USER MOD reduce.3.24.130724 H: found=0, std=0, add=944, rem=0, adj=32 USER MOD reduce.3.24.130724 removed 945 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 99 SER OG : rot -160:sc= 0.338 USER MOD Set 1.2: A 122 LYS NZ :NH3+ 162:sc= 0.352 (180deg=0) USER MOD Set 2.1: A 114 ASN : amide:sc= 0.815 K(o=1.2,f=-7.2!) USER MOD Set 2.2: A 116 GLN : amide:sc= 0.4 K(o=1.2,f=-2.3!) USER MOD Set 3.1: A 16 ASN : amide:sc= -0.108 K(o=-0.72,f=-3.3!) USER MOD Set 3.2: A 19 MET CE :methyl 141:sc= -0.596 (180deg=-0.395) USER MOD Set 3.3: A 48 MET CE :methyl 160:sc= -0.0171 (180deg=0) USER MOD Single : A 7 SER OG : rot 31:sc= 0.0319 USER MOD Single : A 11 ASN :FLIP amide:sc= -1.07 F(o=-2.4!,f=-1.1) USER MOD Single : A 13 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 14 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 20 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 24 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 25 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 27 SER OG : rot 180:sc= 0 USER MOD Single : A 29 SER OG : rot 180:sc= 0 USER MOD Single : A 34 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 35 GLN : amide:sc= -0.191 X(o=-0.19,f=-0.23) USER MOD Single : A 37 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 40 MET CE :methyl -173:sc= -0.256 (180deg=-0.297) USER MOD Single : A 42 SER OG : rot 72:sc= 0.109 USER MOD Single : A 46 THR OG1 : rot 75:sc= 0.12 USER MOD Single : A 47 MET CE :methyl 150:sc= -1.35 (180deg=-2.65) USER MOD Single : A 49 SER OG : rot 69:sc= 1.26 USER MOD Single : A 52 SER OG : rot 71:sc= 0.695 USER MOD Single : A 55 SER OG : rot -24:sc= 0.404 USER MOD Single : A 64 THR OG1 : rot 180:sc= 0 USER MOD Single : A 66 GLN : amide:sc= -0.239 X(o=-0.24,f=-0.021) USER MOD Single : A 68 MET CE :methyl -176:sc= -0.0216 (180deg=-0.0718) USER MOD Single : A 69 ASN :FLIP amide:sc= 0.0381 F(o=-0.95,f=0.038) USER MOD Single : A 70 MET CE :methyl 138:sc= -0.0482 (180deg=-0.653) USER MOD Single : A 74 SER OG : rot 71:sc= 0.441 USER MOD Single : A 75 SER OG : rot 140:sc= 0 USER MOD Single : A 76 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 86 ASN : amide:sc= 1.01 K(o=1,f=-0.36) USER MOD Single : A 87 ASN : amide:sc= -0.493 K(o=-0.49,f=-6.2!) USER MOD Single : A 90 SER OG : rot 180:sc= 0 USER MOD Single : A 94 LYS NZ :NH3+ -115:sc= 1.06 (180deg=-0.0713) USER MOD Single : A 95 THR OG1 : rot 65:sc= 1.13 USER MOD Single : A 100 GLN : amide:sc= -0.284 X(o=-0.28,f=-0.47) USER MOD Single : A 103 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 104 GLN : amide:sc= -0.0175 K(o=-0.018,f=-1.6!) USER MOD Single : A 108 SER OG : rot 76:sc= 0.731 USER MOD Single : A 109 THR OG1 : rot -72:sc= 1.62 USER MOD Single : A 110 MET CE :methyl -170:sc= -0.83 (180deg=-1.11) USER MOD Single : A 112 THR OG1 : rot 180:sc= 0 USER MOD Single : A 119 THR OG1 : rot 74:sc= 0.814 USER MOD Single : A 123 HIS : no HD1:sc=-0.00376 X(o=-0.0038,f=-0.28) USER MOD Single : A 125 MET CE :methyl 154:sc= -0.0953 (180deg=-0.711) USER MOD Single : A 126 THR OG1 : rot 76:sc= 0.265 USER MOD Single : A 127 MET CE :methyl 173:sc= -0.608 (180deg=-0.696) USER MOD Single : A 134 GLN : amide:sc= 0 K(o=0,f=-1.5!) USER MOD ----------------------------------------------------------------- ATOM 82 N SER A 7 2.728 2.091 -7.952 1.00 0.00 N ATOM 83 CA SER A 7 3.687 2.060 -6.872 1.00 0.00 C ATOM 84 C SER A 7 5.023 1.665 -7.435 1.00 0.00 C ATOM 85 O SER A 7 5.497 0.553 -7.211 1.00 0.00 O ATOM 86 CB SER A 7 3.328 1.031 -5.783 1.00 0.00 C ATOM 87 OG SER A 7 2.072 1.353 -5.198 1.00 0.00 O ATOM 0 HA SER A 7 3.695 3.051 -6.419 1.00 0.00 H new ATOM 0 HB2 SER A 7 3.290 0.031 -6.215 1.00 0.00 H new ATOM 0 HB3 SER A 7 4.102 1.018 -5.016 1.00 0.00 H new ATOM 0 HG SER A 7 1.503 1.790 -5.865 1.00 0.00 H new ATOM 93 N PRO A 8 5.656 2.567 -8.158 1.00 0.00 N ATOM 94 CA PRO A 8 6.953 2.287 -8.742 1.00 0.00 C ATOM 95 C PRO A 8 8.062 2.297 -7.730 1.00 0.00 C ATOM 96 O PRO A 8 8.731 1.288 -7.527 1.00 0.00 O ATOM 97 CB PRO A 8 7.151 3.387 -9.787 1.00 0.00 C ATOM 98 CG PRO A 8 6.277 4.547 -9.310 1.00 0.00 C ATOM 99 CD PRO A 8 5.167 3.918 -8.463 1.00 0.00 C ATOM 0 HA PRO A 8 6.982 1.286 -9.171 1.00 0.00 H new ATOM 0 HB2 PRO A 8 8.198 3.683 -9.855 1.00 0.00 H new ATOM 0 HB3 PRO A 8 6.851 3.048 -10.779 1.00 0.00 H new ATOM 0 HG2 PRO A 8 6.859 5.259 -8.724 1.00 0.00 H new ATOM 0 HG3 PRO A 8 5.860 5.095 -10.155 1.00 0.00 H new ATOM 0 HD2 PRO A 8 4.990 4.491 -7.553 1.00 0.00 H new ATOM 0 HD3 PRO A 8 4.223 3.885 -9.007 1.00 0.00 H new ATOM 107 N TRP A 9 8.284 3.456 -7.067 1.00 0.00 N ATOM 108 CA TRP A 9 9.332 3.547 -6.079 1.00 0.00 C ATOM 109 C TRP A 9 8.705 3.444 -4.716 1.00 0.00 C ATOM 110 O TRP A 9 9.406 3.322 -3.714 1.00 0.00 O ATOM 111 CB TRP A 9 10.088 4.888 -6.150 1.00 0.00 C ATOM 112 CG TRP A 9 10.020 5.510 -7.521 1.00 0.00 C ATOM 113 CD1 TRP A 9 10.790 5.242 -8.614 1.00 0.00 C ATOM 114 CD2 TRP A 9 9.072 6.514 -7.935 1.00 0.00 C ATOM 115 NE1 TRP A 9 10.389 6.009 -9.672 1.00 0.00 N ATOM 116 CE2 TRP A 9 9.337 6.798 -9.271 1.00 0.00 C ATOM 117 CE3 TRP A 9 8.062 7.162 -7.279 1.00 0.00 C ATOM 118 CZ2 TRP A 9 8.607 7.717 -9.962 1.00 0.00 C ATOM 119 CZ3 TRP A 9 7.321 8.094 -7.974 1.00 0.00 C ATOM 120 CH2 TRP A 9 7.590 8.368 -9.300 1.00 0.00 C ATOM 0 H TRP A 9 7.751 4.314 -7.209 1.00 0.00 H new ATOM 0 HA TRP A 9 10.042 2.743 -6.270 1.00 0.00 H new ATOM 0 HB2 TRP A 9 9.668 5.579 -5.419 1.00 0.00 H new ATOM 0 HB3 TRP A 9 11.131 4.730 -5.876 1.00 0.00 H new ATOM 0 HD1 TRP A 9 11.599 4.527 -8.640 1.00 0.00 H new ATOM 0 HE1 TRP A 9 10.802 5.998 -10.605 1.00 0.00 H new ATOM 0 HE3 TRP A 9 7.850 6.949 -6.242 1.00 0.00 H new ATOM 0 HZ2 TRP A 9 8.820 7.929 -10.999 1.00 0.00 H new ATOM 0 HZ3 TRP A 9 6.519 8.617 -7.474 1.00 0.00 H new ATOM 0 HH2 TRP A 9 6.996 9.102 -9.824 1.00 0.00 H new ATOM 131 N ALA A 10 7.353 3.501 -4.650 1.00 0.00 N ATOM 132 CA ALA A 10 6.669 3.427 -3.377 1.00 0.00 C ATOM 133 C ALA A 10 6.946 2.089 -2.751 1.00 0.00 C ATOM 134 O ALA A 10 7.176 1.995 -1.545 1.00 0.00 O ATOM 135 CB ALA A 10 5.144 3.597 -3.499 1.00 0.00 C ATOM 0 H ALA A 10 6.740 3.597 -5.460 1.00 0.00 H new ATOM 0 HA ALA A 10 7.045 4.248 -2.766 1.00 0.00 H new ATOM 0 HB1 ALA A 10 4.690 3.532 -2.510 1.00 0.00 H new ATOM 0 HB2 ALA A 10 4.920 4.570 -3.937 1.00 0.00 H new ATOM 0 HB3 ALA A 10 4.740 2.810 -4.136 1.00 0.00 H new ATOM 141 N ASN A 11 6.934 1.020 -3.570 1.00 0.00 N ATOM 142 CA ASN A 11 7.199 -0.300 -3.058 1.00 0.00 C ATOM 143 C ASN A 11 8.585 -0.663 -3.516 1.00 0.00 C ATOM 144 O ASN A 11 8.849 -0.771 -4.714 1.00 0.00 O ATOM 145 CB ASN A 11 6.215 -1.369 -3.576 1.00 0.00 C ATOM 146 CG ASN A 11 4.784 -1.084 -3.140 1.00 0.00 C ATOM 147 OD1 ASN A 11 3.799 -1.685 -3.849 1.00 0.00 O flip ATOM 148 ND2 ASN A 11 4.545 -0.353 -2.185 1.00 0.00 N flip ATOM 0 H ASN A 11 6.745 1.062 -4.571 1.00 0.00 H new ATOM 0 HA ASN A 11 7.091 -0.280 -1.974 1.00 0.00 H new ATOM 0 HB2 ASN A 11 6.262 -1.408 -4.664 1.00 0.00 H new ATOM 0 HB3 ASN A 11 6.518 -2.349 -3.208 1.00 0.00 H new ATOM 0 HD21 ASN A 11 5.311 0.084 -1.673 1.00 0.00 H new ATOM 0 HD22 ASN A 11 3.580 -0.182 -1.903 1.00 0.00 H new ATOM 155 N PRO A 12 9.483 -0.876 -2.573 1.00 0.00 N ATOM 156 CA PRO A 12 10.866 -1.202 -2.895 1.00 0.00 C ATOM 157 C PRO A 12 11.033 -2.522 -3.582 1.00 0.00 C ATOM 158 O PRO A 12 12.010 -2.732 -4.288 1.00 0.00 O ATOM 159 CB PRO A 12 11.588 -1.201 -1.543 1.00 0.00 C ATOM 160 CG PRO A 12 10.487 -1.471 -0.526 1.00 0.00 C ATOM 161 CD PRO A 12 9.239 -0.827 -1.125 1.00 0.00 C ATOM 0 HA PRO A 12 11.269 -0.479 -3.604 1.00 0.00 H new ATOM 0 HB2 PRO A 12 12.361 -1.968 -1.505 1.00 0.00 H new ATOM 0 HB3 PRO A 12 12.078 -0.246 -1.355 1.00 0.00 H new ATOM 0 HG2 PRO A 12 10.345 -2.541 -0.371 1.00 0.00 H new ATOM 0 HG3 PRO A 12 10.729 -1.038 0.444 1.00 0.00 H new ATOM 0 HD2 PRO A 12 8.336 -1.373 -0.852 1.00 0.00 H new ATOM 0 HD3 PRO A 12 9.110 0.197 -0.775 1.00 0.00 H new ATOM 169 N LYS A 13 10.084 -3.456 -3.379 1.00 0.00 N ATOM 170 CA LYS A 13 10.185 -4.749 -4.011 1.00 0.00 C ATOM 171 C LYS A 13 10.118 -4.566 -5.507 1.00 0.00 C ATOM 172 O LYS A 13 10.928 -5.121 -6.248 1.00 0.00 O ATOM 173 CB LYS A 13 9.051 -5.707 -3.588 1.00 0.00 C ATOM 174 CG LYS A 13 9.171 -7.097 -4.223 1.00 0.00 C ATOM 175 CD LYS A 13 10.424 -7.843 -3.756 1.00 0.00 C ATOM 176 CE LYS A 13 10.495 -9.269 -4.304 1.00 0.00 C ATOM 177 NZ LYS A 13 11.722 -9.941 -3.825 1.00 0.00 N ATOM 0 H LYS A 13 9.261 -3.327 -2.791 1.00 0.00 H new ATOM 0 HA LYS A 13 11.131 -5.191 -3.699 1.00 0.00 H new ATOM 0 HB2 LYS A 13 9.055 -5.808 -2.503 1.00 0.00 H new ATOM 0 HB3 LYS A 13 8.092 -5.269 -3.864 1.00 0.00 H new ATOM 0 HG2 LYS A 13 8.287 -7.685 -3.975 1.00 0.00 H new ATOM 0 HG3 LYS A 13 9.193 -6.998 -5.308 1.00 0.00 H new ATOM 0 HD2 LYS A 13 11.310 -7.292 -4.071 1.00 0.00 H new ATOM 0 HD3 LYS A 13 10.439 -7.875 -2.667 1.00 0.00 H new ATOM 0 HE2 LYS A 13 9.617 -9.832 -3.988 1.00 0.00 H new ATOM 0 HE3 LYS A 13 10.485 -9.248 -5.394 1.00 0.00 H new ATOM 0 HZ1 LYS A 13 11.758 -10.909 -4.204 1.00 0.00 H new ATOM 0 HZ2 LYS A 13 12.557 -9.411 -4.148 1.00 0.00 H new ATOM 0 HZ3 LYS A 13 11.715 -9.977 -2.786 1.00 0.00 H new ATOM 191 N LYS A 14 9.136 -3.766 -5.985 1.00 0.00 N ATOM 192 CA LYS A 14 8.986 -3.542 -7.404 1.00 0.00 C ATOM 193 C LYS A 14 10.115 -2.676 -7.870 1.00 0.00 C ATOM 194 O LYS A 14 10.658 -2.870 -8.955 1.00 0.00 O ATOM 195 CB LYS A 14 7.682 -2.817 -7.750 1.00 0.00 C ATOM 196 CG LYS A 14 6.456 -3.651 -7.403 1.00 0.00 C ATOM 197 CD LYS A 14 5.167 -2.851 -7.536 1.00 0.00 C ATOM 198 CE LYS A 14 4.059 -3.414 -6.659 1.00 0.00 C ATOM 199 NZ LYS A 14 3.565 -4.699 -7.202 1.00 0.00 N ATOM 0 H LYS A 14 8.455 -3.280 -5.402 1.00 0.00 H new ATOM 0 HA LYS A 14 8.979 -4.518 -7.889 1.00 0.00 H new ATOM 0 HB2 LYS A 14 7.640 -1.870 -7.212 1.00 0.00 H new ATOM 0 HB3 LYS A 14 7.670 -2.580 -8.814 1.00 0.00 H new ATOM 0 HG2 LYS A 14 6.412 -4.521 -8.058 1.00 0.00 H new ATOM 0 HG3 LYS A 14 6.548 -4.024 -6.383 1.00 0.00 H new ATOM 0 HD2 LYS A 14 5.354 -1.812 -7.263 1.00 0.00 H new ATOM 0 HD3 LYS A 14 4.843 -2.854 -8.577 1.00 0.00 H new ATOM 0 HE2 LYS A 14 4.430 -3.561 -5.645 1.00 0.00 H new ATOM 0 HE3 LYS A 14 3.238 -2.700 -6.598 1.00 0.00 H new ATOM 0 HZ1 LYS A 14 2.809 -5.067 -6.590 1.00 0.00 H new ATOM 0 HZ2 LYS A 14 3.192 -4.550 -8.161 1.00 0.00 H new ATOM 0 HZ3 LYS A 14 4.347 -5.384 -7.237 1.00 0.00 H new ATOM 213 N ALA A 15 10.480 -1.682 -7.036 1.00 0.00 N ATOM 214 CA ALA A 15 11.547 -0.769 -7.390 1.00 0.00 C ATOM 215 C ALA A 15 12.829 -1.530 -7.582 1.00 0.00 C ATOM 216 O ALA A 15 13.576 -1.258 -8.519 1.00 0.00 O ATOM 217 CB ALA A 15 11.811 0.298 -6.313 1.00 0.00 C ATOM 0 H ALA A 15 10.049 -1.505 -6.129 1.00 0.00 H new ATOM 0 HA ALA A 15 11.225 -0.272 -8.305 1.00 0.00 H new ATOM 0 HB1 ALA A 15 12.621 0.951 -6.638 1.00 0.00 H new ATOM 0 HB2 ALA A 15 10.909 0.890 -6.158 1.00 0.00 H new ATOM 0 HB3 ALA A 15 12.090 -0.189 -5.379 1.00 0.00 H new ATOM 223 N ASN A 16 13.122 -2.505 -6.694 1.00 0.00 N ATOM 224 CA ASN A 16 14.346 -3.258 -6.815 1.00 0.00 C ATOM 225 C ASN A 16 14.328 -4.040 -8.099 1.00 0.00 C ATOM 226 O ASN A 16 15.329 -4.096 -8.801 1.00 0.00 O ATOM 227 CB ASN A 16 14.572 -4.249 -5.656 1.00 0.00 C ATOM 228 CG ASN A 16 14.933 -3.542 -4.357 1.00 0.00 C ATOM 229 OD1 ASN A 16 15.371 -2.395 -4.360 1.00 0.00 O ATOM 230 ND2 ASN A 16 14.754 -4.243 -3.210 1.00 0.00 N ATOM 0 H ASN A 16 12.528 -2.770 -5.908 1.00 0.00 H new ATOM 0 HA ASN A 16 15.157 -2.530 -6.794 1.00 0.00 H new ATOM 0 HB2 ASN A 16 13.670 -4.842 -5.506 1.00 0.00 H new ATOM 0 HB3 ASN A 16 15.369 -4.943 -5.924 1.00 0.00 H new ATOM 0 HD21 ASN A 16 14.986 -3.819 -2.312 1.00 0.00 H new ATOM 0 HD22 ASN A 16 14.388 -5.194 -3.246 1.00 0.00 H new ATOM 237 N ALA A 17 13.178 -4.655 -8.447 1.00 0.00 N ATOM 238 CA ALA A 17 13.107 -5.434 -9.665 1.00 0.00 C ATOM 239 C ALA A 17 13.311 -4.525 -10.850 1.00 0.00 C ATOM 240 O ALA A 17 14.022 -4.869 -11.795 1.00 0.00 O ATOM 241 CB ALA A 17 11.753 -6.147 -9.839 1.00 0.00 C ATOM 0 H ALA A 17 12.314 -4.620 -7.906 1.00 0.00 H new ATOM 0 HA ALA A 17 13.886 -6.194 -9.600 1.00 0.00 H new ATOM 0 HB1 ALA A 17 11.758 -6.715 -10.769 1.00 0.00 H new ATOM 0 HB2 ALA A 17 11.588 -6.824 -9.001 1.00 0.00 H new ATOM 0 HB3 ALA A 17 10.953 -5.407 -9.870 1.00 0.00 H new ATOM 247 N PHE A 18 12.673 -3.336 -10.820 1.00 0.00 N ATOM 248 CA PHE A 18 12.791 -2.391 -11.908 1.00 0.00 C ATOM 249 C PHE A 18 14.225 -1.951 -12.063 1.00 0.00 C ATOM 250 O PHE A 18 14.778 -1.984 -13.163 1.00 0.00 O ATOM 251 CB PHE A 18 11.912 -1.141 -11.687 1.00 0.00 C ATOM 252 CG PHE A 18 12.166 -0.032 -12.658 1.00 0.00 C ATOM 253 CD1 PHE A 18 11.941 -0.220 -13.999 1.00 0.00 C ATOM 254 CD2 PHE A 18 12.621 1.195 -12.218 1.00 0.00 C ATOM 255 CE1 PHE A 18 12.170 0.797 -14.894 1.00 0.00 C ATOM 256 CE2 PHE A 18 12.850 2.212 -13.111 1.00 0.00 C ATOM 257 CZ PHE A 18 12.624 2.014 -14.449 1.00 0.00 C ATOM 0 H PHE A 18 12.079 -3.025 -10.052 1.00 0.00 H new ATOM 0 HA PHE A 18 12.450 -2.900 -12.809 1.00 0.00 H new ATOM 0 HB2 PHE A 18 10.864 -1.432 -11.752 1.00 0.00 H new ATOM 0 HB3 PHE A 18 12.078 -0.769 -10.676 1.00 0.00 H new ATOM 0 HD1 PHE A 18 11.581 -1.175 -14.353 1.00 0.00 H new ATOM 0 HD2 PHE A 18 12.798 1.356 -11.165 1.00 0.00 H new ATOM 0 HE1 PHE A 18 11.993 0.639 -15.948 1.00 0.00 H new ATOM 0 HE2 PHE A 18 13.208 3.168 -12.760 1.00 0.00 H new ATOM 0 HZ PHE A 18 12.803 2.814 -15.152 1.00 0.00 H new ATOM 267 N MET A 19 14.856 -1.528 -10.952 1.00 0.00 N ATOM 268 CA MET A 19 16.220 -1.053 -11.010 1.00 0.00 C ATOM 269 C MET A 19 17.143 -2.166 -11.425 1.00 0.00 C ATOM 270 O MET A 19 18.018 -1.959 -12.253 1.00 0.00 O ATOM 271 CB MET A 19 16.718 -0.485 -9.668 1.00 0.00 C ATOM 272 CG MET A 19 16.055 0.854 -9.320 1.00 0.00 C ATOM 273 SD MET A 19 16.750 1.632 -7.830 1.00 0.00 S ATOM 274 CE MET A 19 15.827 0.602 -6.653 1.00 0.00 C ATOM 0 H MET A 19 14.436 -1.511 -10.022 1.00 0.00 H new ATOM 0 HA MET A 19 16.228 -0.246 -11.743 1.00 0.00 H new ATOM 0 HB2 MET A 19 16.517 -1.205 -8.874 1.00 0.00 H new ATOM 0 HB3 MET A 19 17.799 -0.352 -9.711 1.00 0.00 H new ATOM 0 HG2 MET A 19 16.165 1.536 -10.163 1.00 0.00 H new ATOM 0 HG3 MET A 19 14.986 0.696 -9.175 1.00 0.00 H new ATOM 0 HE1 MET A 19 16.469 0.350 -5.809 1.00 0.00 H new ATOM 0 HE2 MET A 19 14.955 1.150 -6.296 1.00 0.00 H new ATOM 0 HE3 MET A 19 15.502 -0.314 -7.147 1.00 0.00 H new ATOM 284 N LYS A 20 16.947 -3.388 -10.887 1.00 0.00 N ATOM 285 CA LYS A 20 17.820 -4.495 -11.229 1.00 0.00 C ATOM 286 C LYS A 20 17.711 -4.778 -12.697 1.00 0.00 C ATOM 287 O LYS A 20 18.698 -5.107 -13.345 1.00 0.00 O ATOM 288 CB LYS A 20 17.479 -5.795 -10.479 1.00 0.00 C ATOM 289 CG LYS A 20 17.862 -5.741 -9.000 1.00 0.00 C ATOM 290 CD LYS A 20 19.376 -5.795 -8.766 1.00 0.00 C ATOM 291 CE LYS A 20 19.976 -7.165 -9.087 1.00 0.00 C ATOM 292 NZ LYS A 20 21.411 -7.195 -8.731 1.00 0.00 N ATOM 0 H LYS A 20 16.203 -3.616 -10.228 1.00 0.00 H new ATOM 0 HA LYS A 20 18.826 -4.191 -10.941 1.00 0.00 H new ATOM 0 HB2 LYS A 20 16.410 -5.990 -10.566 1.00 0.00 H new ATOM 0 HB3 LYS A 20 17.995 -6.629 -10.954 1.00 0.00 H new ATOM 0 HG2 LYS A 20 17.466 -4.825 -8.562 1.00 0.00 H new ATOM 0 HG3 LYS A 20 17.390 -6.574 -8.479 1.00 0.00 H new ATOM 0 HD2 LYS A 20 19.862 -5.037 -9.381 1.00 0.00 H new ATOM 0 HD3 LYS A 20 19.588 -5.545 -7.726 1.00 0.00 H new ATOM 0 HE2 LYS A 20 19.442 -7.941 -8.538 1.00 0.00 H new ATOM 0 HE3 LYS A 20 19.853 -7.383 -10.148 1.00 0.00 H new ATOM 0 HZ1 LYS A 20 21.805 -8.131 -8.955 1.00 0.00 H new ATOM 0 HZ2 LYS A 20 21.919 -6.467 -9.274 1.00 0.00 H new ATOM 0 HZ3 LYS A 20 21.520 -7.007 -7.714 1.00 0.00 H new ATOM 306 N CYS A 21 16.493 -4.668 -13.251 1.00 0.00 N ATOM 307 CA CYS A 21 16.291 -4.940 -14.659 1.00 0.00 C ATOM 308 C CYS A 21 17.140 -4.001 -15.491 1.00 0.00 C ATOM 309 O CYS A 21 17.860 -4.442 -16.385 1.00 0.00 O ATOM 310 CB CYS A 21 14.816 -4.761 -15.084 1.00 0.00 C ATOM 311 SG CYS A 21 14.549 -5.135 -16.846 1.00 0.00 S ATOM 0 H CYS A 21 15.652 -4.396 -12.743 1.00 0.00 H new ATOM 0 HA CYS A 21 16.577 -5.979 -14.825 1.00 0.00 H new ATOM 0 HB2 CYS A 21 14.185 -5.411 -14.478 1.00 0.00 H new ATOM 0 HB3 CYS A 21 14.505 -3.736 -14.882 1.00 0.00 H new ATOM 316 N LEU A 22 17.079 -2.680 -15.210 1.00 0.00 N ATOM 317 CA LEU A 22 17.846 -1.723 -15.988 1.00 0.00 C ATOM 318 C LEU A 22 19.317 -1.886 -15.707 1.00 0.00 C ATOM 319 O LEU A 22 20.145 -1.799 -16.614 1.00 0.00 O ATOM 320 CB LEU A 22 17.479 -0.261 -15.673 1.00 0.00 C ATOM 321 CG LEU A 22 16.076 0.126 -16.165 1.00 0.00 C ATOM 322 CD1 LEU A 22 15.665 1.503 -15.625 1.00 0.00 C ATOM 323 CD2 LEU A 22 15.985 0.080 -17.700 1.00 0.00 C ATOM 0 H LEU A 22 16.515 -2.273 -14.464 1.00 0.00 H new ATOM 0 HA LEU A 22 17.609 -1.928 -17.032 1.00 0.00 H new ATOM 0 HB2 LEU A 22 17.537 -0.102 -14.596 1.00 0.00 H new ATOM 0 HB3 LEU A 22 18.214 0.399 -16.133 1.00 0.00 H new ATOM 0 HG LEU A 22 15.374 -0.611 -15.775 1.00 0.00 H new ATOM 0 HD11 LEU A 22 14.668 1.753 -15.988 1.00 0.00 H new ATOM 0 HD12 LEU A 22 15.659 1.480 -14.535 1.00 0.00 H new ATOM 0 HD13 LEU A 22 16.375 2.255 -15.968 1.00 0.00 H new ATOM 0 HD21 LEU A 22 14.979 0.359 -18.013 1.00 0.00 H new ATOM 0 HD22 LEU A 22 16.705 0.777 -18.128 1.00 0.00 H new ATOM 0 HD23 LEU A 22 16.206 -0.929 -18.048 1.00 0.00 H new ATOM 335 N ILE A 23 19.670 -2.122 -14.429 1.00 0.00 N ATOM 336 CA ILE A 23 21.055 -2.261 -14.039 1.00 0.00 C ATOM 337 C ILE A 23 21.674 -3.441 -14.734 1.00 0.00 C ATOM 338 O ILE A 23 22.792 -3.352 -15.243 1.00 0.00 O ATOM 339 CB ILE A 23 21.191 -2.440 -12.554 1.00 0.00 C ATOM 340 CG1 ILE A 23 20.822 -1.127 -11.848 1.00 0.00 C ATOM 341 CG2 ILE A 23 22.630 -2.881 -12.235 1.00 0.00 C ATOM 342 CD1 ILE A 23 20.602 -1.307 -10.349 1.00 0.00 C ATOM 0 H ILE A 23 19.004 -2.218 -13.662 1.00 0.00 H new ATOM 0 HA ILE A 23 21.571 -1.346 -14.329 1.00 0.00 H new ATOM 0 HB ILE A 23 20.512 -3.212 -12.193 1.00 0.00 H new ATOM 0 HG12 ILE A 23 21.615 -0.397 -12.010 1.00 0.00 H new ATOM 0 HG13 ILE A 23 19.917 -0.719 -12.298 1.00 0.00 H new ATOM 0 HG21 ILE A 23 22.740 -3.014 -11.159 1.00 0.00 H new ATOM 0 HG22 ILE A 23 22.842 -3.823 -12.740 1.00 0.00 H new ATOM 0 HG23 ILE A 23 23.329 -2.119 -12.580 1.00 0.00 H new ATOM 0 HD11 ILE A 23 20.344 -0.347 -9.901 1.00 0.00 H new ATOM 0 HD12 ILE A 23 19.790 -2.015 -10.183 1.00 0.00 H new ATOM 0 HD13 ILE A 23 21.515 -1.688 -9.890 1.00 0.00 H new ATOM 354 N GLN A 24 20.965 -4.584 -14.772 1.00 0.00 N ATOM 355 CA GLN A 24 21.508 -5.762 -15.411 1.00 0.00 C ATOM 356 C GLN A 24 21.682 -5.498 -16.881 1.00 0.00 C ATOM 357 O GLN A 24 22.651 -5.955 -17.475 1.00 0.00 O ATOM 358 CB GLN A 24 20.633 -7.020 -15.244 1.00 0.00 C ATOM 359 CG GLN A 24 20.644 -7.558 -13.806 1.00 0.00 C ATOM 360 CD GLN A 24 19.686 -8.739 -13.724 1.00 0.00 C ATOM 361 OE1 GLN A 24 20.024 -9.854 -14.105 1.00 0.00 O ATOM 362 NE2 GLN A 24 18.454 -8.490 -13.219 1.00 0.00 N ATOM 0 H GLN A 24 20.034 -4.701 -14.372 1.00 0.00 H new ATOM 0 HA GLN A 24 22.460 -5.962 -14.919 1.00 0.00 H new ATOM 0 HB2 GLN A 24 19.608 -6.787 -15.533 1.00 0.00 H new ATOM 0 HB3 GLN A 24 20.987 -7.797 -15.922 1.00 0.00 H new ATOM 0 HG2 GLN A 24 21.651 -7.867 -13.525 1.00 0.00 H new ATOM 0 HG3 GLN A 24 20.343 -6.777 -13.107 1.00 0.00 H new ATOM 0 HE21 GLN A 24 18.209 -7.549 -12.912 1.00 0.00 H new ATOM 0 HE22 GLN A 24 17.771 -9.244 -13.146 1.00 0.00 H new ATOM 371 N LYS A 25 20.743 -4.758 -17.511 1.00 0.00 N ATOM 372 CA LYS A 25 20.865 -4.472 -18.927 1.00 0.00 C ATOM 373 C LYS A 25 22.152 -3.730 -19.153 1.00 0.00 C ATOM 374 O LYS A 25 22.897 -4.029 -20.085 1.00 0.00 O ATOM 375 CB LYS A 25 19.711 -3.607 -19.474 1.00 0.00 C ATOM 376 CG LYS A 25 19.893 -3.219 -20.949 1.00 0.00 C ATOM 377 CD LYS A 25 19.901 -4.428 -21.887 1.00 0.00 C ATOM 378 CE LYS A 25 19.956 -4.025 -23.361 1.00 0.00 C ATOM 379 NZ LYS A 25 19.960 -5.228 -24.221 1.00 0.00 N ATOM 0 H LYS A 25 19.917 -4.364 -17.060 1.00 0.00 H new ATOM 0 HA LYS A 25 20.838 -5.427 -19.452 1.00 0.00 H new ATOM 0 HB2 LYS A 25 18.773 -4.150 -19.361 1.00 0.00 H new ATOM 0 HB3 LYS A 25 19.629 -2.701 -18.874 1.00 0.00 H new ATOM 0 HG2 LYS A 25 19.090 -2.543 -21.243 1.00 0.00 H new ATOM 0 HG3 LYS A 25 20.829 -2.671 -21.062 1.00 0.00 H new ATOM 0 HD2 LYS A 25 20.759 -5.059 -21.654 1.00 0.00 H new ATOM 0 HD3 LYS A 25 19.007 -5.027 -21.710 1.00 0.00 H new ATOM 0 HE2 LYS A 25 19.099 -3.397 -23.606 1.00 0.00 H new ATOM 0 HE3 LYS A 25 20.850 -3.431 -23.550 1.00 0.00 H new ATOM 0 HZ1 LYS A 25 19.998 -4.941 -25.220 1.00 0.00 H new ATOM 0 HZ2 LYS A 25 20.791 -5.812 -23.997 1.00 0.00 H new ATOM 0 HZ3 LYS A 25 19.094 -5.779 -24.052 1.00 0.00 H new ATOM 393 N ILE A 26 22.432 -2.734 -18.297 1.00 0.00 N ATOM 394 CA ILE A 26 23.645 -1.962 -18.422 1.00 0.00 C ATOM 395 C ILE A 26 24.821 -2.872 -18.178 1.00 0.00 C ATOM 396 O ILE A 26 25.804 -2.833 -18.906 1.00 0.00 O ATOM 397 CB ILE A 26 23.713 -0.825 -17.433 1.00 0.00 C ATOM 398 CG1 ILE A 26 22.628 0.215 -17.759 1.00 0.00 C ATOM 399 CG2 ILE A 26 25.130 -0.214 -17.484 1.00 0.00 C ATOM 400 CD1 ILE A 26 22.472 1.266 -16.659 1.00 0.00 C ATOM 0 H ILE A 26 21.830 -2.458 -17.521 1.00 0.00 H new ATOM 0 HA ILE A 26 23.662 -1.535 -19.425 1.00 0.00 H new ATOM 0 HB ILE A 26 23.525 -1.183 -16.421 1.00 0.00 H new ATOM 0 HG12 ILE A 26 22.875 0.711 -18.698 1.00 0.00 H new ATOM 0 HG13 ILE A 26 21.676 -0.294 -17.908 1.00 0.00 H new ATOM 0 HG21 ILE A 26 25.196 0.610 -16.774 1.00 0.00 H new ATOM 0 HG22 ILE A 26 25.865 -0.976 -17.225 1.00 0.00 H new ATOM 0 HG23 ILE A 26 25.331 0.156 -18.489 1.00 0.00 H new ATOM 0 HD11 ILE A 26 21.693 1.975 -16.941 1.00 0.00 H new ATOM 0 HD12 ILE A 26 22.197 0.777 -15.725 1.00 0.00 H new ATOM 0 HD13 ILE A 26 23.415 1.797 -16.526 1.00 0.00 H new ATOM 412 N SER A 27 24.720 -3.740 -17.148 1.00 0.00 N ATOM 413 CA SER A 27 25.812 -4.629 -16.797 1.00 0.00 C ATOM 414 C SER A 27 26.139 -5.553 -17.942 1.00 0.00 C ATOM 415 O SER A 27 27.309 -5.814 -18.210 1.00 0.00 O ATOM 416 CB SER A 27 25.501 -5.498 -15.561 1.00 0.00 C ATOM 417 OG SER A 27 26.607 -6.337 -15.244 1.00 0.00 O ATOM 0 H SER A 27 23.893 -3.832 -16.558 1.00 0.00 H new ATOM 0 HA SER A 27 26.658 -3.982 -16.567 1.00 0.00 H new ATOM 0 HB2 SER A 27 25.268 -4.858 -14.710 1.00 0.00 H new ATOM 0 HB3 SER A 27 24.618 -6.108 -15.752 1.00 0.00 H new ATOM 0 HG SER A 27 26.391 -6.879 -14.457 1.00 0.00 H new ATOM 423 N VAL A 28 25.115 -6.089 -18.633 1.00 0.00 N ATOM 424 CA VAL A 28 25.378 -7.006 -19.721 1.00 0.00 C ATOM 425 C VAL A 28 25.522 -6.219 -21.005 1.00 0.00 C ATOM 426 O VAL A 28 25.458 -6.782 -22.098 1.00 0.00 O ATOM 427 CB VAL A 28 24.284 -8.041 -19.904 1.00 0.00 C ATOM 428 CG1 VAL A 28 24.797 -9.154 -20.841 1.00 0.00 C ATOM 429 CG2 VAL A 28 23.891 -8.597 -18.521 1.00 0.00 C ATOM 0 H VAL A 28 24.129 -5.900 -18.453 1.00 0.00 H new ATOM 0 HA VAL A 28 26.295 -7.541 -19.474 1.00 0.00 H new ATOM 0 HB VAL A 28 23.398 -7.598 -20.359 1.00 0.00 H new ATOM 0 HG11 VAL A 28 24.017 -9.903 -20.978 1.00 0.00 H new ATOM 0 HG12 VAL A 28 25.061 -8.724 -21.807 1.00 0.00 H new ATOM 0 HG13 VAL A 28 25.677 -9.623 -20.401 1.00 0.00 H new ATOM 0 HG21 VAL A 28 23.105 -9.343 -18.639 1.00 0.00 H new ATOM 0 HG22 VAL A 28 24.761 -9.058 -18.053 1.00 0.00 H new ATOM 0 HG23 VAL A 28 23.529 -7.784 -17.892 1.00 0.00 H new ATOM 439 N SER A 29 25.732 -4.886 -20.916 1.00 0.00 N ATOM 440 CA SER A 29 25.892 -4.107 -22.118 1.00 0.00 C ATOM 441 C SER A 29 27.367 -4.096 -22.435 1.00 0.00 C ATOM 442 O SER A 29 28.185 -3.715 -21.610 1.00 0.00 O ATOM 443 CB SER A 29 25.427 -2.644 -21.969 1.00 0.00 C ATOM 444 OG SER A 29 25.573 -1.948 -23.205 1.00 0.00 O ATOM 0 H SER A 29 25.790 -4.360 -20.044 1.00 0.00 H new ATOM 0 HA SER A 29 25.279 -4.557 -22.899 1.00 0.00 H new ATOM 0 HB2 SER A 29 24.385 -2.618 -21.650 1.00 0.00 H new ATOM 0 HB3 SER A 29 26.010 -2.147 -21.194 1.00 0.00 H new ATOM 0 HG SER A 29 25.273 -1.022 -23.096 1.00 0.00 H new ATOM 450 N PRO A 30 27.731 -4.543 -23.615 1.00 0.00 N ATOM 451 CA PRO A 30 29.127 -4.552 -24.019 1.00 0.00 C ATOM 452 C PRO A 30 29.613 -3.193 -24.433 1.00 0.00 C ATOM 453 O PRO A 30 30.807 -2.982 -24.632 1.00 0.00 O ATOM 454 CB PRO A 30 29.158 -5.523 -25.199 1.00 0.00 C ATOM 455 CG PRO A 30 27.774 -5.378 -25.827 1.00 0.00 C ATOM 456 CD PRO A 30 26.838 -5.073 -24.654 1.00 0.00 C ATOM 0 HA PRO A 30 29.783 -4.846 -23.200 1.00 0.00 H new ATOM 0 HB2 PRO A 30 29.947 -5.268 -25.906 1.00 0.00 H new ATOM 0 HB3 PRO A 30 29.343 -6.546 -24.871 1.00 0.00 H new ATOM 0 HG2 PRO A 30 27.757 -4.576 -26.565 1.00 0.00 H new ATOM 0 HG3 PRO A 30 27.477 -6.291 -26.342 1.00 0.00 H new ATOM 0 HD2 PRO A 30 26.074 -4.347 -24.932 1.00 0.00 H new ATOM 0 HD3 PRO A 30 26.318 -5.969 -24.315 1.00 0.00 H new ATOM 464 N VAL A 31 28.668 -2.241 -24.583 1.00 0.00 N ATOM 465 CA VAL A 31 29.007 -0.903 -25.004 1.00 0.00 C ATOM 466 C VAL A 31 29.749 -0.191 -23.899 1.00 0.00 C ATOM 467 O VAL A 31 30.736 0.500 -24.153 1.00 0.00 O ATOM 468 CB VAL A 31 27.787 -0.087 -25.354 1.00 0.00 C ATOM 469 CG1 VAL A 31 28.226 1.354 -25.681 1.00 0.00 C ATOM 470 CG2 VAL A 31 27.067 -0.766 -26.534 1.00 0.00 C ATOM 0 H VAL A 31 27.673 -2.392 -24.415 1.00 0.00 H new ATOM 0 HA VAL A 31 29.628 -0.999 -25.895 1.00 0.00 H new ATOM 0 HB VAL A 31 27.087 -0.035 -24.520 1.00 0.00 H new ATOM 0 HG11 VAL A 31 27.351 1.952 -25.935 1.00 0.00 H new ATOM 0 HG12 VAL A 31 28.723 1.789 -24.814 1.00 0.00 H new ATOM 0 HG13 VAL A 31 28.915 1.342 -26.526 1.00 0.00 H new ATOM 0 HG21 VAL A 31 26.182 -0.189 -26.801 1.00 0.00 H new ATOM 0 HG22 VAL A 31 27.739 -0.816 -27.391 1.00 0.00 H new ATOM 0 HG23 VAL A 31 26.770 -1.775 -26.247 1.00 0.00 H new ATOM 480 N PHE A 32 29.289 -0.345 -22.638 1.00 0.00 N ATOM 481 CA PHE A 32 29.934 0.347 -21.541 1.00 0.00 C ATOM 482 C PHE A 32 31.084 -0.509 -21.055 1.00 0.00 C ATOM 483 O PHE A 32 31.069 -1.735 -21.173 1.00 0.00 O ATOM 484 CB PHE A 32 28.952 0.652 -20.368 1.00 0.00 C ATOM 485 CG PHE A 32 28.960 -0.323 -19.232 1.00 0.00 C ATOM 486 CD1 PHE A 32 29.370 0.062 -17.974 1.00 0.00 C ATOM 487 CD2 PHE A 32 28.555 -1.617 -19.431 1.00 0.00 C ATOM 488 CE1 PHE A 32 29.372 -0.841 -16.935 1.00 0.00 C ATOM 489 CE2 PHE A 32 28.558 -2.519 -18.398 1.00 0.00 C ATOM 490 CZ PHE A 32 28.966 -2.133 -17.151 1.00 0.00 C ATOM 0 H PHE A 32 28.495 -0.929 -22.376 1.00 0.00 H new ATOM 0 HA PHE A 32 30.293 1.312 -21.900 1.00 0.00 H new ATOM 0 HB2 PHE A 32 29.186 1.641 -19.973 1.00 0.00 H new ATOM 0 HB3 PHE A 32 27.940 0.701 -20.771 1.00 0.00 H new ATOM 0 HD1 PHE A 32 29.692 1.079 -17.802 1.00 0.00 H new ATOM 0 HD2 PHE A 32 28.230 -1.930 -20.412 1.00 0.00 H new ATOM 0 HE1 PHE A 32 29.693 -0.532 -15.951 1.00 0.00 H new ATOM 0 HE2 PHE A 32 28.238 -3.536 -18.570 1.00 0.00 H new ATOM 0 HZ PHE A 32 28.968 -2.844 -16.338 1.00 0.00 H new ATOM 500 N PRO A 33 32.099 0.138 -20.518 1.00 0.00 N ATOM 501 CA PRO A 33 33.276 -0.553 -20.009 1.00 0.00 C ATOM 502 C PRO A 33 33.043 -1.231 -18.690 1.00 0.00 C ATOM 503 O PRO A 33 32.292 -0.744 -17.848 1.00 0.00 O ATOM 504 CB PRO A 33 34.321 0.554 -19.876 1.00 0.00 C ATOM 505 CG PRO A 33 33.494 1.802 -19.587 1.00 0.00 C ATOM 506 CD PRO A 33 32.190 1.597 -20.360 1.00 0.00 C ATOM 0 HA PRO A 33 33.578 -1.361 -20.675 1.00 0.00 H new ATOM 0 HB2 PRO A 33 35.025 0.345 -19.070 1.00 0.00 H new ATOM 0 HB3 PRO A 33 34.906 0.664 -20.789 1.00 0.00 H new ATOM 0 HG2 PRO A 33 33.307 1.914 -18.519 1.00 0.00 H new ATOM 0 HG3 PRO A 33 34.011 2.704 -19.916 1.00 0.00 H new ATOM 0 HD2 PRO A 33 31.335 1.994 -19.813 1.00 0.00 H new ATOM 0 HD3 PRO A 33 32.214 2.103 -21.325 1.00 0.00 H new ATOM 514 N GLN A 34 33.734 -2.372 -18.469 1.00 0.00 N ATOM 515 CA GLN A 34 33.577 -3.117 -17.238 1.00 0.00 C ATOM 516 C GLN A 34 34.234 -2.367 -16.107 1.00 0.00 C ATOM 517 O GLN A 34 33.994 -2.662 -14.940 1.00 0.00 O ATOM 518 CB GLN A 34 34.197 -4.528 -17.308 1.00 0.00 C ATOM 519 CG GLN A 34 35.732 -4.509 -17.403 1.00 0.00 C ATOM 520 CD GLN A 34 36.217 -5.932 -17.649 1.00 0.00 C ATOM 521 OE1 GLN A 34 36.028 -6.485 -18.727 1.00 0.00 O ATOM 522 NE2 GLN A 34 36.861 -6.544 -16.625 1.00 0.00 N ATOM 0 H GLN A 34 34.395 -2.779 -19.131 1.00 0.00 H new ATOM 0 HA GLN A 34 32.505 -3.228 -17.073 1.00 0.00 H new ATOM 0 HB2 GLN A 34 33.901 -5.093 -16.424 1.00 0.00 H new ATOM 0 HB3 GLN A 34 33.792 -5.054 -18.173 1.00 0.00 H new ATOM 0 HG2 GLN A 34 36.054 -3.854 -18.212 1.00 0.00 H new ATOM 0 HG3 GLN A 34 36.164 -4.115 -16.483 1.00 0.00 H new ATOM 0 HE21 GLN A 34 36.999 -6.052 -15.743 1.00 0.00 H new ATOM 0 HE22 GLN A 34 37.207 -7.497 -16.737 1.00 0.00 H new ATOM 531 N GLN A 35 35.092 -1.377 -16.430 1.00 0.00 N ATOM 532 CA GLN A 35 35.770 -0.614 -15.406 1.00 0.00 C ATOM 533 C GLN A 35 34.751 0.160 -14.606 1.00 0.00 C ATOM 534 O GLN A 35 34.868 0.288 -13.389 1.00 0.00 O ATOM 535 CB GLN A 35 36.789 0.389 -15.986 1.00 0.00 C ATOM 536 CG GLN A 35 37.645 1.071 -14.907 1.00 0.00 C ATOM 537 CD GLN A 35 38.459 0.006 -14.181 1.00 0.00 C ATOM 538 OE1 GLN A 35 39.206 -0.747 -14.797 1.00 0.00 O ATOM 539 NE2 GLN A 35 38.312 -0.062 -12.834 1.00 0.00 N ATOM 0 H GLN A 35 35.318 -1.103 -17.386 1.00 0.00 H new ATOM 0 HA GLN A 35 36.313 -1.326 -14.785 1.00 0.00 H new ATOM 0 HB2 GLN A 35 37.443 -0.131 -16.686 1.00 0.00 H new ATOM 0 HB3 GLN A 35 36.256 1.151 -16.554 1.00 0.00 H new ATOM 0 HG2 GLN A 35 38.307 1.808 -15.361 1.00 0.00 H new ATOM 0 HG3 GLN A 35 37.008 1.605 -14.202 1.00 0.00 H new ATOM 0 HE21 GLN A 35 37.681 0.582 -12.357 1.00 0.00 H new ATOM 0 HE22 GLN A 35 38.833 -0.757 -12.299 1.00 0.00 H new ATOM 548 N GLU A 36 33.710 0.687 -15.288 1.00 0.00 N ATOM 549 CA GLU A 36 32.703 1.477 -14.614 1.00 0.00 C ATOM 550 C GLU A 36 31.719 0.570 -13.922 1.00 0.00 C ATOM 551 O GLU A 36 30.845 1.044 -13.202 1.00 0.00 O ATOM 552 CB GLU A 36 31.914 2.391 -15.575 1.00 0.00 C ATOM 553 CG GLU A 36 32.772 3.522 -16.170 1.00 0.00 C ATOM 554 CD GLU A 36 33.310 4.387 -15.038 1.00 0.00 C ATOM 555 OE1 GLU A 36 32.497 4.791 -14.161 1.00 0.00 O ATOM 556 OE2 GLU A 36 34.539 4.659 -15.036 1.00 0.00 O ATOM 0 H GLU A 36 33.562 0.572 -16.291 1.00 0.00 H new ATOM 0 HA GLU A 36 33.234 2.107 -13.900 1.00 0.00 H new ATOM 0 HB2 GLU A 36 31.504 1.789 -16.386 1.00 0.00 H new ATOM 0 HB3 GLU A 36 31.069 2.826 -15.042 1.00 0.00 H new ATOM 0 HG2 GLU A 36 33.596 3.104 -16.748 1.00 0.00 H new ATOM 0 HG3 GLU A 36 32.176 4.126 -16.854 1.00 0.00 H new ATOM 563 N LYS A 37 31.825 -0.761 -14.128 1.00 0.00 N ATOM 564 CA LYS A 37 30.901 -1.686 -13.503 1.00 0.00 C ATOM 565 C LYS A 37 31.022 -1.575 -12.002 1.00 0.00 C ATOM 566 O LYS A 37 30.019 -1.588 -11.291 1.00 0.00 O ATOM 567 CB LYS A 37 31.159 -3.155 -13.895 1.00 0.00 C ATOM 568 CG LYS A 37 30.160 -4.130 -13.262 1.00 0.00 C ATOM 569 CD LYS A 37 30.411 -5.579 -13.687 1.00 0.00 C ATOM 570 CE LYS A 37 29.425 -6.555 -13.046 1.00 0.00 C ATOM 571 NZ LYS A 37 29.701 -7.937 -13.499 1.00 0.00 N ATOM 0 H LYS A 37 32.535 -1.198 -14.716 1.00 0.00 H new ATOM 0 HA LYS A 37 29.904 -1.415 -13.851 1.00 0.00 H new ATOM 0 HB2 LYS A 37 31.112 -3.249 -14.980 1.00 0.00 H new ATOM 0 HB3 LYS A 37 32.169 -3.433 -13.595 1.00 0.00 H new ATOM 0 HG2 LYS A 37 30.223 -4.056 -12.176 1.00 0.00 H new ATOM 0 HG3 LYS A 37 29.147 -3.842 -13.543 1.00 0.00 H new ATOM 0 HD2 LYS A 37 30.338 -5.654 -14.772 1.00 0.00 H new ATOM 0 HD3 LYS A 37 31.428 -5.863 -13.415 1.00 0.00 H new ATOM 0 HE2 LYS A 37 29.502 -6.499 -11.960 1.00 0.00 H new ATOM 0 HE3 LYS A 37 28.404 -6.276 -13.308 1.00 0.00 H new ATOM 0 HZ1 LYS A 37 29.023 -8.590 -13.056 1.00 0.00 H new ATOM 0 HZ2 LYS A 37 29.605 -7.989 -14.533 1.00 0.00 H new ATOM 0 HZ3 LYS A 37 30.668 -8.205 -13.227 1.00 0.00 H new ATOM 585 N GLU A 38 32.266 -1.463 -11.484 1.00 0.00 N ATOM 586 CA GLU A 38 32.464 -1.370 -10.052 1.00 0.00 C ATOM 587 C GLU A 38 31.837 -0.096 -9.542 1.00 0.00 C ATOM 588 O GLU A 38 31.217 -0.082 -8.478 1.00 0.00 O ATOM 589 CB GLU A 38 33.952 -1.362 -9.653 1.00 0.00 C ATOM 590 CG GLU A 38 34.629 -2.725 -9.875 1.00 0.00 C ATOM 591 CD GLU A 38 36.125 -2.592 -9.608 1.00 0.00 C ATOM 592 OE1 GLU A 38 36.615 -1.436 -9.503 1.00 0.00 O ATOM 593 OE2 GLU A 38 36.799 -3.651 -9.506 1.00 0.00 O ATOM 0 H GLU A 38 33.122 -1.437 -12.038 1.00 0.00 H new ATOM 0 HA GLU A 38 31.999 -2.252 -9.612 1.00 0.00 H new ATOM 0 HB2 GLU A 38 34.476 -0.601 -10.232 1.00 0.00 H new ATOM 0 HB3 GLU A 38 34.042 -1.082 -8.603 1.00 0.00 H new ATOM 0 HG2 GLU A 38 34.194 -3.473 -9.212 1.00 0.00 H new ATOM 0 HG3 GLU A 38 34.459 -3.067 -10.896 1.00 0.00 H new ATOM 600 N ASP A 39 31.995 1.015 -10.297 1.00 0.00 N ATOM 601 CA ASP A 39 31.428 2.278 -9.879 1.00 0.00 C ATOM 602 C ASP A 39 29.925 2.176 -9.914 1.00 0.00 C ATOM 603 O ASP A 39 29.239 2.690 -9.037 1.00 0.00 O ATOM 604 CB ASP A 39 31.847 3.454 -10.784 1.00 0.00 C ATOM 605 CG ASP A 39 33.324 3.790 -10.639 1.00 0.00 C ATOM 606 OD1 ASP A 39 34.136 3.221 -11.415 1.00 0.00 O ATOM 607 OD2 ASP A 39 33.655 4.618 -9.751 1.00 0.00 O ATOM 0 H ASP A 39 32.504 1.045 -11.180 1.00 0.00 H new ATOM 0 HA ASP A 39 31.801 2.477 -8.874 1.00 0.00 H new ATOM 0 HB2 ASP A 39 31.633 3.205 -11.823 1.00 0.00 H new ATOM 0 HB3 ASP A 39 31.250 4.332 -10.537 1.00 0.00 H new ATOM 612 N MET A 40 29.390 1.492 -10.948 1.00 0.00 N ATOM 613 CA MET A 40 27.961 1.345 -11.099 1.00 0.00 C ATOM 614 C MET A 40 27.401 0.607 -9.910 1.00 0.00 C ATOM 615 O MET A 40 26.378 1.004 -9.353 1.00 0.00 O ATOM 616 CB MET A 40 27.585 0.574 -12.386 1.00 0.00 C ATOM 617 CG MET A 40 26.073 0.406 -12.578 1.00 0.00 C ATOM 618 SD MET A 40 25.418 -1.120 -11.835 1.00 0.00 S ATOM 619 CE MET A 40 25.916 -2.214 -13.201 1.00 0.00 C ATOM 0 H MET A 40 29.940 1.041 -11.679 1.00 0.00 H new ATOM 0 HA MET A 40 27.537 2.347 -11.168 1.00 0.00 H new ATOM 0 HB2 MET A 40 27.997 1.099 -13.248 1.00 0.00 H new ATOM 0 HB3 MET A 40 28.052 -0.411 -12.360 1.00 0.00 H new ATOM 0 HG2 MET A 40 25.561 1.263 -12.141 1.00 0.00 H new ATOM 0 HG3 MET A 40 25.847 0.409 -13.644 1.00 0.00 H new ATOM 0 HE1 MET A 40 25.509 -3.211 -13.035 1.00 0.00 H new ATOM 0 HE2 MET A 40 25.535 -1.818 -14.142 1.00 0.00 H new ATOM 0 HE3 MET A 40 27.004 -2.269 -13.245 1.00 0.00 H new ATOM 629 N GLU A 41 28.070 -0.485 -9.484 1.00 0.00 N ATOM 630 CA GLU A 41 27.585 -1.261 -8.362 1.00 0.00 C ATOM 631 C GLU A 41 27.587 -0.412 -7.119 1.00 0.00 C ATOM 632 O GLU A 41 26.669 -0.492 -6.303 1.00 0.00 O ATOM 633 CB GLU A 41 28.437 -2.514 -8.081 1.00 0.00 C ATOM 634 CG GLU A 41 28.268 -3.595 -9.161 1.00 0.00 C ATOM 635 CD GLU A 41 29.283 -4.707 -8.919 1.00 0.00 C ATOM 636 OE1 GLU A 41 30.283 -4.457 -8.193 1.00 0.00 O ATOM 637 OE2 GLU A 41 29.069 -5.825 -9.456 1.00 0.00 O ATOM 0 H GLU A 41 28.933 -0.832 -9.903 1.00 0.00 H new ATOM 0 HA GLU A 41 26.579 -1.586 -8.626 1.00 0.00 H new ATOM 0 HB2 GLU A 41 29.487 -2.229 -8.018 1.00 0.00 H new ATOM 0 HB3 GLU A 41 28.160 -2.928 -7.111 1.00 0.00 H new ATOM 0 HG2 GLU A 41 27.256 -3.998 -9.134 1.00 0.00 H new ATOM 0 HG3 GLU A 41 28.413 -3.163 -10.151 1.00 0.00 H new ATOM 644 N SER A 42 28.634 0.421 -6.943 1.00 0.00 N ATOM 645 CA SER A 42 28.726 1.258 -5.763 1.00 0.00 C ATOM 646 C SER A 42 27.587 2.246 -5.755 1.00 0.00 C ATOM 647 O SER A 42 26.975 2.487 -4.717 1.00 0.00 O ATOM 648 CB SER A 42 30.039 2.059 -5.695 1.00 0.00 C ATOM 649 OG SER A 42 31.147 1.176 -5.560 1.00 0.00 O ATOM 0 H SER A 42 29.408 0.521 -7.600 1.00 0.00 H new ATOM 0 HA SER A 42 28.688 0.587 -4.905 1.00 0.00 H new ATOM 0 HB2 SER A 42 30.153 2.662 -6.596 1.00 0.00 H new ATOM 0 HB3 SER A 42 30.009 2.749 -4.852 1.00 0.00 H new ATOM 0 HG SER A 42 31.293 0.703 -6.406 1.00 0.00 H new ATOM 655 N ILE A 43 27.277 2.840 -6.930 1.00 0.00 N ATOM 656 CA ILE A 43 26.211 3.814 -7.021 1.00 0.00 C ATOM 657 C ILE A 43 24.900 3.166 -6.661 1.00 0.00 C ATOM 658 O ILE A 43 24.119 3.714 -5.887 1.00 0.00 O ATOM 659 CB ILE A 43 26.084 4.397 -8.409 1.00 0.00 C ATOM 660 CG1 ILE A 43 27.305 5.280 -8.725 1.00 0.00 C ATOM 661 CG2 ILE A 43 24.760 5.185 -8.507 1.00 0.00 C ATOM 662 CD1 ILE A 43 27.375 5.682 -10.198 1.00 0.00 C ATOM 0 H ILE A 43 27.756 2.652 -7.811 1.00 0.00 H new ATOM 0 HA ILE A 43 26.455 4.620 -6.329 1.00 0.00 H new ATOM 0 HB ILE A 43 26.062 3.599 -9.152 1.00 0.00 H new ATOM 0 HG12 ILE A 43 27.268 6.178 -8.109 1.00 0.00 H new ATOM 0 HG13 ILE A 43 28.215 4.745 -8.455 1.00 0.00 H new ATOM 0 HG21 ILE A 43 24.662 5.609 -9.506 1.00 0.00 H new ATOM 0 HG22 ILE A 43 23.923 4.515 -8.313 1.00 0.00 H new ATOM 0 HG23 ILE A 43 24.760 5.989 -7.771 1.00 0.00 H new ATOM 0 HD11 ILE A 43 28.255 6.303 -10.364 1.00 0.00 H new ATOM 0 HD12 ILE A 43 27.441 4.787 -10.817 1.00 0.00 H new ATOM 0 HD13 ILE A 43 26.479 6.243 -10.465 1.00 0.00 H new ATOM 674 N VAL A 44 24.643 1.960 -7.207 1.00 0.00 N ATOM 675 CA VAL A 44 23.389 1.278 -6.958 1.00 0.00 C ATOM 676 C VAL A 44 23.234 0.986 -5.487 1.00 0.00 C ATOM 677 O VAL A 44 22.166 1.213 -4.917 1.00 0.00 O ATOM 678 CB VAL A 44 23.286 -0.025 -7.707 1.00 0.00 C ATOM 679 CG1 VAL A 44 22.042 -0.794 -7.214 1.00 0.00 C ATOM 680 CG2 VAL A 44 23.223 0.295 -9.210 1.00 0.00 C ATOM 0 H VAL A 44 25.289 1.456 -7.814 1.00 0.00 H new ATOM 0 HA VAL A 44 22.601 1.946 -7.306 1.00 0.00 H new ATOM 0 HB VAL A 44 24.151 -0.664 -7.529 1.00 0.00 H new ATOM 0 HG11 VAL A 44 21.961 -1.738 -7.752 1.00 0.00 H new ATOM 0 HG12 VAL A 44 22.136 -0.992 -6.146 1.00 0.00 H new ATOM 0 HG13 VAL A 44 21.149 -0.196 -7.395 1.00 0.00 H new ATOM 0 HG21 VAL A 44 23.148 -0.633 -9.777 1.00 0.00 H new ATOM 0 HG22 VAL A 44 22.351 0.916 -9.414 1.00 0.00 H new ATOM 0 HG23 VAL A 44 24.126 0.829 -9.506 1.00 0.00 H new ATOM 690 N GLU A 45 24.300 0.484 -4.830 1.00 0.00 N ATOM 691 CA GLU A 45 24.200 0.140 -3.429 1.00 0.00 C ATOM 692 C GLU A 45 23.906 1.365 -2.605 1.00 0.00 C ATOM 693 O GLU A 45 23.106 1.311 -1.674 1.00 0.00 O ATOM 694 CB GLU A 45 25.486 -0.508 -2.877 1.00 0.00 C ATOM 695 CG GLU A 45 25.712 -1.925 -3.429 1.00 0.00 C ATOM 696 CD GLU A 45 27.068 -2.438 -2.956 1.00 0.00 C ATOM 697 OE1 GLU A 45 27.860 -1.622 -2.410 1.00 0.00 O ATOM 698 OE2 GLU A 45 27.328 -3.657 -3.133 1.00 0.00 O ATOM 0 H GLU A 45 25.214 0.317 -5.251 1.00 0.00 H new ATOM 0 HA GLU A 45 23.389 -0.584 -3.356 1.00 0.00 H new ATOM 0 HB2 GLU A 45 26.342 0.118 -3.129 1.00 0.00 H new ATOM 0 HB3 GLU A 45 25.431 -0.549 -1.789 1.00 0.00 H new ATOM 0 HG2 GLU A 45 24.919 -2.591 -3.089 1.00 0.00 H new ATOM 0 HG3 GLU A 45 25.674 -1.914 -4.518 1.00 0.00 H new ATOM 705 N THR A 46 24.550 2.503 -2.924 1.00 0.00 N ATOM 706 CA THR A 46 24.330 3.710 -2.152 1.00 0.00 C ATOM 707 C THR A 46 22.939 4.229 -2.392 1.00 0.00 C ATOM 708 O THR A 46 22.263 4.652 -1.452 1.00 0.00 O ATOM 709 CB THR A 46 25.305 4.814 -2.480 1.00 0.00 C ATOM 710 OG1 THR A 46 26.632 4.382 -2.212 1.00 0.00 O ATOM 711 CG2 THR A 46 24.981 6.052 -1.624 1.00 0.00 C ATOM 0 H THR A 46 25.210 2.599 -3.696 1.00 0.00 H new ATOM 0 HA THR A 46 24.476 3.430 -1.109 1.00 0.00 H new ATOM 0 HB THR A 46 25.220 5.068 -3.537 1.00 0.00 H new ATOM 0 HG1 THR A 46 26.921 3.760 -2.912 1.00 0.00 H new ATOM 0 HG21 THR A 46 25.684 6.851 -1.859 1.00 0.00 H new ATOM 0 HG22 THR A 46 23.966 6.387 -1.838 1.00 0.00 H new ATOM 0 HG23 THR A 46 25.063 5.796 -0.568 1.00 0.00 H new ATOM 719 N MET A 47 22.467 4.214 -3.657 1.00 0.00 N ATOM 720 CA MET A 47 21.145 4.726 -3.948 1.00 0.00 C ATOM 721 C MET A 47 20.119 3.887 -3.234 1.00 0.00 C ATOM 722 O MET A 47 19.157 4.414 -2.675 1.00 0.00 O ATOM 723 CB MET A 47 20.809 4.715 -5.452 1.00 0.00 C ATOM 724 CG MET A 47 21.634 5.737 -6.247 1.00 0.00 C ATOM 725 SD MET A 47 21.281 7.462 -5.791 1.00 0.00 S ATOM 726 CE MET A 47 19.689 7.543 -6.657 1.00 0.00 C ATOM 0 H MET A 47 22.980 3.859 -4.464 1.00 0.00 H new ATOM 0 HA MET A 47 21.129 5.762 -3.609 1.00 0.00 H new ATOM 0 HB2 MET A 47 20.988 3.718 -5.854 1.00 0.00 H new ATOM 0 HB3 MET A 47 19.748 4.927 -5.585 1.00 0.00 H new ATOM 0 HG2 MET A 47 22.694 5.537 -6.091 1.00 0.00 H new ATOM 0 HG3 MET A 47 21.438 5.603 -7.311 1.00 0.00 H new ATOM 0 HE1 MET A 47 19.030 8.242 -6.142 1.00 0.00 H new ATOM 0 HE2 MET A 47 19.848 7.882 -7.681 1.00 0.00 H new ATOM 0 HE3 MET A 47 19.231 6.554 -6.669 1.00 0.00 H new ATOM 736 N MET A 48 20.302 2.549 -3.232 1.00 0.00 N ATOM 737 CA MET A 48 19.358 1.680 -2.569 1.00 0.00 C ATOM 738 C MET A 48 19.453 1.874 -1.085 1.00 0.00 C ATOM 739 O MET A 48 18.451 1.783 -0.380 1.00 0.00 O ATOM 740 CB MET A 48 19.566 0.191 -2.883 1.00 