 14.961 1.00 0.00 H new ATOM 0 HG21 ILE A 119 -3.779 17.714 16.391 1.00 0.00 H new ATOM 0 HG22 ILE A 119 -4.228 17.402 18.084 1.00 0.00 H new ATOM 0 HG23 ILE A 119 -3.507 16.105 17.102 1.00 0.00 H new ATOM 0 HD11 ILE A 119 -5.059 16.595 13.225 1.00 0.00 H new ATOM 0 HD12 ILE A 119 -5.885 17.801 14.240 1.00 0.00 H new ATOM 0 HD13 ILE A 119 -4.157 17.460 14.492 1.00 0.00 H new ATOM 1698 N GLY A 120 -7.436 16.771 19.192 1.00 0.00 N ATOM 1699 CA GLY A 120 -7.690 17.422 20.509 1.00 0.00 C ATOM 1700 C GLY A 120 -7.913 16.348 21.577 1.00 0.00 C ATOM 1701 O GLY A 120 -7.540 16.512 22.721 1.00 0.00 O ATOM 0 H GLY A 120 -8.185 16.870 18.507 1.00 0.00 H new ATOM 0 HA2 GLY A 120 -6.844 18.053 20.784 1.00 0.00 H new ATOM 0 HA3 GLY A 120 -8.563 18.071 20.443 1.00 0.00 H new ATOM 1705 N MET A 121 -8.519 15.252 21.214 1.00 0.00 N ATOM 1706 CA MET A 121 -8.767 14.172 22.209 1.00 0.00 C ATOM 1707 C MET A 121 -7.431 13.600 22.689 1.00 0.00 C ATOM 1708 O MET A 121 -7.261 13.282 23.849 1.00 0.00 O ATOM 1709 CB MET A 121 -9.594 13.061 21.560 1.00 0.00 C ATOM 1710 CG MET A 121 -9.943 12.003 22.609 1.00 0.00 C ATOM 1711 SD MET A 121 -10.746 10.596 21.803 1.00 0.00 S ATOM 1712 CE MET A 121 -12.188 11.489 21.170 1.00 0.00 C ATOM 0 H MET A 121 -8.854 15.058 20.270 1.00 0.00 H new ATOM 0 HA MET A 121 -9.312 14.582 23.060 1.00 0.00 H new ATOM 0 HB2 MET A 121 -10.506 13.476 21.130 1.00 0.00 H new ATOM 0 HB3 MET A 121 -9.034 12.607 20.743 1.00 0.00 H new ATOM 0 HG2 MET A 121 -9.040 11.674 23.124 1.00 0.00 H new ATOM 0 HG3 MET A 121 -10.604 12.429 23.364 1.00 0.00 H new ATOM 0 HE1 MET A 121 -13.016 10.793 21.033 1.00 0.00 H new ATOM 0 HE2 MET A 121 -12.478 12.262 21.881 1.00 0.00 H new ATOM 0 HE3 MET A 121 -11.940 11.950 20.214 1.00 0.00 H new ATOM 1722 N PHE A 122 -6.482 13.464 21.804 1.00 0.00 N ATOM 1723 CA PHE A 122 -5.158 12.910 22.209 1.00 0.00 C ATOM 1724 C PHE A 122 -4.485 13.863 23.198 1.00 0.00 C ATOM 1725 O PHE A 122 -3.898 13.444 24.177 1.00 0.00 O ATOM 1726 CB PHE A 122 -4.274 12.748 20.973 1.00 0.00 C ATOM 1727 CG PHE A 122 -4.830 11.651 20.098 1.00 0.00 C ATOM 1728 CD1 PHE A 122 -4.694 10.311 20.484 1.00 0.00 C ATOM 1729 CD2 PHE A 122 -5.485 11.971 18.903 1.00 0.00 C ATOM 1730 CE1 PHE A 122 -5.212 9.294 19.675 1.00 0.00 C ATOM 1731 CE2 PHE A 122 -6.004 10.953 18.094 1.00 0.00 C ATOM 1732 CZ PHE A 122 -5.867 9.614 18.479 1.00 0.00 C ATOM 0 H PHE A 122 -6.566 13.712 20.818 1.00 0.00 H new ATOM 0 HA PHE A 122 -5.301 11.939 22.683 1.00 0.00 H new ATOM 0 HB2 PHE A 122 -4.232 13.685 20.417 1.00 0.00 H new ATOM 0 HB3 PHE A 122 -3.253 12.508 21.271 1.00 0.00 H new ATOM 0 HD1 PHE A 122 -4.189 10.063 21.406 1.00 0.00 H new ATOM 0 HD2 PHE A 122 -5.590 13.004 18.605 1.00 0.00 H new ATOM 0 HE1 PHE A 122 -5.107 8.261 19.973 1.00 0.00 H new ATOM 0 HE2 PHE A 122 -6.510 11.201 17.173 1.00 0.00 H new ATOM 0 HZ PHE A 122 -6.266 8.828 17.854 1.00 0.00 H new ATOM 1742 N ALA A 123 -4.563 15.143 22.954 1.00 0.00 N ATOM 1743 CA ALA A 123 -3.925 16.117 23.883 1.00 0.00 C ATOM 1744 C ALA A 123 -4.599 16.026 25.253 1.00 0.00 C ATOM 1745 O ALA A 123 -3.986 16.263 26.275 1.00 0.00 O ATOM 1746 CB ALA A 123 -4.086 17.533 23.328 1.00 0.00 C ATOM 0 H ALA A 123 -5.040 15.555 22.152 1.00 0.00 H new ATOM 0 HA ALA A 123 -2.864 15.886 23.982 1.00 0.00 H new ATOM 0 HB1 ALA A 123 -3.619 18.246 24.008 1.00 0.00 H new ATOM 0 HB2 ALA A 123 -3.608 17.597 22.351 1.00 0.00 H new ATOM 0 HB3 ALA A 123 -5.146 17.767 23.229 1.00 0.00 H new