0.00 C ATOM 741 CG MET A 48 19.157 -0.136 -4.314 1.00 0.00 C ATOM 742 SD MET A 48 19.325 -1.894 -4.735 1.00 0.00 S ATOM 743 CE MET A 48 18.326 -1.779 -6.250 1.00 0.00 C ATOM 0 H MET A 48 21.085 2.072 -3.678 1.00 0.00 H new ATOM 0 HA MET A 48 18.373 1.955 -2.946 1.00 0.00 H new ATOM 0 HB2 MET A 48 20.613 -0.072 -2.733 1.00 0.00 H new ATOM 0 HB3 MET A 48 18.983 -0.414 -2.189 1.00 0.00 H new ATOM 0 HG2 MET A 48 18.121 0.168 -4.465 1.00 0.00 H new ATOM 0 HG3 MET A 48 19.765 0.453 -5.000 1.00 0.00 H new ATOM 0 HE1 MET A 48 18.549 -2.627 -6.898 1.00 0.00 H new ATOM 0 HE2 MET A 48 17.268 -1.789 -5.990 1.00 0.00 H new ATOM 0 HE3 MET A 48 18.562 -0.852 -6.772 1.00 0.00 H new ATOM 753 N SER A 49 20.672 2.128 -0.569 1.00 0.00 N ATOM 754 CA SER A 49 20.836 2.316 0.859 1.00 0.00 C ATOM 755 C SER A 49 20.057 3.529 1.290 1.00 0.00 C ATOM 756 O SER A 49 19.413 3.523 2.338 1.00 0.00 O ATOM 757 CB SER A 49 22.302 2.524 1.286 1.00 0.00 C ATOM 758 OG SER A 49 23.054 1.341 1.047 1.00 0.00 O ATOM 0 H SER A 49 21.529 2.204 -1.116 1.00 0.00 H new ATOM 0 HA SER A 49 20.476 1.403 1.333 1.00 0.00 H new ATOM 0 HB2 SER A 49 22.735 3.357 0.733 1.00 0.00 H new ATOM 0 HB3 SER A 49 22.347 2.785 2.343 1.00 0.00 H new ATOM 0 HG SER A 49 23.150 1.204 0.081 1.00 0.00 H new ATOM 764 N ALA A 50 20.108 4.609 0.483 1.00 0.00 N ATOM 765 CA ALA A 50 19.398 5.825 0.820 1.00 0.00 C ATOM 766 C ALA A 50 17.909 5.563 0.805 1.00 0.00 C ATOM 767 O ALA A 50 17.181 6.033 1.680 1.00 0.00 O ATOM 768 CB ALA A 50 19.694 6.973 -0.156 1.00 0.00 C ATOM 0 H ALA A 50 20.631 4.649 -0.392 1.00 0.00 H new ATOM 0 HA ALA A 50 19.738 6.125 1.811 1.00 0.00 H new ATOM 0 HB1 ALA A 50 19.135 7.859 0.145 1.00 0.00 H new ATOM 0 HB2 ALA A 50 20.761 7.195 -0.144 1.00 0.00 H new ATOM 0 HB3 ALA A 50 19.396 6.681 -1.163 1.00 0.00 H new ATOM 774 N ILE A 51 17.424 4.806 -0.207 1.00 0.00 N ATOM 775 CA ILE A 51 16.007 4.508 -0.307 1.00 0.00 C ATOM 776 C ILE A 51 15.599 3.669 0.871 1.00 0.00 C ATOM 777 O ILE A 51 14.534 3.871 1.456 1.00 0.00 O ATOM 778 CB ILE A 51 15.645 3.772 -1.575 1.00 0.00 C ATOM 779 CG1 ILE A 51 15.812 4.708 -2.784 1.00 0.00 C ATOM 780 CG2 ILE A 51 14.199 3.248 -1.455 1.00 0.00 C ATOM 781 CD1 ILE A 51 15.732 3.974 -4.121 1.00 0.00 C ATOM 0 H ILE A 51 17.997 4.403 -0.948 1.00 0.00 H new ATOM 0 HA ILE A 51 15.479 5.462 -0.322 1.00 0.00 H new ATOM 0 HB ILE A 51 16.309 2.920 -1.723 1.00 0.00 H new ATOM 0 HG12 ILE A 51 15.040 5.477 -2.751 1.00 0.00 H new ATOM 0 HG13 ILE A 51 16.773 5.218 -2.712 1.00 0.00 H new ATOM 0 HG21 ILE A 51 13.928 2.715 -2.366 1.00 0.00 H new ATOM 0 HG22 ILE A 51 14.127 2.571 -0.604 1.00 0.00 H new ATOM 0 HG23 ILE A 51 13.519 4.087 -1.310 1.00 0.00 H new ATOM 0 HD11 ILE A 51 15.857 4.687 -4.936 1.00 0.00 H new ATOM 0 HD12 ILE A 51 16.521 3.223 -4.172 1.00 0.00 H new ATOM 0 HD13 ILE A 51 14.761 3.487 -4.211 1.00 0.00 H new ATOM 793 N SER A 52 16.457 2.701 1.245 1.00 0.00 N ATOM 794 CA SER A 52 16.160 1.819 2.351 1.00 0.00 C ATOM 795 C SER A 52 16.008 2.632 3.607 1.00 0.00 C ATOM 796 O SER A 52 15.158 2.332 4.437 1.00 0.00 O ATOM 797 CB SER A 52 17.261 0.772 2.602 1.00 0.00 C ATOM 798 OG SER A 52 17.355 -0.115 1.493 1.00 0.00 O ATOM 0 H SER A 52 17.352 2.523 0.790 1.00 0.00 H new ATOM 0 HA SER A 52 15.242 1.292 2.090 1.00 0.00 H new ATOM 0 HB2 SER A 52 18.217 1.270 2.761 1.00 0.00 H new ATOM 0 HB3 SER A 52 17.039 0.210 3.509 1.00 0.00 H new ATOM 0 HG SER A 52 17.736 0.360 0.725 1.00 0.00 H new ATOM 804 N GLY A 53 16.857 3.671 3.783 1.00 0.00 N ATOM 805 CA GLY A 53 16.786 4.500 4.969 1.00 0.00 C ATOM 806 C GLY A 53 15.460 5.218 5.024 1.00 0.00 C ATOM 807 O GLY A 53 14.871 5.353 6.094 1.00 0.00 O ATOM 0 H GLY A 53 17.583 3.938 3.119 1.00 0.00 H new ATOM 0 HA2 GLY A 53 16.912 3.885 5.860 1.00 0.00 H new ATOM 0 HA3 GLY A 53 17.600 5.225 4.964 1.00 0.00 H new ATOM 811 N VAL A 54 14.975 5.728 3.867 1.00 0.00 N ATOM 812 CA VAL A 54 13.713 6.445 3.844 1.00 0.00 C ATOM 813 C VAL A 54 12.595 5.484 4.157 1.00 0.00 C ATOM 814 O VAL A 54 11.683 5.801 4.923 1.00 0.00 O ATOM 815 CB VAL A 54 13.425 7.095 2.506 1.00 0.00 C ATOM 816 CG1 VAL A 54 11.987 7.663 2.507 1.00 0.00 C ATOM 817 CG2 VAL A 54 14.474 8.195 2.265 1.00 0.00 C ATOM 0 H VAL A 54 15.440 5.650 2.963 1.00 0.00 H new ATOM 0 HA VAL A 54 13.784 7.238 4.588 1.00 0.00 H new ATOM 0 HB VAL A 54 13.490 6.368 1.697 1.00 0.00 H new ATOM 0 HG11 VAL A 54 11.780 8.131 1.544 1.00 0.00 H new ATOM 0 HG12 VAL A 54 11.276 6.854 2.678 1.00 0.00 H new ATOM 0 HG13 VAL A 54 11.889 8.405 3.299 1.00 0.00 H new ATOM 0 HG21 VAL A 54 14.283 8.675 1.305 1.00 0.00 H new ATOM 0 HG22 VAL A 54 14.412 8.937 3.061 1.00 0.00 H new ATOM 0 HG23 VAL A 54 15.470 7.753 2.258 1.00 0.00 H new ATOM 827 N SER A 55 12.643 4.277 3.560 1.00 0.00 N ATOM 828 CA SER A 55 11.606 3.294 3.785 1.00 0.00 C ATOM 829 C SER A 55 11.780 2.696 5.157 1.00 0.00 C ATOM 830 O SER A 55 12.833 2.812 5.775 1.00 0.00 O ATOM 831 CB SER A 55 11.628 2.146 2.751 1.00 0.00 C ATOM 832 OG SER A 55 12.786 1.333 2.920 1.00 0.00 O ATOM 0 H SER A 55 13.386 3.977 2.929 1.00 0.00 H new ATOM 0 HA SER A 55 10.652 3.813 3.688 1.00 0.00 H new ATOM 0 HB2 SER A 55 10.731 1.536 2.860 1.00 0.00 H new ATOM 0 HB3 SER A 55 11.612 2.559 1.742 1.00 0.00 H new ATOM 0 HG SER A 55 13.492 1.856 3.355 1.00 0.00 H new ATOM 916 N GLU A 62 7.405 10.336 0.618 1.00 0.00 N ATOM 917 CA GLU A 62 7.434 9.998 -0.783 1.00 0.00 C ATOM 918 C GLU A 62 8.298 11.009 -1.486 1.00 0.00 C ATOM 919 O GLU A 62 8.686 10.817 -2.635 1.00 0.00 O ATOM 920 CB GLU A 62 6.040 10.017 -1.439 1.00 0.00 C ATOM 921 CG GLU A 62 5.128 8.894 -0.919 1.00 0.00 C ATOM 922 CD GLU A 62 3.747 9.036 -1.551 1.00 0.00 C ATOM 923 OE1 GLU A 62 3.497 10.081 -2.209 1.00 0.00 O ATOM 924 OE2 GLU A 62 2.926 8.097 -1.383 1.00 0.00 O ATOM 0 HA GLU A 62 7.821 8.983 -0.870 1.00 0.00 H new ATOM 0 HB2 GLU A 62 5.567 10.981 -1.251 1.00 0.00 H new ATOM 0 HB3 GLU A 62 6.149 9.921 -2.519 1.00 0.00 H new ATOM 0 HG2 GLU A 62 5.554 7.921 -1.163 1.00 0.00 H new ATOM 0 HG3 GLU A 62 5.051 8.945 0.167 1.00 0.00 H new ATOM 931 N ALA A 63 8.606 12.130 -0.795 1.00 0.00 N ATOM 932 CA ALA A 63 9.401 13.185 -1.381 1.00 0.00 C ATOM 933 C ALA A 63 10.747 12.652 -1.771 1.00 0.00 C ATOM 934 O ALA A 63 11.258 12.950 -2.850 1.00 0.00 O ATOM 935 CB ALA A 63 9.648 14.332 -0.391 1.00 0.00 C ATOM 0 H ALA A 63 8.308 12.309 0.164 1.00 0.00 H new ATOM 0 HA ALA A 63 8.846 13.554 -2.243 1.00 0.00 H new ATOM 0 HB1 ALA A 63 10.249 15.104 -0.871 1.00 0.00 H new ATOM 0 HB2 ALA A 63 8.693 14.756 -0.080 1.00 0.00 H new ATOM 0 HB3 ALA A 63 10.177 13.951 0.483 1.00 0.00 H new ATOM 941 N THR A 64 11.355 11.845 -0.887 1.00 0.00 N ATOM 942 CA THR A 64 12.662 11.303 -1.164 1.00 0.00 C ATOM 943 C THR A 64 12.551 10.319 -2.288 1.00 0.00 C ATOM 944 O THR A 64 13.409 10.264 -3.157 1.00 0.00 O ATOM 945 CB THR A 64 13.278 10.599 0.009 1.00 0.00 C ATOM 946 OG1 THR A 64 13.386 11.494 1.109 1.00 0.00 O ATOM 947 CG2 THR A 64 14.676 10.097 -0.393 1.00 0.00 C ATOM 0 H THR A 64 10.956 11.566 0.009 1.00 0.00 H new ATOM 0 HA THR A 64 13.304 12.147 -1.416 1.00 0.00 H new ATOM 0 HB THR A 64 12.652 9.757 0.303 1.00 0.00 H new ATOM 0 HG1 THR A 64 13.787 11.028 1.872 1.00 0.00 H new ATOM 0 HG21 THR A 64 15.135 9.583 0.452 1.00 0.00 H new ATOM 0 HG22 THR A 64 14.588 9.408 -1.233 1.00 0.00 H new ATOM 0 HG23 THR A 64 15.297 10.944 -0.683 1.00 0.00 H new ATOM 955 N LEU A 65 11.474 9.511 -2.293 1.00 0.00 N ATOM 956 CA LEU A 65 11.300 8.509 -3.321 1.00 0.00 C ATOM 957 C LEU A 65 11.191 9.186 -4.662 1.00 0.00 C ATOM 958 O LEU A 65 11.743 8.710 -5.654 1.00 0.00 O ATOM 959 CB LEU A 65 10.039 7.652 -3.109 1.00 0.00 C ATOM 960 CG LEU A 65 10.153 6.722 -1.888 1.00 0.00 C ATOM 961 CD1 LEU A 65 8.805 6.058 -1.562 1.00 0.00 C ATOM 962 CD2 LEU A 65 11.257 5.669 -2.086 1.00 0.00 C ATOM 0 H LEU A 65 10.728 9.544 -1.598 1.00 0.00 H new ATOM 0 HA LEU A 65 12.167 7.850 -3.274 1.00 0.00 H new ATOM 0 HB2 LEU A 65 9.177 8.306 -2.983 1.00 0.00 H new ATOM 0 HB3 LEU A 65 9.857 7.053 -4.001 1.00 0.00 H new ATOM 0 HG LEU A 65 10.434 7.338 -1.034 1.00 0.00 H new ATOM 0 HD11 LEU A 65 8.920 5.408 -0.695 1.00 0.00 H new ATOM 0 HD12 LEU A 65 8.064 6.827 -1.343 1.00 0.00 H new ATOM 0 HD13 LEU A 65 8.474 5.468 -2.417 1.00 0.00 H new ATOM 0 HD21 LEU A 65 11.311 5.029 -1.206 1.00 0.00 H new ATOM 0 HD22 LEU A 65 11.028 5.063 -2.962 1.00 0.00 H new ATOM 0 HD23 LEU A 65 12.215 6.169 -2.230 1.00 0.00 H new ATOM 974 N GLN A 66 10.465 10.321 -4.719 1.00 0.00 N ATOM 975 CA GLN A 66 10.317 11.043 -5.964 1.00 0.00 C ATOM 976 C GLN A 66 11.663 11.587 -6.364 1.00 0.00 C ATOM 977 O GLN A 66 12.037 11.562 -7.540 1.00 0.00 O ATOM 978 CB GLN A 66 9.327 12.222 -5.861 1.00 0.00 C ATOM 979 CG GLN A 66 9.083 12.920 -7.208 1.00 0.00 C ATOM 980 CD GLN A 66 8.462 11.921 -8.176 1.00 0.00 C ATOM 981 OE1 GLN A 66 7.402 11.360 -7.913 1.00 0.00 O ATOM 982 NE2 GLN A 66 9.142 11.685 -9.324 1.00 0.00 N ATOM 0 H GLN A 66 9.985 10.739 -3.922 1.00 0.00 H new ATOM 0 HA GLN A 66 9.922 10.345 -6.702 1.00 0.00 H new ATOM 0 HB2 GLN A 66 8.377 11.859 -5.469 1.00 0.00 H new ATOM 0 HB3 GLN A 66 9.710 12.949 -5.145 1.00 0.00 H new ATOM 0 HG2 GLN A 66 8.422 13.776 -7.075 1.00 0.00 H new ATOM 0 HG3 GLN A 66 10.021 13.301 -7.610 1.00 0.00 H new ATOM 0 HE21 GLN A 66 10.020 12.171 -9.506 1.00 0.00 H new ATOM 0 HE22 GLN A 66 8.776 11.021 -10.006 1.00 0.00 H new ATOM 991 N ALA A 67 12.423 12.101 -5.372 1.00 0.00 N ATOM 992 CA ALA A 67 13.728 12.655 -5.639 1.00 0.00 C ATOM 993 C ALA A 67 14.628 11.571 -6.169 1.00 0.00 C ATOM 994 O ALA A 67 15.434 11.814 -7.059 1.00 0.00 O ATOM 995 CB ALA A 67 14.391 13.257 -4.387 1.00 0.00 C ATOM 0 H ALA A 67 12.140 12.134 -4.393 1.00 0.00 H new ATOM 0 HA ALA A 67 13.589 13.456 -6.365 1.00 0.00 H new ATOM 0 HB1 ALA A 67 15.370 13.658 -4.651 1.00 0.00 H new ATOM 0 HB2 ALA A 67 13.765 14.058 -3.993 1.00 0.00 H new ATOM 0 HB3 ALA A 67 14.508 12.482 -3.629 1.00 0.00 H new ATOM 1001 N MET A 68 14.516 10.342 -5.615 1.00 0.00 N ATOM 1002 CA MET A 68 15.352 9.248 -6.049 1.00 0.00 C ATOM 1003 C MET A 68 15.070 8.917 -7.491 1.00 0.00 C ATOM 1004 O MET A 68 15.985 8.576 -8.227 1.00 0.00 O ATOM 1005 CB MET A 68 15.171 7.981 -5.196 1.00 0.00 C ATOM 1006 CG MET A 68 15.749 8.160 -3.790 1.00 0.00 C ATOM 1007 SD MET A 68 17.562 8.267 -3.777 1.00 0.00 S ATOM 1008 CE MET A 68 17.668 8.867 -2.068 1.00 0.00 C ATOM 0 H MET A 68 13.855 10.105 -4.875 1.00 0.00 H new ATOM 0 HA MET A 68 16.383 9.581 -5.930 1.00 0.00 H new ATOM 0 HB2 MET A 68 14.111 7.738 -5.126 1.00 0.00 H new ATOM 0 HB3 MET A 68 15.660 7.139 -5.686 1.00 0.00 H new ATOM 0 HG2 MET A 68 15.334 9.064 -3.345 1.00 0.00 H new ATOM 0 HG3 MET A 68 15.435 7.324 -3.165 1.00 0.00 H new ATOM 0 HE1 MET A 68 18.707 9.087 -1.823 1.00 0.00 H new ATOM 0 HE2 MET A 68 17.071 9.773 -1.963 1.00 0.00 H new ATOM 0 HE3 MET A 68 17.290 8.102 -1.390 1.00 0.00 H new ATOM 1018 N ASN A 69 13.793 8.986 -7.935 1.00 0.00 N ATOM 1019 CA ASN A 69 13.486 8.689 -9.321 1.00 0.00 C ATOM 1020 C ASN A 69 14.252 9.653 -10.202 1.00 0.00 C ATOM 1021 O ASN A 69 14.879 9.251 -11.189 1.00 0.00 O ATOM 1022 CB ASN A 69 11.981 8.813 -9.640 1.00 0.00 C ATOM 1023 CG ASN A 69 11.670 8.583 -11.116 1.00 0.00 C ATOM 1024 OD1 ASN A 69 12.124 7.430 -11.669 1.00 0.00 O flip ATOM 1025 ND2 ASN A 69 11.051 9.419 -11.768 1.00 0.00 N flip ATOM 0 H ASN A 69 12.991 9.239 -7.358 1.00 0.00 H new ATOM 0 HA ASN A 69 13.775 7.655 -9.508 1.00 0.00 H new ATOM 0 HB2 ASN A 69 11.426 8.092 -9.040 1.00 0.00 H new ATOM 0 HB3 ASN A 69 11.633 9.804 -9.350 1.00 0.00 H new ATOM 0 HD21 ASN A 69 10.724 10.275 -11.320 1.00 0.00 H new ATOM 0 HD22 ASN A 69 10.864 9.257 -12.758 1.00 0.00 H new ATOM 1032 N MET A 70 14.224 10.956 -9.848 1.00 0.00 N ATOM 1033 CA MET A 70 14.931 11.948 -10.626 1.00 0.00 C ATOM 1034 C MET A 70 16.409 11.695 -10.488 1.00 0.00 C ATOM 1035 O MET A 70 17.176 11.873 -11.435 1.00 0.00 O ATOM 1036 CB MET A 70 14.646 13.390 -10.161 1.00 0.00 C ATOM 1037 CG MET A 70 13.210 13.830 -10.460 1.00 0.00 C ATOM 1038 SD MET A 70 12.808 15.463 -9.769 1.00 0.00 S ATOM 1039 CE MET A 70 13.856 16.395 -10.924 1.00 0.00 C ATOM 0 H MET A 70 13.723 11.323 -9.039 1.00 0.00 H new ATOM 0 HA MET A 70 14.590 11.858 -11.658 1.00 0.00 H new ATOM 0 HB2 MET A 70 14.830 13.466 -9.089 1.00 0.00 H new ATOM 0 HB3 MET A 70 15.341 14.071 -10.653 1.00 0.00 H new ATOM 0 HG2 MET A 70 13.060 13.852 -11.539 1.00 0.00 H new ATOM 0 HG3 MET A 70 12.518 13.091 -10.057 1.00 0.00 H new ATOM 0 HE1 MET A 70 13.327 17.289 -11.255 1.00 0.00 H new ATOM 0 HE2 MET A 70 14.780 16.685 -10.424 1.00 0.00 H new ATOM 0 HE3 MET A 70 14.090 15.771 -11.787 1.00 0.00 H new ATOM 1049 N ALA A 71 16.836 11.287 -9.275 1.00 0.00 N ATOM 1050 CA ALA A 71 18.226 11.025 -9.005 1.00 0.00 C ATOM 1051 C ALA A 71 18.722 9.887 -9.861 1.00 0.00 C ATOM 1052 O ALA A 71 19.871 9.900 -10.292 1.00 0.00 O ATOM 1053 CB ALA A 71 18.494 10.666 -7.534 1.00 0.00 C ATOM 0 H ALA A 71 16.219 11.137 -8.477 1.00 0.00 H new ATOM 0 HA ALA A 71 18.756 11.949 -9.236 1.00 0.00 H new ATOM 0 HB1 ALA A 71 19.559 10.480 -7.393 1.00 0.00 H new ATOM 0 HB2 ALA A 71 18.183 11.493 -6.895 1.00 0.00 H new ATOM 0 HB3 ALA A 71 17.931 9.771 -7.269 1.00 0.00 H new ATOM 1059 N PHE A 72 17.876 8.856 -10.112 1.00 0.00 N ATOM 1060 CA PHE A 72 18.314 7.727 -10.909 1.00 0.00 C ATOM 1061 C PHE A 72 18.659 8.233 -12.273 1.00 0.00 C ATOM 1062 O PHE A 72 19.714 7.916 -12.822 1.00 0.00 O ATOM 1063 CB PHE A 72 17.225 6.650 -11.134 1.00 0.00 C ATOM 1064 CG PHE A 72 16.649 6.031 -9.901 1.00 0.00 C ATOM 1065 CD1 PHE A 72 15.322 5.660 -9.885 1.00 0.00 C ATOM 1066 CD2 PHE A 72 17.416 5.816 -8.776 1.00 0.00 C ATOM 1067 CE1 PHE A 72 14.768 5.088 -8.768 1.00 0.00 C ATOM 1068 CE2 PHE A 72 16.858 5.241 -7.657 1.00 0.00 C ATOM 1069 CZ PHE A 72 15.535 4.878 -7.654 1.00 0.00 C ATOM 0 H PHE A 72 16.915 8.800 -9.775 1.00 0.00 H new ATOM 0 HA PHE A 72 19.144 7.276 -10.365 1.00 0.00 H new ATOM 0 HB2 PHE A 72 16.412 7.098 -11.705 1.00 0.00 H new ATOM 0 HB3 PHE A 72 17.648 5.857 -11.751 1.00 0.00 H new ATOM 0 HD1 PHE A 72 14.712 5.821 -10.761 1.00 0.00 H new ATOM 0 HD2 PHE A 72 18.458 6.100 -8.773 1.00 0.00 H new ATOM 0 HE1 PHE A 72 13.726 4.803 -8.768 1.00 0.00 H new ATOM 0 HE2 PHE A 72 17.464 5.075 -6.778 1.00 0.00 H new ATOM 0 HZ PHE A 72 15.100 4.427 -6.774 1.00 0.00 H new ATOM 1079 N ALA A 73 17.755 9.051 -12.850 1.00 0.00 N ATOM 1080 CA ALA A 73 17.978 9.570 -14.172 1.00 0.00 C ATOM 1081 C ALA A 73 19.174 10.488 -14.167 1.00 0.00 C ATOM 1082 O ALA A 73 19.978 10.467 -15.092 1.00 0.00 O ATOM 1083 CB ALA A 73 16.773 10.353 -14.721 1.00 0.00 C ATOM 0 H ALA A 73 16.884 9.350 -12.412 1.00 0.00 H new ATOM 0 HA ALA A 73 18.143 8.707 -14.817 1.00 0.00 H new ATOM 0 HB1 ALA A 73 17.002 10.719 -15.722 1.00 0.00 H new ATOM 0 HB2 ALA A 73 15.903 9.698 -14.765 1.00 0.00 H new ATOM 0 HB3 ALA A 73 16.559 11.197 -14.066 1.00 0.00 H new ATOM 1089 N SER A 74 19.308 11.322 -13.115 1.00 0.00 N ATOM 1090 CA SER A 74 20.408 12.265 -13.046 1.00 0.00 C ATOM 1091 C SER A 74 21.721 11.531 -12.945 1.00 0.00 C ATOM 1092 O SER A 74 22.696 11.908 -13.590 1.00 0.00 O ATOM 1093 CB SER A 74 20.312 13.209 -11.834 1.00 0.00 C ATOM 1094 OG SER A 74 19.159 14.035 -11.950 1.00 0.00 O ATOM 0 H SER A 74 18.670 11.351 -12.319 1.00 0.00 H new ATOM 0 HA SER A 74 20.351 12.858 -13.959 1.00 0.00 H new ATOM 0 HB2 SER A 74 20.262 12.628 -10.913 1.00 0.00 H new ATOM 0 HB3 SER A 74 21.208 13.827 -11.772 1.00 0.00 H new ATOM 0 HG SER A 74 18.354 13.494 -11.810 1.00 0.00 H new ATOM 1100 N SER A 75 21.780 10.462 -12.120 1.00 0.00 N ATOM 1101 CA SER A 75 23.015 9.723 -11.949 1.00 0.00 C ATOM 1102 C SER A 75 23.403 9.086 -13.256 1.00 0.00 C ATOM 1103 O SER A 75 24.564 9.139 -13.665 1.00 0.00 O ATOM 1104 CB SER A 75 22.906 8.609 -10.888 1.00 0.00 C ATOM 1105 OG SER A 75 24.150 7.930 -10.746 1.00 0.00 O ATOM 0 H SER A 75 20.992 10.109 -11.578 1.00 0.00 H new ATOM 0 HA SER A 75 23.764 10.439 -11.613 1.00 0.00 H new ATOM 0 HB2 SER A 75 22.608 9.038 -9.931 1.00 0.00 H new ATOM 0 HB3 SER A 75 22.129 7.900 -11.175 1.00 0.00 H new ATOM 0 HG SER A 75 24.314 7.742 -9.798 1.00 0.00 H new ATOM 1111 N MET A 76 22.426 8.457 -13.943 1.00 0.00 N ATOM 1112 CA MET A 76 22.713 7.806 -15.197 1.00 0.00 C ATOM 1113 C MET A 76 23.093 8.852 -16.210 1.00 0.00 C ATOM 1114 O MET A 76 23.971 8.630 -17.038 1.00 0.00 O ATOM 1115 CB MET A 76 21.519 6.997 -15.744 1.00 0.00 C ATOM 1116 CG MET A 76 21.186 5.779 -14.869 1.00 0.00 C ATOM 1117 SD MET A 76 22.542 4.570 -14.774 1.00 0.00 S ATOM 1118 CE MET A 76 21.785 3.576 -13.451 1.00 0.00 C ATOM 0 H MET A 76 21.454 8.397 -13.640 1.00 0.00 H new ATOM 0 HA MET A 76 23.527 7.103 -15.019 1.00 0.00 H new ATOM 0 HB2 MET A 76 20.644 7.644 -15.809 1.00 0.00 H new ATOM 0 HB3 MET A 76 21.744 6.663 -16.757 1.00 0.00 H new ATOM 0 HG2 MET A 76 20.940 6.119 -13.863 1.00 0.00 H new ATOM 0 HG3 MET A 76 20.297 5.288 -15.265 1.00 0.00 H new ATOM 0 HE1 MET A 76 22.442 2.743 -13.201 1.00 0.00 H new ATOM 0 HE2 MET A 76 21.636 4.198 -12.569 1.00 0.00 H new ATOM 0 HE3 MET A 76 20.823 3.191 -13.790 1.00 0.00 H new ATOM 1128 N ALA A 77 22.428 10.028 -16.159 1.00 0.00 N ATOM 1129 CA ALA A 77 22.712 11.094 -17.094 1.00 0.00 C ATOM 1130 C ALA A 77 24.142 11.540 -16.941 1.00 0.00 C ATOM 1131 O ALA A 77 24.806 11.834 -17.929 1.00 0.00 O ATOM 1132 CB ALA A 77 21.808 12.325 -16.897 1.00 0.00 C ATOM 0 H ALA A 77 21.699 10.244 -15.479 1.00 0.00 H new ATOM 0 HA ALA A 77 22.523 10.687 -18.088 1.00 0.00 H new ATOM 0 HB1 ALA A 77 22.070 13.090 -17.628 1.00 0.00 H new ATOM 0 HB2 ALA A 77 20.766 12.036 -17.032 1.00 0.00 H new ATOM 0 HB3 ALA A 77 21.947 12.722 -15.891 1.00 0.00 H new ATOM 1138 N GLU A 78 24.659 11.612 -15.692 1.00 0.00 N ATOM 1139 CA GLU A 78 26.028 12.048 -15.488 1.00 0.00 C ATOM 1140 C GLU A 78 26.960 11.073 -16.157 1.00 0.00 C ATOM 1141 O GLU A 78 27.949 11.470 -16.777 1.00 0.00 O ATOM 1142 CB GLU A 78 26.426 12.143 -14.000 1.00 0.00 C ATOM 1143 CG GLU A 78 25.735 13.304 -13.263 1.00 0.00 C ATOM 1144 CD GLU A 78 26.123 14.618 -13.927 1.00 0.00 C ATOM 1145 OE1 GLU A 78 27.347 14.844 -14.124 1.00 0.00 O ATOM 1146 OE2 GLU A 78 25.201 15.415 -14.243 1.00 0.00 O ATOM 0 H GLU A 78 24.150 11.377 -14.840 1.00 0.00 H new ATOM 0 HA GLU A 78 26.103 13.048 -15.916 1.00 0.00 H new ATOM 0 HB2 GLU A 78 26.177 11.205 -13.503 1.00 0.00 H new ATOM 0 HB3 GLU A 78 27.507 12.266 -13.926 1.00 0.00 H new ATOM 0 HG2 GLU A 78 24.653 13.175 -13.289 1.00 0.00 H new ATOM 0 HG3 GLU A 78 26.030 13.312 -12.214 1.00 0.00 H new ATOM 1153 N LEU A 79 26.664 9.762 -16.043 1.00 0.00 N ATOM 1154 CA LEU A 79 27.503 8.758 -16.661 1.00 0.00 C ATOM 1155 C LEU A 79 27.407 8.908 -18.157 1.00 0.00 C ATOM 1156 O LEU A 79 28.395 8.762 -18.878 1.00 0.00 O ATOM 1157 CB LEU A 79 27.089 7.316 -16.299 1.00 0.00 C ATOM 1158 CG LEU A 79 27.362 6.966 -14.825 1.00 0.00 C ATOM 1159 CD1 LEU A 79 26.729 5.619 -14.445 1.00 0.00 C ATOM 1160 CD2 LEU A 79 28.869 6.979 -14.514 1.00 0.00 C ATOM 0 H LEU A 79 25.860 9.395 -15.534 1.00 0.00 H new ATOM 0 HA LEU A 79 28.517 8.915 -16.293 1.00 0.00 H new ATOM 0 HB2 LEU A 79 26.027 7.185 -16.507 1.00 0.00 H new ATOM 0 HB3 LEU A 79 27.628 6.617 -16.939 1.00 0.00 H new ATOM 0 HG LEU A 79 26.893 7.737 -14.214 1.00 0.00 H new ATOM 0 HD11 LEU A 79 26.940 5.400 -13.398 1.00 0.00 H new ATOM 0 HD12 LEU A 79 25.651 5.668 -14.595 1.00 0.00 H new ATOM 0 HD13 LEU A 79 27.147 4.831 -15.071 1.00 0.00 H new ATOM 0 HD21 LEU A 79 29.026 6.728 -13.465 1.00 0.00 H new ATOM 0 HD22 LEU A 79 29.377 6.247 -15.142 1.00 0.00 H new ATOM 0 HD23 LEU A 79 29.273 7.971 -14.714 1.00 0.00 H new ATOM 1172 N VAL A 80 26.186 9.202 -18.648 1.00 0.00 N ATOM 1173 CA VAL A 80 25.952 9.365 -20.066 1.00 0.00 C ATOM 1174 C VAL A 80 26.733 10.548 -20.578 1.00 0.00 C ATOM 1175 O VAL A 80 27.321 10.482 -21.648 1.00 0.00 O ATOM 1176 CB VAL A 80 24.491 9.573 -20.392 1.00 0.00 C ATOM 1177 CG1 VAL A 80 24.349 9.984 -21.871 1.00 0.00 C ATOM 1178 CG2 VAL A 80 23.741 8.267 -20.079 1.00 0.00 C ATOM 0 H VAL A 80 25.356 9.328 -18.068 1.00 0.00 H new ATOM 0 HA VAL A 80 26.278 8.444 -20.549 1.00 0.00 H new ATOM 0 HB VAL A 80 24.060 10.374 -19.791 1.00 0.00 H new ATOM 0 HG11 VAL A 80 23.296 10.134 -22.107 1.00 0.00 H new ATOM 0 HG12 VAL A 80 24.896 10.911 -22.045 1.00 0.00 H new ATOM 0 HG13 VAL A 80 24.755 9.198 -22.508 1.00 0.00 H new ATOM 0 HG21 VAL A 80 22.682 8.392 -20.306 1.00 0.00 H new ATOM 0 HG22 VAL A 80 24.149 7.459 -20.685 1.00 0.00 H new ATOM 0 HG23 VAL A 80 23.859 8.024 -19.023 1.00 0.00 H new ATOM 1188 N ILE A 81 26.765 11.664 -19.816 1.00 0.00 N ATOM 1189 CA ILE A 81 27.470 12.853 -20.261 1.00 0.00 C ATOM 1190 C ILE A 81 28.928 12.552 -20.456 1.00 0.00 C ATOM 1191 O ILE A 81 29.523 12.955 -21.459 1.00 0.00 O ATOM 1192 CB ILE A 81 27.397 13.989 -19.278 1.00 0.00 C ATOM 1193 CG1 ILE A 81 25.972 14.550 -19.212 1.00 0.00 C ATOM 1194 CG2 ILE A 81 28.416 15.060 -19.722 1.00 0.00 C ATOM 1195 CD1 ILE A 81 25.745 15.458 -18.004 1.00 0.00 C ATOM 0 H ILE A 81 26.313 11.751 -18.906 1.00 0.00 H new ATOM 0 HA ILE A 81 26.981 13.148 -21.189 1.00 0.00 H new ATOM 0 HB ILE A 81 27.644 13.648 -18.273 1.00 0.00 H new ATOM 0 HG12 ILE A 81 25.765 15.109 -20.124 1.00 0.00 H new ATOM 0 HG13 ILE A 81 25.263 13.723 -19.177 1.00 0.00 H new ATOM 0 HG21 ILE A 81 28.387 15.900 -19.027 1.00 0.00 H new ATOM 0 HG22 ILE A 81 29.417 14.629 -19.729 1.00 0.00 H new ATOM 0 HG23 ILE A 81 28.164 15.409 -20.723 1.00 0.00 H new ATOM 0 HD11 ILE A 81 24.718 15.824 -18.012 1.00 0.00 H new ATOM 0 HD12 ILE A 81 25.922 14.895 -17.087 1.00 0.00 H new ATOM 0 HD13 ILE A 81 26.432 16.303 -18.050 1.00 0.00 H new ATOM 1207 N ALA A 82 29.534 11.823 -19.504 1.00 0.00 N ATOM 1208 CA ALA A 82 30.946 11.538 -19.583 1.00 0.00 C ATOM 1209 C ALA A 82 31.252 10.791 -20.851 1.00 0.00 C ATOM 1210 O ALA A 82 32.247 11.068 -21.511 1.00 0.00 O ATOM 1211 CB ALA A 82 31.447 10.689 -18.401 1.00 0.00 C ATOM 0 H ALA A 82 29.062 11.432 -18.688 1.00 0.00 H new ATOM 0 HA ALA A 82 31.455 12.502 -19.559 1.00 0.00 H new ATOM 0 HB1 ALA A 82 32.516 10.505 -18.512 1.00 0.00 H new ATOM 0 HB2 ALA A 82 31.266 11.222 -17.468 1.00 0.00 H new ATOM 0 HB3 ALA A 82 30.915 9.738 -18.385 1.00 0.00 H new ATOM 1217 N GLU A 83 30.397 9.834 -21.238 1.00 0.00 N ATOM 1218 CA GLU A 83 30.667 9.075 -22.433 1.00 0.00 C ATOM 1219 C GLU A 83 30.169 9.821 -23.648 1.00 0.00 C ATOM 1220 O GLU A 83 30.684 9.627 -24.737 1.00 0.00 O ATOM 1221 CB GLU A 83 30.009 7.683 -22.413 1.00 0.00 C ATOM 1222 CG GLU A 83 30.651 6.753 -21.370 1.00 0.00 C ATOM 1223 CD GLU A 83 29.886 5.434 -21.333 1.00 0.00 C ATOM 1224 OE1 GLU A 83 28.792 5.359 -21.954 1.00 0.00 O ATOM 1225 OE2 GLU A 83 30.389 4.482 -20.678 1.00 0.00 O ATOM 0 H GLU A 83 29.539 9.583 -20.746 1.00 0.00 H new ATOM 0 HA GLU A 83 31.748 8.942 -22.476 1.00 0.00 H new ATOM 0 HB2 GLU A 83 28.946 7.789 -22.198 1.00 0.00 H new ATOM 0 HB3 GLU A 83 30.091 7.230 -23.401 1.00 0.00 H new ATOM 0 HG2 GLU A 83 31.697 6.573 -21.620 1.00 0.00 H new ATOM 0 HG3 GLU A 83 30.635 7.224 -20.387 1.00 0.00 H new ATOM 1232 N ASP A 84 29.159 10.698 -23.487 1.00 0.00 N ATOM 1233 CA ASP A 84 28.597 11.414 -24.620 1.00 0.00 C ATOM 1234 C ASP A 84 29.604 12.355 -25.224 1.00 0.00 C ATOM 1235 O ASP A 84 29.765 12.393 -26.438 1.00 0.00 O ATOM 1236 CB ASP A 84 27.346 12.241 -24.240 1.00 0.00 C ATOM 1237 CG ASP A 84 26.622 12.802 -25.457 1.00 0.00 C ATOM 1238 OD1 ASP A 84 26.949 13.947 -25.864 1.00 0.00 O ATOM 1239 OD2 ASP A 84 25.729 12.093 -25.991 1.00 0.00 O ATOM 0 H ASP A 84 28.728 10.918 -22.589 1.00 0.00 H new ATOM 0 HA ASP A 84 28.312 10.645 -25.339 1.00 0.00 H new ATOM 0 HB2 ASP A 84 26.660 11.614 -23.671 1.00 0.00 H new ATOM 0 HB3 ASP A 84 27.643 13.062 -23.588 1.00 0.00 H new ATOM 1244 N VAL A 85 30.294 13.156 -24.394 1.00 0.00 N ATOM 1245 CA VAL A 85 31.244 14.107 -24.930 1.00 0.00 C ATOM 1246 C VAL A 85 32.404 13.368 -25.542 1.00 0.00 C ATOM 1247 O VAL A 85 32.865 13.702 -26.632 1.00 0.00 O ATOM 1248 CB VAL A 85 31.777 15.051 -23.881 1.00 0.00 C ATOM 1249 CG1 VAL A 85 32.906 15.903 -24.499 1.00 0.00 C ATOM 1250 CG2 VAL A 85 30.610 15.911 -23.366 1.00 0.00 C ATOM 0 H VAL A 85 30.206 13.156 -23.378 1.00 0.00 H new ATOM 0 HA VAL A 85 30.715 14.699 -25.677 1.00 0.00 H new ATOM 0 HB VAL A 85 32.200 14.511 -23.034 1.00 0.00 H new ATOM 0 HG11 VAL A 85 33.297 16.589 -23.747 1.00 0.00 H new ATOM 0 HG12 VAL A 85 33.706 15.250 -24.846 1.00 0.00 H new ATOM 0 HG13 VAL A 85 32.512 16.473 -25.340 1.00 0.00 H new ATOM 0 HG21 VAL A 85 30.975 16.601 -22.605 1.00 0.00 H new ATOM 0 HG22 VAL A 85 30.182 16.476 -24.194 1.00 0.00 H new ATOM 0 HG23 VAL A 85 29.846 15.266 -22.933 1.00 0.00 H new ATOM 1260 N ASN A 86 32.896 12.335 -24.838 1.00 0.00 N ATOM 1261 CA ASN A 86 34.041 11.591 -25.306 1.00 0.00 C ATOM 1262 C ASN A 86 33.698 10.757 -26.522 1.00 0.00 C ATOM 1263 O ASN A 86 34.507 10.649 -27.442 1.00 0.00 O ATOM 1264 CB ASN A 86 34.616 10.684 -24.204 1.00 0.00 C ATOM 1265 CG ASN A 86 35.365 11.506 -23.158 1.00 0.00 C ATOM 1266 OD1 ASN A 86 36.536 11.824 -23.328 1.00 0.00 O ATOM 1267 ND2 ASN A 86 34.661 11.900 -22.062 1.00 0.00 N ATOM 0 H ASN A 86 32.511 12.010 -23.951 1.00 0.00 H new ATOM 0 HA ASN A 86 34.799 12.324 -25.584 1.00 0.00 H new ATOM 0 HB2 ASN A 86 33.809 10.129 -23.726 1.00 0.00 H new ATOM 0 HB3 ASN A 86 35.290 9.950 -24.646 1.00 0.00 H new ATOM 0 HD21 ASN A 86 35.107 12.478 -21.350 1.00 0.00 H new ATOM 0 HD22 ASN A 86 33.687 11.617 -21.952 1.00 0.00 H new ATOM 1274 N ASN A 87 32.500 10.139 -26.561 1.00 0.00 N ATOM 1275 CA ASN A 87 32.142 9.322 -27.699 1.00 0.00 C ATOM 1276 C ASN A 87 30.635 9.234 -27.744 1.00 0.00 C ATOM 1277 O ASN A 87 30.028 8.343 -27.144 1.00 0.00 O ATOM 1278 CB ASN A 87 32.711 7.887 -27.607 1.00 0.00 C ATOM 1279 CG ASN A 87 32.574 7.125 -28.920 1.00 0.00 C ATOM 1280 OD1 ASN A 87 31.779 7.487 -29.785 1.00 0.00 O ATOM 1281 ND2 ASN A 87 33.369 6.039 -29.078 1.00 0.00 N ATOM 0 H ASN A 87 31.792 10.197 -25.829 1.00 0.00 H new ATOM 0 HA ASN A 87 32.561 9.783 -28.593 1.00 0.00 H new ATOM 0 HB2 ASN A 87 33.763 7.933 -27.324 1.00 0.00 H new ATOM 0 HB3 ASN A 87 32.192 7.343 -26.818 1.00 0.00 H new ATOM 0 HD21 ASN A 87 33.320 5.491 -29.937 1.00 0.00 H new ATOM 0 HD22 ASN A 87 34.017 5.769 -28.338 1.00 0.00 H new ATOM 1288 N PRO A 88 30.014 10.134 -28.476 1.00 0.00 N ATOM 1289 CA PRO A 88 28.560 10.166 -28.586 1.00 0.00 C ATOM 1290 C PRO A 88 27.986 9.017 -29.360 1.00 0.00 C ATOM 1291 O PRO A 88 26.798 8.718 -29.248 1.00 0.00 O ATOM 1292 CB PRO A 88 28.264 11.492 -29.290 1.00 0.00 C ATOM 1293 CG PRO A 88 29.526 11.776 -30.099 1.00 0.00 C ATOM 1294 CD PRO A 88 30.665 11.191 -29.264 1.00 0.00 C ATOM 0 HA PRO A 88 28.100 10.080 -27.601 1.00 0.00 H new ATOM 0 HB2 PRO A 88 27.388 11.414 -29.933 1.00 0.00 H new ATOM 0 HB3 PRO A 88 28.063 12.288 -28.573 1.00 0.00 H new ATOM 0 HG2 PRO A 88 29.478 11.311 -31.083 1.00 0.00 H new ATOM 0 HG3 PRO A 88 29.661 12.846 -30.258 1.00 0.00 H new ATOM 0 HD2 PRO A 88 31.458 10.789 -29.895 1.00 0.00 H new ATOM 0 HD3 PRO A 88 31.120 11.946 -28.623 1.00 0.00 H new ATOM 1302 N ASP A 89 28.824 8.335 -30.169 1.00 0.00 N ATOM 1303 CA ASP A 89 28.344 7.222 -30.960 1.00 0.00 C ATOM 1304 C ASP A 89 27.922 6.114 -30.030 1.00 0.00 C ATOM 1305 O ASP A 89 26.915 5.442 -30.259 1.00 0.00 O ATOM 1306 CB ASP A 89 29.406 6.656 -31.927 1.00 0.00 C ATOM 1307 CG ASP A 89 29.699 7.602 -33.084 1.00 0.00 C ATOM 1308 OD1 ASP A 89 28.904 8.558 -33.289 1.00 0.00 O ATOM 1309 OD2 ASP A 89 30.724 7.378 -33.780 1.00 0.00 O ATOM 0 H ASP A 89 29.816 8.543 -30.279 1.00 0.00 H new ATOM 0 HA ASP A 89 27.515 7.595 -31.562 1.00 0.00 H new ATOM 0 HB2 ASP A 89 30.327 6.462 -31.378 1.00 0.00 H new ATOM 0 HB3 ASP A 89 29.062 5.700 -32.321 1.00 0.00 H new ATOM 1314 N SER A 90 28.702 5.904 -28.950 1.00 0.00 N ATOM 1315 CA SER A 90 28.397 4.861 -27.998 1.00 0.00 C ATOM 1316 C SER A 90 27.099 5.184 -27.313 1.00 0.00 C ATOM 1317 O SER A 90 26.277 4.305 -27.073 1.00 0.00 O ATOM 1318 CB SER A 90 29.476 4.702 -26.909 1.00 0.00 C ATOM 1319 OG SER A 90 30.695 4.257 -27.488 1.00 0.00 O ATOM 0 H SER A 90 29.537 6.447 -28.732 1.00 0.00 H new ATOM 0 HA SER A 90 28.344 3.929 -28.561 1.00 0.00 H new ATOM 0 HB2 SER A 90 29.632 5.653 -26.400 1.00 0.00 H new ATOM 0 HB3 SER A 90 29.141 3.989 -26.156 1.00 0.00 H new ATOM 0 HG SER A 90 31.374 4.161 -26.788 1.00 0.00 H new ATOM 1325 N ILE A 91 26.896 6.474 -26.989 1.00 0.00 N ATOM 1326 CA ILE A 91 25.692 6.897 -26.306 1.00 0.00 C ATOM 1327 C ILE A 91 24.500 6.672 -27.189 1.00 0.00 C ATOM 1328 O ILE A 91 23.445 6.278 -26.709 1.00 0.00 O ATOM 1329 CB ILE A 91 25.724 8.345 -25.891 1.00 0.00 C ATOM 1330 CG1 ILE A 91 26.797 8.549 -24.811 1.00 0.00 C ATOM 1331 CG2 ILE A 91 24.323 8.761 -25.396 1.00 0.00 C ATOM 1332 CD1 ILE A 91 26.571 7.678 -23.574 1.00 0.00 C ATOM 0 H ILE A 91 27.554 7.226 -27.194 1.00 0.00 H new ATOM 0 HA ILE A 91 25.624 6.297 -25.398 1.00 0.00 H new ATOM 0 HB ILE A 91 25.985 8.978 -26.739 1.00 0.00 H new ATOM 0 HG12 ILE A 91 27.777 8.325 -25.233 1.00 0.00 H new ATOM 0 HG13 ILE A 91 26.811 9.597 -24.513 1.00 0.00 H new ATOM 0 HG21 ILE A 91 24.340 9.808 -25.094 1.00 0.00 H new ATOM 0 HG22 ILE A 91 23.599 8.626 -26.199 1.00 0.00 H new ATOM 0 HG23 ILE A 91 24.040 8.143 -24.544 1.00 0.00 H new ATOM 0 HD11 ILE A 91 27.361 7.867 -22.847 1.00 0.00 H new ATOM 0 HD12 ILE A 91 25.605 7.919 -23.131 1.00 0.00 H new ATOM 0 HD13 ILE A 91 26.586 6.627 -23.862 1.00 0.00 H new ATOM 1344 N ALA A 92 24.625 6.935 -28.506 1.00 0.00 N ATOM 1345 CA ALA A 92 23.500 6.745 -29.394 1.00 0.00 C ATOM 1346 C ALA A 92 23.078 5.297 -29.355 1.00 0.00 C ATOM 1347 O ALA A 92 21.884 4.988 -29.329 1.00 0.00 O ATOM 1348 CB ALA A 92 23.820 7.112 -30.854 1.00 0.00 C ATOM 0 H ALA A 92 25.478 7.271 -28.953 1.00 0.00 H new ATOM 0 HA ALA A 92 22.707 7.407 -29.047 1.00 0.00 H new ATOM 0 HB1 ALA A 92 22.937 6.949 -31.472 1.00 0.00 H new ATOM 0 HB2 ALA A 92 24.113 8.160 -30.910 1.00 0.00 H new ATOM 0 HB3 ALA A 92 24.637 6.487 -31.216 1.00 0.00 H new ATOM 1354 N GLU A 93 24.059 4.372 -29.346 1.00 0.00 N ATOM 1355 CA GLU A 93 23.742 2.960 -29.311 1.00 0.00 C ATOM 1356 C GLU A 93 23.127 2.623 -27.973 1.00 0.00 C ATOM 1357 O GLU A 93 22.166 1.857 -27.898 1.00 0.00 O ATOM 1358 CB GLU A 93 24.981 2.062 -29.503 1.00 0.00 C ATOM 1359 CG GLU A 93 25.541 2.133 -30.933 1.00 0.00 C ATOM 1360 CD GLU A 93 26.839 1.336 -31.003 1.00 0.00 C ATOM 1361 OE1 GLU A 93 27.365 0.954 -29.923 1.00 0.00 O ATOM 1362 OE2 GLU A 93 27.322 1.100 -32.141 1.00 0.00 O ATOM 0 H GLU A 93 25.056 4.588 -29.362 1.00 0.00 H new ATOM 0 HA GLU A 93 23.054 2.770 -30.135 1.00 0.00 H new ATOM 0 HB2 GLU A 93 25.756 2.361 -28.797 1.00 0.00 H new ATOM 0 HB3 GLU A 93 24.718 1.030 -29.270 1.00 0.00 H new ATOM 0 HG2 GLU A 93 24.815 1.732 -31.641 1.00 0.00 H new ATOM 0 HG3 GLU A 93 25.722 3.170 -31.215 1.00 0.00 H new ATOM 1369 N LYS A 94 23.680 3.197 -26.879 1.00 0.00 N ATOM 1370 CA LYS A 94 23.168 2.925 -25.551 1.00 0.00 C ATOM 1371 C LYS A 94 21.773 3.464 -25.419 1.00 0.00 C ATOM 1372 O LYS A 94 20.935 2.851 -24.775 1.00 0.00 O ATOM 1373 CB LYS A 94 24.011 3.551 -24.423 1.00 0.00 C ATOM 1374 CG LYS A 94 25.358 2.854 -24.230 1.00 0.00 C ATOM 1375 CD LYS A 94 26.225 3.537 -23.167 1.00 0.00 C ATOM 1376 CE LYS A 94 25.656 3.380 -21.756 1.00 0.00 C ATOM 1377 NZ LYS A 94 26.565 3.999 -20.766 1.00 0.00 N ATOM 0 H LYS A 94 24.470 3.841 -26.907 1.00 0.00 H new ATOM 0 HA LYS A 94 23.201 1.841 -25.441 1.00 0.00 H new ATOM 0 HB2 LYS A 94 24.181 4.604 -24.645 1.00 0.00 H new ATOM 0 HB3 LYS A 94 23.449 3.509 -23.490 1.00 0.00 H new ATOM 0 HG2 LYS A 94 25.189 1.816 -23.944 1.00 0.00 H new ATOM 0 HG3 LYS A 94 25.895 2.840 -25.178 1.00 0.00 H new ATOM 0 HD2 LYS A 94 27.230 3.117 -23.198 1.00 0.00 H new ATOM 0 HD3 LYS A 94 26.315 4.597 -23.403 1.00 0.00 H new ATOM 0 HE2 LYS A 94 24.672 3.846 -21.699 1.00 0.00 H new ATOM 0 HE3 LYS A 94 25.521 2.323 -21.526 1.00 0.00 H new ATOM 0 HZ1 LYS A 94 26.951 3.263 -20.141 1.00 0.00 H new ATOM 0 HZ2 LYS A 94 27.345 4.476 -21.262 1.00 0.00 H new ATOM 0 HZ3 LYS A 94 26.039 4.694 -20.199 1.00 0.00 H new ATOM 1391 N THR A 95 21.497 4.636 -26.020 1.00 0.00 N ATOM 1392 CA THR A 95 20.188 5.244 -25.911 1.00 0.00 C ATOM 1393 C THR A 95 19.159 4.324 -26.503 1.00 0.00 C ATOM 1394 O THR A 95 18.094 4.120 -25.921 1.00 0.00 O ATOM 1395 CB THR A 95 20.092 6.571 -26.623 1.00 0.00 C ATOM 1396 OG1 THR A 95 21.026 7.487 -26.067 1.00 0.00 O ATOM 1397 CG2 THR A 95 18.665 7.128 -26.470 1.00 0.00 C ATOM 0 H THR A 95 22.167 5.166 -26.578 1.00 0.00 H new ATOM 0 HA THR A 95 20.012 5.417 -24.849 1.00 0.00 H new ATOM 0 HB THR A 95 20.319 6.432 -27.680 1.00 0.00 H new ATOM 0 HG1 THR A 95 21.937 7.173 -26.244 1.00 0.00 H new ATOM 0 HG21 THR A 95 18.592 8.087 -26.983 1.00 0.00 H new ATOM 0 HG22 THR A 95 17.952 6.428 -26.906 1.00 0.00 H new ATOM 0 HG23 THR A 95 18.439 7.264 -25.412 1.00 0.00 H new ATOM 1405 N GLU A 96 19.449 3.742 -27.687 1.00 0.00 N ATOM 1406 CA GLU A 96 18.496 2.855 -28.315 1.00 0.00 C ATOM 1407 C GLU A 96 18.308 1.633 -27.449 1.00 0.00 C ATOM 1408 O GLU A 96 17.187 1.156 -27.270 1.00 0.00 O ATOM 1409 CB GLU A 96 18.950 2.380 -29.711 1.00 0.00 C ATOM 1410 CG GLU A 96 18.941 3.504 -30.760 1.00 0.00 C ATOM 1411 CD GLU A 96 17.526 4.053 -30.894 1.00 0.00 C ATOM 1412 OE1 GLU A 96 16.586 3.231 -31.067 1.00 0.00 O ATOM 1413 OE2 GLU A 96 17.367 5.301 -30.826 1.00 0.00 O ATOM 0 H GLU A 96 20.319 3.877 -28.202 1.00 0.00 H new ATOM 0 HA GLU A 96 17.570 3.418 -28.431 1.00 0.00 H new ATOM 0 HB2 GLU A 96 19.956 1.966 -29.639 1.00 0.00 H new ATOM 0 HB3 GLU A 96 18.297 1.574 -30.045 1.00 0.00 H new ATOM 0 HG2 GLU A 96 19.626 4.299 -30.465 1.00 0.00 H new ATOM 0 HG3 GLU A 96 19.289 3.124 -31.721 1.00 0.00 H new ATOM 1420 N ALA A 97 19.415 1.100 -26.886 1.00 0.00 N ATOM 1421 CA ALA A 97 19.334 -0.083 -26.054 1.00 0.00 C ATOM 1422 C ALA A 97 18.547 0.219 -24.802 1.00 0.00 C ATOM 1423 O ALA A 97 17.718 -0.581 -24.372 1.00 0.00 O ATOM 1424 CB ALA A 97 20.719 -0.605 -25.631 1.00 0.00 C ATOM 0 H ALA A 97 20.356 1.477 -27.001 1.00 0.00 H new ATOM 0 HA ALA A 97 18.843 -0.850 -26.653 1.00 0.00 H new ATOM 0 HB1 ALA A 97 20.599 -1.492 -25.009 1.00 0.00 H new ATOM 0 HB2 ALA A 97 21.299 -0.859 -26.518 1.00 0.00 H new ATOM 0 HB3 ALA A 97 21.241 0.166 -25.065 1.00 0.00 H new ATOM 1430 N LEU A 98 18.796 1.393 -24.193 1.00 0.00 N ATOM 1431 CA LEU A 98 18.116 1.768 -22.971 1.00 0.00 C ATOM 1432 C LEU A 98 16.663 2.006 -23.247 1.00 0.00 C ATOM 1433 O LEU A 98 15.818 1.699 -22.415 1.00 0.00 O ATOM 1434 CB LEU A 98 18.694 3.035 -22.308 1.00 0.00 C ATOM 1435 CG LEU A 98 20.085 2.805 -21.691 1.00 0.00 C ATOM 1436 CD1 LEU A 98 20.734 4.132 -21.268 1.00 0.00 C ATOM 1437 CD2 LEU A 98 20.020 1.820 -20.510 1.00 0.00 C ATOM 0 H LEU A 98 19.462 2.085 -24.536 1.00 0.00 H new ATOM 0 HA LEU A 98 18.261 0.937 -22.281 1.00 0.00 H new ATOM 0 HB2 LEU A 98 18.758 3.831 -23.050 1.00 0.00 H new ATOM 0 HB3 LEU A 98 18.010 3.378 -21.532 1.00 0.00 H new ATOM 0 HG LEU A 98 20.713 2.357 -22.461 1.00 0.00 H new ATOM 0 HD11 LEU A 98 21.715 3.936 -20.836 1.00 0.00 H new ATOM 0 HD12 LEU A 98 20.844 4.777 -22.139 1.00 0.00 H new ATOM 0 HD13 LEU A 98 20.104 4.626 -20.528 1.00 0.00 H new ATOM 0 HD21 LEU A 98 21.019 1.680 -20.098 1.00 0.00 H new ATOM 0 HD22 LEU A 98 19.362 2.220 -19.739 1.00 0.00 H new ATOM 0 HD23 LEU A 98 19.633 0.862 -20.856 1.00 0.00 H new ATOM 1449 N SER A 99 16.333 2.582 -24.419 1.00 0.00 N ATOM 1450 CA SER A 99 14.947 2.850 -24.740 1.00 0.00 C ATOM 1451 C SER A 99 14.202 1.544 -24.756 1.00 0.00 C ATOM 1452 O SER A 99 13.099 1.436 -24.218 1.00 0.00 O ATOM 1453 CB SER A 99 14.763 3.529 -26.114 1.00 0.00 C ATOM 1454 OG SER A 99 13.385 3.799 -26.362 1.00 0.00 O ATOM 0 H SER A 99 17.003 2.860 -25.136 1.00 0.00 H new ATOM 0 HA SER A 99 14.565 3.535 -23.983 1.00 0.00 H new ATOM 0 HB2 SER A 99 15.332 4.458 -26.145 1.00 0.00 H new ATOM 0 HB3 SER A 99 15.160 2.886 -26.899 1.00 0.00 H new ATOM 0 HG SER A 99 13.244 3.925 -27.324 1.00 0.00 H new ATOM 1460 N GLN A 100 14.802 0.515 -25.387 1.00 0.00 N ATOM 1461 CA GLN A 100 14.167 -0.779 -25.453 1.00 0.00 C ATOM 1462 C GLN A 100 14.131 -1.373 -24.071 1.00 0.00 C ATOM 1463 O GLN A 100 13.141 -1.983 -23.675 1.00 0.00 O ATOM 1464 CB GLN A 100 14.905 -1.770 -26.378 1.00 0.00 C ATOM 1465 CG GLN A 100 14.831 -1.373 -27.861 1.00 0.00 C ATOM 1466 CD GLN A 100 13.370 -1.369 -28.296 1.00 0.00 C ATOM 1467 OE1 GLN A 100 12.634 -2.318 -28.055 1.00 0.00 O ATOM 1468 NE2 GLN A 100 12.936 -0.269 -28.962 1.00 0.00 N ATOM 0 H GLN A 100 15.711 0.571 -25.846 1.00 0.00 H new ATOM 0 HA GLN A 100 13.168 -0.623 -25.861 1.00 0.00 H new ATOM 0 HB2 GLN A 100 15.950 -1.832 -26.075 1.00 0.00 H new ATOM 0 HB3 GLN A 100 14.477 -2.765 -26.252 1.00 0.00 H new ATOM 0 HG2 GLN A 100 15.272 -0.387 -28.010 1.00 0.00 H new ATOM 0 HG3 GLN A 100 15.404 -2.074 -28.468 1.00 0.00 H new ATOM 0 HE21 GLN A 100 13.578 0.503 -29.145 1.00 0.00 H new ATOM 0 HE22 GLN A 100 11.968 -0.214 -29.280 1.00 0.00 H new ATOM 1477 N ALA A 101 15.225 -1.193 -23.299 1.00 0.00 N ATOM 1478 CA ALA A 101 15.301 -1.744 -21.968 1.00 0.00 C ATOM 1479 C ALA A 101 14.230 -1.158 -21.092 1.00 0.00 C ATOM 1480 O ALA A 101 13.626 -1.866 -20.299 1.00 0.00 O ATOM 1481 CB ALA A 101 16.656 -1.477 -21.293 1.00 0.00 C ATOM 0 H ALA A 101 16.052 -0.671 -23.590 1.00 0.00 H new ATOM 0 HA ALA A 101 15.169 -2.820 -22.081 1.00 0.00 H new ATOM 0 HB1 ALA A 101 16.657 -1.914 -20.294 1.00 0.00 H new ATOM 0 HB2 ALA A 101 17.453 -1.926 -21.886 1.00 0.00 H new ATOM 0 HB3 ALA A 101 16.820 -0.402 -21.219 1.00 0.00 H new ATOM 1487 N LEU A 102 13.966 0.157 -21.208 1.00 0.00 N ATOM 1488 CA LEU A 102 12.962 0.777 -20.368 1.00 0.00 C ATOM 1489 C LEU A 102 11.613 0.173 -20.653 1.00 0.00 C ATOM 1490 O LEU A 102 10.875 -0.167 -19.729 1.00 0.00 O ATOM 1491 CB LEU A 102 12.848 2.302 -20.590 1.00 0.00 C ATOM 1492 CG LEU A 102 14.050 3.090 -20.036 1.00 0.00 C ATOM 1493 CD1 LEU A 102 14.049 4.540 -20.551 1.00 0.00 C ATOM 1494 CD2 LEU A 102 14.082 3.063 -18.498 1.00 0.00 C ATOM 0 H LEU A 102 14.430 0.786 -21.864 1.00 0.00 H new ATOM 0 HA LEU A 102 13.274 0.599 -19.339 1.00 0.00 H new ATOM 0 HB2 LEU A 102 12.753 2.501 -21.658 1.00 0.00 H new ATOM 0 HB3 LEU A 102 11.936 2.664 -20.116 1.00 0.00 H new ATOM 0 HG LEU A 102 14.953 2.599 -20.399 1.00 0.00 H new ATOM 0 HD11 LEU A 102 14.909 5.072 -20.143 1.00 0.00 H new ATOM 0 HD12 LEU A 102 14.105 4.540 -21.640 1.00 0.00 H new ATOM 0 HD13 LEU A 102 13.132 5.038 -20.236 1.00 0.00 H new ATOM 0 HD21 LEU A 102 14.943 3.629 -18.142 1.00 0.00 H new ATOM 0 HD22 LEU A 102 13.168 3.509 -18.107 1.00 0.00 H new ATOM 0 HD23 LEU A 102 14.158 2.032 -18.154 1.00 0.00 H new ATOM 1506 N LYS A 103 11.263 0.009 -21.944 1.00 0.00 N ATOM 1507 CA LYS A 103 9.972 -0.546 -22.287 1.00 0.00 C ATOM 1508 C LYS A 103 9.903 -1.994 -21.874 1.00 0.00 C ATOM 1509 O LYS A 103 8.888 -2.445 -21.346 1.00 0.00 O ATOM 1510 CB LYS A 103 9.672 -0.471 -23.796 1.00 0.00 C ATOM 1511 CG LYS A 103 9.450 0.966 -24.277 1.00 0.00 C ATOM 1512 CD LYS A 103 9.152 1.041 -25.775 1.00 0.00 C ATOM 1513 CE LYS A 103 8.923 2.475 -26.255 1.00 0.00 C ATOM 1514 NZ LYS A 103 8.645 2.494 -27.708 1.00 0.00 N ATOM 0 H LYS A 103 11.853 0.252 -22.740 1.00 0.00 H new ATOM 0 HA LYS A 103 9.233 0.053 -21.756 1.00 0.00 H new ATOM 0 HB2 LYS A 103 10.500 -0.913 -24.351 1.00 0.00 H new ATOM 0 HB3 LYS A 103 8.786 -1.066 -24.017 1.00 0.00 H new ATOM 0 HG2 LYS A 103 8.622 1.408 -23.722 1.00 0.00 H new ATOM 0 HG3 LYS A 103 10.336 1.561 -24.056 1.00 0.00 H new ATOM 0 HD2 LYS A 103 9.982 0.604 -26.330 1.00 0.00 H new ATOM 0 HD3 LYS A 103 8.269 0.441 -25.997 1.00 0.00 H new ATOM 0 HE2 LYS A 103 8.088 2.918 -25.713 1.00 0.00 H new ATOM 0 HE3 LYS A 103 9.802 3.083 -26.038 1.00 0.00 H new ATOM 0 HZ1 LYS A 103 8.492 3.474 -28.019 1.00 0.00 H new ATOM 0 HZ2 LYS A 103 9.454 2.090 -28.222 1.00 0.00 H new ATOM 0 HZ3 LYS A 103 7.793 1.931 -27.906 1.00 0.00 H new ATOM 1528 N GLN A 104 10.991 -2.758 -22.099 1.00 0.00 N ATOM 1529 CA GLN A 104 10.988 -4.167 -21.760 1.00 0.00 C ATOM 1530 C GLN A 104 10.936 -4.346 -20.269 1.00 0.00 C ATOM 1531 O GLN A 104 10.239 -5.226 -19.769 1.00 0.00 O ATOM 1532 CB GLN A 104 12.228 -4.918 -22.285 1.00 0.00 C ATOM 1533 CG GLN A 104 12.222 -5.069 -23.813 1.00 0.00 C ATOM 1534 CD GLN A 104 13.568 -5.633 -24.254 1.00 0.00 C ATOM 1535 OE1 GLN A 104 14.591 -5.416 -23.613 1.00 0.00 O ATOM 1536 NE2 GLN A 104 13.571 -6.379 -25.387 1.00 0.00 N ATOM 0 H GLN A 104 11.861 -2.417 -22.507 1.00 0.00 H new ATOM 0 HA GLN A 104 10.103 -4.587 -22.239 1.00 0.00 H new ATOM 0 HB2 GLN A 104 13.128 -4.384 -21.980 1.00 0.00 H new ATOM 0 HB3 GLN A 104 12.272 -5.906 -21.826 1.00 0.00 H new ATOM 0 HG2 GLN A 104 11.414 -5.732 -24.124 1.00 0.00 H new ATOM 0 HG3 GLN A 104 12.043 -4.104 -24.287 1.00 0.00 H new ATOM 0 HE21 GLN A 104 12.701 -6.539 -25.895 1.00 0.00 H new ATOM 0 HE22 GLN A 104 14.443 -6.780 -25.731 1.00 0.00 H new ATOM 1545 N CYS A 105 11.687 -3.520 -19.518 1.00 0.00 N ATOM 1546 CA CYS A 105 11.711 -3.646 -18.075 1.00 0.00 C ATOM 1547 C CYS A 105 10.364 -3.302 -17.511 1.00 0.00 C ATOM 1548 O CYS A 105 9.893 -3.964 -16.593 1.00 0.00 O ATOM 1549 CB CYS A 105 12.756 -2.742 -17.393 1.00 0.00 C ATOM 1550 SG CYS A 105 14.450 -3.319 -17.724 1.00 0.00 S ATOM 0 H CYS A 105 12.272 -2.773 -19.892 1.00 0.00 H new ATOM 0 HA CYS A 105 11.982 -4.682 -17.871 1.00 0.00 H new ATOM 0 HB2 CYS A 105 12.642 -1.718 -17.750 1.00 0.00 H new ATOM 0 HB3 CYS A 105 12.579 -2.726 -16.318 1.00 0.00 H new ATOM 1555 N PHE A 106 9.709 -2.245 -18.047 1.00 0.00 N ATOM 1556 CA PHE A 106 8.408 -1.855 -17.543 1.00 0.00 C ATOM 1557 C PHE A 106 7.411 -2.936 -17.858 1.00 0.00 C ATOM 1558 O PHE A 106 6.579 -3.282 -17.027 1.00 0.00 O ATOM 1559 CB PHE A 106 7.883 -0.544 -18.169 1.00 0.00 C ATOM 1560 CG PHE A 106 8.155 0.684 -17.360 1.00 0.00 C ATOM 1561 CD1 PHE A 106 9.444 1.127 -17.158 1.00 0.00 C ATOM 1562 CD2 PHE A 106 7.111 1.403 -16.817 1.00 0.00 C ATOM 1563 CE1 PHE A 106 9.683 2.266 -16.425 1.00 0.00 C ATOM 1564 CE2 PHE A 106 7.352 2.541 -16.084 1.00 0.00 C ATOM 1565 CZ PHE A 106 8.638 2.971 -15.888 1.00 0.00 C ATOM 0 H PHE A 106 10.065 -1.670 -18.811 1.00 0.00 H new ATOM 0 HA PHE A 106 8.525 -1.700 -16.470 1.00 0.00 H new ATOM 0 HB2 PHE A 106 8.333 -0.421 -19.154 1.00 0.00 H new ATOM 0 HB3 PHE A 106 6.807 -0.634 -18.319 1.00 0.00 H new ATOM 0 HD1 PHE A 106 10.272 0.576 -17.578 1.00 0.00 H new ATOM 0 HD2 PHE A 106 6.095 1.069 -16.969 1.00 0.00 H new ATOM 0 HE1 PHE A 106 10.697 2.606 -16.272 1.00 0.00 H new ATOM 0 HE2 PHE A 106 6.527 3.096 -15.662 1.00 0.00 H new ATOM 0 HZ PHE A 106 8.828 3.864 -15.311 1.00 0.00 H new ATOM 1575 N ARG A 107 7.478 -3.490 -19.085 1.00 0.00 N ATOM 1576 CA ARG A 107 6.548 -4.515 -19.503 1.00 0.00 C ATOM 1577 C ARG A 107 6.758 -5.771 -18.692 1.00 0.00 C ATOM 1578 O ARG A 107 5.803 -6.458 -18.337 1.00 0.00 O ATOM 1579 CB ARG A 107 6.699 -4.874 -20.996 1.00 0.00 C ATOM 1580 CG ARG A 107 5.675 -5.912 -21.474 1.00 0.00 C ATOM 1581 CD ARG A 107 4.231 -5.401 -21.381 1.00 0.00 C ATOM 1582 NE ARG A 107 3.317 -6.453 -21.923 1.00 0.00 N ATOM 1583 CZ ARG A 107 3.075 -6.544 -23.268 1.00 0.00 C ATOM 1584 NH1 ARG A 107 3.662 -5.670 -24.137 1.00 0.00 N ATOM 1585 NH2 ARG A 107 2.242 -7.517 -23.740 1.00 0.00 N ATOM 0 H ARG A 107 8.170 -3.235 -19.789 1.00 0.00 H new ATOM 0 HA ARG A 107 5.548 -4.111 -19.343 1.00 0.00 H new ATOM 0 HB2 ARG A 107 6.595 -3.968 -21.593 1.00 0.00 H new ATOM 0 HB3 ARG A 107 7.704 -5.257 -21.171 1.00 0.00 H new ATOM 0 HG2 ARG A 107 5.894 -6.185 -22.506 1.00 0.00 H new ATOM 0 HG3 ARG A 107 5.775 -6.818 -20.876 1.00 0.00 H new ATOM 0 HD2 ARG A 107 3.976 -5.175 -20.346 1.00 0.00 H new ATOM 0 HD3 ARG A 107 4.120 -4.476 -21.946 1.00 0.00 H new ATOM 0 HE ARG A 107 2.869 -7.110 -21.284 1.00 0.00 H new ATOM 0 HH11 ARG A 107 4.286 -4.943 -23.786 1.00 0.00 H new ATOM 0 HH12 ARG A 107 3.477 -5.744 -25.137 1.00 0.00 H new ATOM 0 HH21 ARG A 107 1.803 -8.171 -23.092 1.00 0.00 H new ATOM 0 HH22 ARG A 107 2.058 -7.590 -24.741 1.00 0.00 H new ATOM 1599 N SER A 108 8.025 -6.095 -18.371 1.00 0.00 N ATOM 1600 CA SER A 108 8.319 -7.320 -17.659 1.00 0.00 C ATOM 1601 C SER A 108 8.019 -7.180 -16.190 1.00 0.00 C ATOM 1602 O SER A 108 8.059 -8.173 -15.468 1.00 0.00 O ATOM 1603 CB SER A 108 9.795 -7.743 -17.785 1.00 0.00 C ATOM 1604 OG SER A 108 10.115 -8.001 -19.147 1.00 0.00 O ATOM 0 H SER A 108 8.840 -5.525 -18.596 1.00 0.00 H new ATOM 0 HA SER A 108 7.685 -8.079 -18.117 1.00 0.00 H new ATOM 0 HB2 SER A 108 10.441 -6.957 -17.394 1.00 0.00 H new ATOM 0 HB3 SER A 108 9.978 -8.634 -17.185 1.00 0.00 H new ATOM 0 HG SER A 108 10.218 -7.152 -19.625 1.00 0.00 H new ATOM 1610 N THR A 109 7.723 -5.957 -15.695 1.00 0.00 N ATOM 1611 CA THR A 109 7.454 -5.810 -14.285 1.00 0.00 C ATOM 1612 C THR A 109 6.034 -5.363 -14.093 1.00 0.00 C ATOM 1613 O THR A 109 5.151 -6.169 -13.809 1.00 0.00 O ATOM 1614 CB THR A 109 8.362 -4.813 -13.603 1.00 0.00 C ATOM 1615 OG1 THR A 109 8.520 -3.640 -14.396 1.00 0.00 O ATOM 1616 CG2 THR A 109 9.730 -5.473 -13.362 1.00 0.00 C ATOM 0 H THR A 109 7.670 -5.099 -16.244 1.00 0.00 H new ATOM 0 HA THR A 109 7.635 -6.785 -13.832 1.00 0.00 H new ATOM 0 HB THR A 109 7.916 -4.517 -12.653 1.00 0.00 H new ATOM 0 HG1 THR A 109 9.086 -3.842 -15.170 1.00 0.00 H new ATOM 0 HG21 THR A 109 10.395 -4.763 -12.870 1.00 0.00 H new ATOM 0 HG22 THR A 109 9.604 -6.351 -12.729 1.00 0.00 H new ATOM 0 HG23 THR A 109 10.162 -5.773 -14.316 1.00 0.00 H new ATOM 1624 N MET A 110 5.796 -4.047 -14.228 1.00 0.00 N ATOM 1625 CA MET A 110 4.475 -3.501 -14.017 1.00 0.00 C ATOM 1626 C MET A 110 3.571 -3.871 -15.164 1.00 0.00 C ATOM 1627 O MET A 110 2.360 -3.991 -14.987 1.00 0.00 O ATOM 1628 CB MET A 110 4.486 -1.973 -13.871 1.00 0.00 C ATOM 1629 CG MET A 110 5.168 -1.525 -12.575 1.00 0.00 C ATOM 1630 SD MET A 110 4.997 0.255 -12.260 1.00 0.00 S ATOM 1631 CE MET A 110 6.117 0.743 -13.599 1.00 0.00 C ATOM 0 H MET A 110 6.505 -3.359 -14.481 1.00 0.00 H new ATOM 0 HA MET A 110 4.106 -3.928 -13.084 1.00 0.00 H new ATOM 0 HB2 MET A 110 5.002 -1.531 -14.724 1.00 0.00 H new ATOM 0 HB3 MET A 110 3.462 -1.600 -13.890 1.00 0.00 H new ATOM 0 HG2 MET A 110 4.743 -2.079 -11.738 1.00 0.00 H new ATOM 0 HG3 MET A 110 6.227 -1.780 -12.622 1.00 0.00 H new ATOM 0 HE1 MET A 110 6.336 1.808 -13.521 1.00 0.00 H new ATOM 0 HE2 MET A 110 7.044 0.176 -13.523 1.00 0.00 H new ATOM 0 HE3 MET A 110 5.645 0.539 -14.560 1.00 0.00 H new ATOM 1641 N GLY A 111 4.138 -4.050 -16.378 1.00 0.00 N ATOM 1642 CA GLY A 111 3.325 -4.418 -17.511 1.00 0.00 C ATOM 1643 C GLY A 111 3.037 -3.199 -18.338 1.00 0.00 C ATOM 1644 O GLY A 111 2.002 -3.137 -19.001 1.00 0.00 O ATOM 0 H GLY A 111 5.133 -3.944 -16.576 1.00 0.00 H new ATOM 0 HA2 GLY A 111 3.840 -5.166 -18.114 1.00 0.00 H new ATOM 0 HA3 GLY A 111 2.392 -4.869 -17.172 1.00 0.00 H new ATOM 1648 N THR A 112 3.961 -2.200 -18.323 1.00 0.00 N ATOM 1649 CA THR A 112 3.782 -0.981 -19.086 1.00 0.00 C ATOM 1650 C THR A 112 2.552 -0.286 -18.586 1.00 0.00 C ATOM 1651 O THR A 112 1.446 -0.499 -19.086 1.00 0.00 O ATOM 1652 CB THR A 112 3.645 -1.209 -20.564 1.00 0.00 C ATOM 1653 OG1 THR A 112 4.716 -2.018 -21.034 1.00 0.00 O ATOM 1654 CG2 THR A 112 3.674 0.151 -21.268 1.00 0.00 C ATOM 0 H THR A 112 4.827 -2.236 -17.786 1.00 0.00 H new ATOM 0 HA THR A 112 4.679 -0.379 -18.945 1.00 0.00 H new ATOM 0 HB THR A 112 2.706 -1.721 -20.775 1.00 0.00 H new ATOM 0 HG1 THR A 112 4.618 -2.163 -21.998 1.00 0.00 H new ATOM 0 HG21 THR A 112 3.576 0.006 -22.344 1.00 0.00 H new ATOM 0 HG22 THR A 112 2.849 0.765 -20.908 1.00 0.00 H new ATOM 0 HG23 THR A 112 4.619 0.651 -21.054 1.00 0.00 H new ATOM 1662 N VAL A 113 2.730 0.592 -17.581 1.00 0.00 N ATOM 1663 CA VAL A 113 1.606 1.272 -17.005 1.00 0.00 C ATOM 1664 C VAL A 113 1.599 2.708 -17.439 1.00 0.00 C ATOM 1665 O VAL A 113 0.538 3.285 -17.660 1.00 0.00 O ATOM 1666 CB VAL A 113 1.649 1.219 -15.505 1.00 0.00 C ATOM 1667 CG1 VAL A 113 1.573 -0.260 -15.102 1.00 0.00 C ATOM 1668 CG2 VAL A 113 2.947 1.893 -15.003 1.00 0.00 C ATOM 0 H VAL A 113 3.634 0.829 -17.172 1.00 0.00 H new ATOM 0 HA VAL A 113 0.702 0.771 -17.350 1.00 0.00 H new ATOM 0 HB VAL A 113 0.816 1.758 -15.054 1.00 0.00 H new ATOM 0 HG11 VAL A 113 1.602 -0.343 -14.016 1.00 0.00 H new ATOM 0 HG12 VAL A 113 0.644 -0.691 -15.475 1.00 0.00 H new ATOM 0 HG13 VAL A 113 2.420 -0.797 -15.529 1.00 0.00 H new ATOM 0 HG21 VAL A 113 2.979 1.855 -13.914 1.00 0.00 H new ATOM 0 HG22 VAL A 113 3.811 1.367 -15.410 1.00 0.00 H new ATOM 0 HG23 VAL A 113 2.967 2.932 -15.331 1.00 0.00 H new ATOM 1678 N ASN A 114 2.785 3.326 -17.574 1.00 0.00 N ATOM 1679 CA ASN A 114 2.830 4.700 -17.978 1.00 0.00 C ATOM 1680 C ASN A 114 4.120 4.897 -18.717 1.00 0.00 C ATOM 1681 O ASN A 114 5.202 4.699 -18.169 1.00 0.00 O ATOM 1682 CB ASN A 114 2.775 5.682 -16.788 1.00 0.00 C ATOM 1683 CG ASN A 114 2.516 7.114 -17.233 1.00 0.00 C ATOM 1684 OD1 ASN A 114 2.503 7.410 -18.423 1.00 0.00 O ATOM 1685 ND2 ASN A 114 2.302 8.030 -16.256 1.00 0.00 N ATOM 0 H ASN A 114 3.692 2.890 -17.409 1.00 0.00 H new ATOM 0 HA ASN A 114 1.956 4.911 -18.595 1.00 0.00 H new ATOM 0 HB2 ASN A 114 1.990 5.370 -16.099 1.00 0.00 H new ATOM 0 HB3 ASN A 114 3.716 5.639 -16.240 1.00 0.00 H new ATOM 0 HD21 ASN A 114 2.122 9.004 -16.500 1.00 0.00 H new ATOM 0 HD22 ASN A 114 2.321 7.745 -15.277 1.00 0.00 H new ATOM 1692 N ARG A 115 4.022 5.301 -20.000 1.00 0.00 N ATOM 1693 CA ARG A 115 5.201 5.518 -20.799 1.00 0.00 C ATOM 1694 C ARG A 115 5.726 6.902 -20.525 1.00 0.00 C ATOM 1695 O ARG A 115 6.754 7.297 -21.067 1.00 0.00 O ATOM 1696 CB ARG A 115 4.931 5.387 -22.313 1.00 0.00 C ATOM 1697 CG ARG A 115 3.996 6.473 -22.856 1.00 0.00 C ATOM 1698 CD ARG A 115 3.676 6.277 -24.340 1.00 0.00 C ATOM 1699 NE ARG A 115 2.774 7.382 -24.778 1.00 0.00 N ATOM 1700 CZ ARG A 115 2.307 7.424 -26.061 1.00 0.00 C ATOM 1701 NH1 ARG A 115 2.666 6.455 -26.953 1.00 0.00 N ATOM 1702 NH2 ARG A 115 1.482 8.438 -26.452 1.00 0.00 N ATOM 0 H ARG A 115 3.141 5.476 -20.482 1.00 0.00 H new ATOM 0 HA ARG A 115 5.925 4.750 -20.525 1.00 0.00 H new ATOM 0 HB2 ARG A 115 5.879 5.431 -22.850 1.00 0.00 H new ATOM 0 HB3 ARG A 115 4.496 4.408 -22.514 1.00 0.00 H new ATOM 0 HG2 ARG A 115 3.069 6.470 -22.283 1.00 0.00 H new ATOM 0 HG3 ARG A 115 4.456 7.451 -22.712 1.00 0.00 H new ATOM 0 HD2 ARG A 115 4.593 6.280 -24.929 1.00 0.00 H new ATOM 0 HD3 ARG A 115 3.197 5.311 -24.500 1.00 0.00 H new ATOM 0 HE ARG A 115 2.505 8.110 -24.116 1.00 0.00 H new ATOM 0 HH11 ARG A 115 3.284 5.698 -26.662 1.00 0.00 H new ATOM 0 HH12 ARG A 115 2.316 6.488 -27.911 1.00 0.00 H new ATOM 0 HH21 ARG A 115 1.215 9.163 -25.787 1.00 0.00 H new ATOM 0 HH22 ARG A 115 1.133 8.471 -27.410 1.00 0.00 H new ATOM 1716 N GLN A 116 5.018 7.682 -19.678 1.00 0.00 N ATOM 1717 CA GLN A 116 5.443 9.031 -19.374 1.00 0.00 C ATOM 1718 C GLN A 116 6.784 9.010 -18.678 1.00 0.00 C ATOM 1719 O GLN A 116 7.665 9.793 -19.014 1.00 0.00 O ATOM 1720 CB GLN A 116 4.449 9.772 -18.457 1.00 0.00 C ATOM 1721 CG GLN A 116 4.851 11.226 -18.185 1.00 0.00 C ATOM 1722 CD GLN A 116 3.777 11.872 -17.318 1.00 0.00 C ATOM 1723 OE1 GLN A 116 2.742 11.273 -17.038 1.00 0.00 O ATOM 1724 NE2 GLN A 116 4.030 13.127 -16.874 1.00 0.00 N ATOM 0 H GLN A 116 4.162 7.389 -19.207 1.00 0.00 H new ATOM 0 HA GLN A 116 5.500 9.556 -20.327 1.00 0.00 H new ATOM 0 HB2 GLN A 116 3.460 9.754 -18.914 1.00 0.00 H new ATOM 0 HB3 GLN A 116 4.372 9.239 -17.509 1.00 0.00 H new ATOM 0 HG2 GLN A 116 5.817 11.264 -17.682 1.00 0.00 H new ATOM 0 HG3 GLN A 116 4.959 11.771 -19.123 1.00 0.00 H new ATOM 0 HE21 GLN A 116 4.902 13.592 -17.128 1.00 0.00 H new ATOM 0 HE22 GLN A 116 3.349 13.607 -16.286 1.00 0.00 H new ATOM 1733 N PHE A 117 6.979 8.098 -17.695 1.00 0.00 N ATOM 1734 CA PHE A 117 8.241 8.056 -16.976 1.00 0.00 C ATOM 1735 C PHE A 117 9.304 7.589 -17.917 1.00 0.00 C ATOM 1736 O PHE A 117 10.410 8.118 -17.941 1.00 0.00 O ATOM 1737 CB PHE A 117 8.248 7.063 -15.799 1.00 0.00 C ATOM 1738 CG PHE A 117 7.212 7.331 -14.769 1.00 0.00 C ATOM 1739 CD1 PHE A 117 6.005 6.684 -14.842 1.00 0.00 C ATOM 1740 CD2 PHE A 117 7.443 8.218 -13.739 1.00 0.00 C ATOM 1741 CE1 PHE A 117 5.031 6.914 -13.901 1.00 0.00 C ATOM 1742 CE2 PHE A 117 6.470 8.449 -12.796 1.00 0.00 C ATOM 1743 CZ PHE A 117 5.264 7.799 -12.877 1.00 0.00 C ATOM 0 H PHE A 117 6.290 7.406 -17.400 1.00 0.00 H new ATOM 0 HA PHE A 117 8.406 9.060 -16.586 1.00 0.00 H new ATOM 0 HB2 PHE A 117 8.105 6.055 -16.188 1.00 0.00 H new ATOM 0 HB3 PHE A 117 9.229 7.086 -15.325 1.00 0.00 H new ATOM 0 HD1 PHE A 117 5.819 5.988 -15.646 1.00 0.00 H new ATOM 0 HD2 PHE A 117 8.390 8.732 -13.673 1.00 0.00 H new ATOM 0 HE1 PHE A 117 4.084 6.400 -13.966 1.00 0.00 H new ATOM 0 HE2 PHE A 117 6.655 9.143 -11.990 1.00 0.00 H new ATOM 0 HZ PHE A 117 4.499 7.983 -12.137 1.00 0.00 H new ATOM 1753 N ILE A 118 8.960 6.580 -18.731 1.00 0.00 N ATOM 1754 CA ILE A 118 9.903 6.008 -19.664 1.00 0.00 C ATOM 1755 C ILE A 118 10.362 7.074 -20.631 1.00 0.00 C ATOM 1756 O ILE A 118 11.559 7.228 -20.886 1.00 0.00 O ATOM 1757 CB ILE A 118 9.278 4.876 -20.444 1.00 0.00 C ATOM 1758 CG1 ILE A 118 8.981 3.700 -19.492 1.00 0.00 C ATOM 1759 CG2 ILE A 118 10.231 4.471 -21.587 1.00 0.00 C ATOM 1760 CD1 ILE A 118 8.060 2.639 -20.102 1.00 0.00 C ATOM 0 H ILE A 118 8.034 6.154 -18.751 1.00 0.00 H new ATOM 0 HA ILE A 118 10.749 5.618 -19.098 1.00 0.00 H new ATOM 0 HB ILE A 118 8.332 5.187 -20.887 1.00 0.00 H new ATOM 0 HG12 ILE A 118 9.921 3.231 -19.202 1.00 0.00 H new ATOM 0 HG13 ILE A 118 8.524 4.087 -18.581 1.00 0.00 H new ATOM 0 HG21 ILE A 118 9.789 3.654 -22.157 1.00 0.00 H new ATOM 0 HG22 ILE A 118 10.394 5.325 -22.244 1.00 0.00 H new ATOM 0 HG23 ILE A 118 11.184 4.148 -21.169 1.00 0.00 H new ATOM 0 HD11 ILE A 118 7.894 1.842 -19.378 1.00 0.00 H new ATOM 0 HD12 ILE A 118 7.105 3.094 -20.366 1.00 0.00 H new ATOM 0 HD13 ILE A 118 8.525 2.225 -20.997 1.00 0.00 H new ATOM 1772 N THR A 119 9.406 7.846 -21.181 1.00 0.00 N ATOM 1773 CA THR A 119 9.733 8.880 -22.139 1.00 0.00 C ATOM 1774 C THR A 119 10.497 9.993 -21.468 1.00 0.00 C ATOM 1775 O THR A 119 11.488 10.480 -22.008 1.00 0.00 O ATOM 1776 CB THR A 119 8.508 9.492 -22.767 1.00 0.00 C ATOM 1777 OG1 THR A 119 7.756 8.489 -23.438 1.00 0.00 O ATOM 1778 CG2 THR A 119 8.937 10.578 -23.769 1.00 0.00 C ATOM 0 H THR A 119 8.412 7.762 -20.970 1.00 0.00 H new ATOM 0 HA THR A 119 10.330 8.398 -22.913 1.00 0.00 H new ATOM 0 HB THR A 119 7.888 9.939 -21.990 1.00 0.00 H new ATOM 0 HG1 THR A 119 7.300 7.926 -22.778 1.00 0.00 H new ATOM 0 HG21 THR A 119 8.052 11.022 -24.225 1.00 0.00 H new ATOM 0 HG22 THR A 119 9.504 11.350 -23.248 1.00 0.00 H new ATOM 0 HG23 THR A 119 9.560 10.132 -24.545 1.00 0.00 H new ATOM 1786 N GLU A 120 10.053 10.426 -20.266 1.00 0.00 N ATOM 1787 CA GLU A 120 10.708 11.527 -19.587 1.00 0.00 C ATOM 1788 C GLU A 120 12.121 11.169 -19.221 1.00 0.00 C ATOM 1789 O GLU A 120 13.008 12.005 -19.331 1.00 0.00 O ATOM 1790 CB GLU A 120 9.985 11.979 -18.303 1.00 0.00 C ATOM 1791 CG GLU A 120 8.664 12.710 -18.598 1.00 0.00 C ATOM 1792 CD GLU A 120 7.943 12.992 -17.284 1.00 0.00 C ATOM 1793 OE1 GLU A 120 8.375 12.447 -16.233 1.00 0.00 O ATOM 1794 OE2 GLU A 120 6.941 13.757 -17.316 1.00 0.00 O ATOM 0 H GLU A 120 9.257 10.027 -19.767 1.00 0.00 H new ATOM 0 HA GLU A 120 10.685 12.352 -20.299 1.00 0.00 H new ATOM 0 HB2 GLU A 120 9.784 11.109 -17.678 1.00 0.00 H new ATOM 0 HB3 GLU A 120 10.641 12.637 -17.733 1.00 0.00 H new ATOM 0 HG2 GLU A 120 8.861 13.643 -19.126 1.00 0.00 H new ATOM 0 HG3 GLU A 120 8.035 12.102 -19.248 1.00 0.00 H new ATOM 1801 N ILE A 121 12.375 9.927 -18.762 1.00 0.00 N ATOM 1802 CA ILE A 121 13.722 9.557 -18.380 1.00 0.00 C ATOM 1803 C ILE A 121 14.624 9.642 -19.583 1.00 0.00 C ATOM 1804 O ILE A 121 15.710 10.216 -19.513 1.00 0.00 O ATOM 1805 CB ILE A 121 13.813 8.164 -17.808 1.00 0.00 C ATOM 1806 CG1 ILE A 121 13.111 8.111 -16.437 1.00 0.00 C ATOM 1807 CG2 ILE A 121 15.300 7.765 -17.705 1.00 0.00 C ATOM 1808 CD1 ILE A 121 12.926 6.682 -15.926 1.00 0.00 C ATOM 0 H ILE A 121 11.676 9.192 -18.654 1.00 0.00 H new ATOM 0 HA ILE A 121 14.031 10.254 -17.601 1.00 0.00 H new ATOM 0 HB ILE A 121 13.307 7.452 -18.460 1.00 0.00 H new ATOM 0 HG12 ILE A 121 13.694 8.679 -15.712 1.00 0.00 H new ATOM 0 HG13 ILE A 121 12.137 8.595 -16.513 1.00 0.00 H new ATOM 0 HG21 ILE A 121 15.379 6.759 -17.293 1.00 0.00 H new ATOM 0 HG22 ILE A 121 15.752 7.787 -18.697 1.00 0.00 H new ATOM 0 HG23 ILE A 121 15.821 8.466 -17.053 1.00 0.00 H new ATOM 0 HD11 ILE A 121 12.427 6.704 -14.957 1.00 0.00 H new ATOM 0 HD12 ILE A 121 12.319 6.118 -16.634 1.00 0.00 H new ATOM 0 HD13 ILE A 121 13.900 6.204 -15.822 1.00 0.00 H new ATOM 1820 N LYS A 122 14.184 9.077 -20.722 1.00 0.00 N ATOM 1821 CA LYS A 122 14.997 9.095 -21.919 1.00 0.00 C ATOM 1822 C LYS A 122 15.185 10.518 -22.385 1.00 0.00 C ATOM 1823 O LYS A 122 16.290 10.921 -22.758 1.00 0.00 O ATOM 1824 CB LYS A 122 14.370 8.289 -23.073 1.00 0.00 C ATOM 1825 CG LYS A 122 15.243 8.267 -24.333 1.00 0.00 C ATOM 1826 CD LYS A 122 14.721 7.292 -25.393 1.00 0.00 C ATOM 1827 CE LYS A 122 13.395 7.742 -26.009 1.00 0.00 C ATOM 1828 NZ LYS A 122 12.974 6.797 -27.067 1.00 0.00 N ATOM 0 H LYS A 122 13.282 8.613 -20.824 1.00 0.00 H new ATOM 0 HA LYS A 122 15.950 8.635 -21.659 1.00 0.00 H new ATOM 0 HB2 LYS A 122 14.195 7.266 -22.741 1.00 0.00 H new ATOM 0 HB3 LYS A 122 13.397 8.715 -23.319 1.00 0.00 H new ATOM 0 HG2 LYS A 122 15.288 9.270 -24.757 1.00 0.00 H new ATOM 0 HG3 LYS A 122 16.262 7.991 -24.060 1.00 0.00 H new ATOM 0 HD2 LYS A 122 15.466 7.187 -26.182 1.00 0.00 H new ATOM 0 HD3 LYS A 122 14.592 6.308 -24.943 1.00 0.00 H new ATOM 0 HE2 LYS A 122 12.628 7.799 -25.237 1.00 0.00 H new ATOM 0 HE3 LYS A 122 13.501 8.743 -26.427 1.00 0.00 H new ATOM 0 HZ1 LYS A 122 11.961 6.925 -27.263 1.00 0.00 H new ATOM 0 HZ2 LYS A 122 13.520 6.980 -27.933 1.00 0.00 H new ATOM 0 HZ3 LYS A 122 13.145 5.822 -26.749 1.00 0.00 H new ATOM 1842 N HIS A 123 14.094 11.307 -22.377 1.00 0.00 N ATOM 1843 CA HIS A 123 14.154 12.681 -22.831 1.00 0.00 C ATOM 1844 C HIS A 123 15.090 13.480 -21.963 1.00 0.00 C ATOM 1845 O HIS A 123 15.941 14.203 -22.473 1.00 0.00 O ATOM 1846 CB HIS A 123 12.776 13.376 -22.810 1.00 0.00 C ATOM 1847 CG HIS A 123 12.803 14.793 -23.319 1.00 0.00 C ATOM 1848 ND1 HIS A 123 12.985 15.845 -22.434 1.00 0.00 N ATOM 1849 CD2 HIS A 123 12.670 15.258 -24.592 1.00 0.00 C ATOM 1850 CE1 HIS A 123 12.958 16.925 -23.195 1.00 0.00 C ATOM 1851 NE2 HIS A 123 12.771 16.627 -24.504 1.00 0.00 N ATOM 0 H HIS A 123 13.173 11.005 -22.060 1.00 0.00 H new ATOM 0 HA HIS A 123 14.510 12.644 -23.860 1.00 0.00 H new ATOM 0 HB2 HIS A 123 12.078 12.796 -23.413 1.00 0.00 H new ATOM 0 HB3 HIS A 123 12.394 13.374 -21.789 1.00 0.00 H new ATOM 0 HD2 HIS A 123 12.517 14.672 -25.486 1.00 0.00 H new ATOM 0 HE1 HIS A 123 13.072 17.930 -22.817 1.00 0.00 H new ATOM 0 HE2 HIS A 123 12.716 17.291 -25.276 1.00 0.00 H new ATOM 1859 N LEU A 124 14.954 13.369 -20.623 1.00 0.00 N ATOM 1860 CA LEU A 124 15.791 14.137 -19.726 1.00 0.00 C ATOM 1861 C LEU A 124 17.224 13.711 -19.862 1.00 0.00 C ATOM 1862 O LEU A 124 18.127 14.544 -19.847 1.00 0.00 O ATOM 1863 CB LEU A 124 15.393 13.981 -18.242 1.00 0.00 C ATOM 1864 CG LEU A 124 14.054 14.661 -17.905 1.00 0.00 C ATOM 1865 CD1 LEU A 124 13.571 14.274 -16.498 1.00 0.00 C ATOM 1866 CD2 LEU A 124 14.146 16.188 -18.057 1.00 0.00 C ATOM 0 H LEU A 124 14.278 12.760 -20.161 1.00 0.00 H new ATOM 0 HA LEU A 124 15.656 15.180 -20.012 1.00 0.00 H new ATOM 0 HB2 LEU A 124 15.327 12.921 -17.998 1.00 0.00 H new ATOM 0 HB3 LEU A 124 16.177 14.404 -17.615 1.00 0.00 H new ATOM 0 HG LEU A 124 13.316 14.302 -18.622 1.00 0.00 H new ATOM 0 HD11 LEU A 124 12.623 14.770 -16.289 1.00 0.00 H new ATOM 0 HD12 LEU A 124 13.435 13.194 -16.444 1.00 0.00 H new ATOM 0 HD13 LEU A 124 14.312 14.583 -15.761 1.00 0.00 H new ATOM 0 HD21 LEU A 124 13.183 16.637 -17.811 1.00 0.00 H new ATOM 0 HD22 LEU A 124 14.910 16.575 -17.383 1.00 0.00 H new ATOM 0 HD23 LEU A 124 14.410 16.436 -19.085 1.00 0.00 H new ATOM 1878 N MET A 125 17.467 12.397 -20.003 1.00 0.00 N ATOM 1879 CA MET A 125 18.821 11.900 -20.112 1.00 0.00 C ATOM 1880 C MET A 125 19.472 12.481 -21.339 1.00 0.00 C ATOM 1881 O MET A 125 20.602 12.969 -21.282 1.00 0.00 O ATOM 1882 CB MET A 125 18.865 10.362 -20.225 1.00 0.00 C ATOM 1883 CG MET A 125 20.287 9.798 -20.321 1.00 0.00 C ATOM 1884 SD MET A 125 20.317 7.983 -20.426 1.00 0.00 S ATOM 1885 CE MET A 125 19.695 7.905 -22.132 1.00 0.00 C ATOM 0 H MET A 125 16.744 11.679 -20.042 1.00 0.00 H new ATOM 0 HA MET A 125 19.350 12.198 -19.207 1.00 0.00 H new ATOM 0 HB2 MET A 125 18.368 9.927 -19.358 1.00 0.00 H new ATOM 0 HB3 MET A 125 18.300 10.054 -21.105 1.00 0.00 H new ATOM 0 HG2 MET A 125 20.781 10.217 -21.198 1.00 0.00 H new ATOM 0 HG3 MET A 125 20.859 10.117 -19.450 1.00 0.00 H new ATOM 0 HE1 MET A 125 20.037 6.983 -22.602 1.00 0.00 H new ATOM 0 HE2 MET A 125 18.605 7.925 -22.123 1.00 0.00 H new ATOM 0 HE3 MET A 125 20.069 8.760 -22.695 1.00 0.00 H new ATOM 1895 N THR A 126 18.760 12.448 -22.482 1.00 0.00 N ATOM 1896 CA THR A 126 19.309 12.963 -23.715 1.00 0.00 C ATOM 1897 C THR A 126 19.454 14.460 -23.611 1.00 0.00 C ATOM 1898 O THR A 126 20.457 15.028 -24.036 1.00 0.00 O ATOM 1899 CB THR A 126 18.438 12.666 -24.910 1.00 0.00 C ATOM 1900 OG1 THR A 126 18.276 11.260 -25.053 1.00 0.00 O ATOM 1901 CG2 THR A 126 19.095 13.245 -26.175 1.00 0.00 C ATOM 0 H THR A 126 17.815 12.071 -22.560 1.00 0.00 H new ATOM 0 HA THR A 126 20.271 12.472 -23.860 1.00 0.00 H new ATOM 0 HB THR A 126 17.459 13.123 -24.767 1.00 0.00 H new ATOM 0 HG1 THR A 126 17.635 10.935 -24.387 1.00 0.00 H new ATOM 0 HG21 THR A 126 18.468 13.032 -27.041 1.00 0.00 H new ATOM 0 HG22 THR A 126 19.208 14.324 -26.065 1.00 0.00 H new ATOM 0 HG23 THR A 126 20.075 12.790 -26.317 1.00 0.00 H new ATOM 1909 N MET A 127 18.437 15.132 -23.033 1.00 0.00 N ATOM 1910 CA MET A 127 18.449 16.575 -22.925 1.00 0.00 C ATOM 1911 C MET A 127 19.592 17.051 -22.069 1.00 0.00 C ATOM 1912 O MET A 127 20.270 18.014 -22.422 1.00 0.00 O ATOM 1913 CB MET A 127 17.145 17.130 -22.318 1.00 0.00 C ATOM 1914 CG MET A 127 17.115 18.663 -22.259 1.00 0.00 C ATOM 1915 SD MET A 127 15.569 19.318 -21.563 1.00 0.00 S ATOM 1916 CE MET A 127 15.948 18.846 -19.850 1.00 0.00 C ATOM 0 H MET A 127 17.608 14.686 -22.641 1.00 0.00 H new ATOM 0 HA MET A 127 18.558 16.944 -23.945 1.00 0.00 H new ATOM 0 HB2 MET A 127 16.298 16.778 -22.907 1.00 0.00 H new ATOM 0 HB3 MET A 127 17.021 16.731 -21.311 1.00 0.00 H new ATOM 0 HG2 MET A 127 17.954 19.014 -21.659 1.00 0.00 H new ATOM 0 HG3 MET A 127 17.252 19.062 -23.264 1.00 0.00 H new ATOM 0 HE1 MET A 127 15.189 19.255 -19.183 1.00 0.00 H new ATOM 0 HE2 MET A 127 15.957 17.759 -19.766 1.00 0.00 H new ATOM 0 HE3 MET A 127 16.926 19.240 -19.572 1.00 0.00 H new ATOM 1926 N PHE A 128 19.850 16.389 -20.921 1.00 0.00 N ATOM 1927 CA PHE A 128 20.898 16.857 -20.041 1.00 0.00 C ATOM 1928 C PHE A 128 22.227 16.656 -20.699 1.00 0.00 C ATOM 1929 O PHE A 128 23.104 17.516 -20.623 1.00 0.00 O ATOM 1930 CB PHE A 128 20.932 16.134 -18.677 1.00 0.00 C ATOM 1931 CG PHE A 128 19.917 16.638 -17.699 1.00 0.00 C ATOM 1932 CD1 PHE A 128 18.933 15.805 -17.210 1.00 0.00 C ATOM 1933 CD2 PHE A 128 19.952 17.950 -17.273 1.00 0.00 C ATOM 1934 CE1 PHE A 128 18.003 16.274 -16.312 1.00 0.00 C ATOM 1935 CE2 PHE A 128 19.020 18.418 -16.376 1.00 0.00 C ATOM 1936 CZ PHE A 128 18.047 17.580 -15.896 1.00 0.00 C ATOM 0 H PHE A 128 19.354 15.556 -20.604 1.00 0.00 H new ATOM 0 HA PHE A 128 20.687 17.910 -19.854 1.00 0.00 H new ATOM 0 HB2 PHE A 128 20.770 15.068 -18.837 1.00 0.00 H new ATOM 0 HB3 PHE A 128 21.926 16.243 -18.243 1.00 0.00 H new ATOM 0 HD1 PHE A 128 18.892 14.776 -17.535 1.00 0.00 H new ATOM 0 HD2 PHE A 128 20.717 18.615 -17.647 1.00 0.00 H new ATOM 0 HE1 PHE A 128 17.237 15.613 -15.934 1.00 0.00 H new ATOM 0 HE2 PHE A 128 19.055 19.447 -16.049 1.00 0.00 H new ATOM 0 HZ PHE A 128 17.316 17.948 -15.191 1.00 0.00 H new ATOM 1946 N ALA A 129 22.408 15.505 -21.368 1.00 0.00 N ATOM 1947 CA ALA A 129 23.661 15.228 -22.013 1.00 0.00 C ATOM 1948 C ALA A 129 23.864 16.171 -23.166 1.00 0.00 C ATOM 1949 O ALA A 129 24.974 16.638 -23.401 1.00 0.00 O ATOM 1950 CB ALA A 129 23.762 13.785 -22.520 1.00 0.00 C ATOM 0 H ALA A 129 21.703 14.774 -21.464 1.00 0.00 H new ATOM 0 HA ALA A 129 24.438 15.368 -21.262 1.00 0.00 H new ATOM 0 HB1 ALA A 129 24.730 13.634 -22.998 1.00 0.00 H new ATOM 0 HB2 ALA A 129 23.660 13.097 -21.681 1.00 0.00 H new ATOM 0 HB3 ALA A 129 22.967 13.597 -23.242 1.00 0.00 H new ATOM 1956 N ALA A 130 22.787 16.467 -23.922 1.00 0.00 N ATOM 1957 CA ALA A 130 22.901 17.356 -25.056 1.00 0.00 C ATOM 1958 C ALA A 130 23.307 18.728 -24.588 1.00 0.00 C ATOM 1959 O ALA A 130 24.152 19.377 -25.204 1.00 0.00 O ATOM 1960 CB ALA A 130 21.585 17.492 -25.843 1.00 0.00 C ATOM 0 H ALA A 130 21.849 16.101 -23.757 1.00 0.00 H new ATOM 0 HA ALA A 130 23.651 16.921 -25.716 1.00 0.00 H new ATOM 0 HB1 ALA A 130 21.732 18.172 -26.682 1.00 0.00 H new ATOM 0 HB2 ALA A 130 21.282 16.514 -26.217 1.00 0.00 H new ATOM 0 HB3 ALA A 130 20.808 17.887 -25.188 1.00 0.00 H new ATOM 1966 N GLU A 131 22.705 19.206 -23.478 1.00 0.00 N ATOM 1967 CA GLU A 131 23.030 20.522 -22.971 1.00 0.00 C ATOM 1968 C GLU A 131 24.453 20.530 -22.483 1.00 0.00 C ATOM 1969 O GLU A 131 25.188 21.494 -22.702 1.00 0.00 O ATOM 1970 CB GLU A 131 22.125 20.962 -21.800 1.00 0.00 C ATOM 1971 CG GLU A 131 20.678 21.257 -22.231 1.00 0.00 C ATOM 1972 CD GLU A 131 20.679 22.390 -23.251 1.00 0.00 C ATOM 1973 OE1 GLU A 131 21.320 23.438 -22.971 1.00 0.00 O ATOM 1974 OE2 GLU A 131 20.033 22.222 -24.319 1.00 0.00 O ATOM 0 H GLU A 131 22.006 18.698 -22.936 1.00 0.00 H new ATOM 0 HA GLU A 131 22.878 21.219 -23.795 1.00 0.00 H new ATOM 0 HB2 GLU A 131 22.119 20.180 -21.040 1.00 0.00 H new ATOM 0 HB3 GLU A 131 22.548 21.853 -21.337 1.00 0.00 H new ATOM 0 HG2 GLU A 131 20.225 20.364 -22.662 1.00 0.00 H new ATOM 0 HG3 GLU A 131 20.077 21.532 -21.364 1.00 0.00 H new ATOM 1981 N ALA A 132 24.872 19.447 -21.801 1.00 0.00 N ATOM 1982 CA ALA A 132 26.220 19.373 -21.282 1.00 0.00 C ATOM 1983 C ALA A 132 27.196 19.360 -22.428 1.00 0.00 C ATOM 1984 O ALA A 132 28.241 20.005 -22.369 1.00 0.00 O ATOM 1985 CB ALA A 132 26.465 18.113 -20.434 1.00 0.00 C ATOM 0 H ALA A 132 24.293 18.630 -21.607 1.00 0.00 H new ATOM 0 HA ALA A 132 26.360 20.245 -20.643 1.00 0.00 H new ATOM 0 HB1 ALA A 132 27.493 18.112 -20.072 1.00 0.00 H new ATOM 0 HB2 ALA A 132 25.781 18.107 -19.585 1.00 0.00 H new ATOM 0 HB3 ALA A 132 26.294 17.225 -21.043 1.00 0.00 H new ATOM 1991 N ALA A 133 26.876 18.606 -23.500 1.00 0.00 N ATOM 1992 CA ALA A 133 27.759 18.521 -24.641 1.00 0.00 C ATOM 1993 C ALA A 133 27.864 19.869 -25.296 1.00 0.00 C ATOM 1994 O ALA A 133 28.938 20.259 -25.748 1.00 0.00 O ATOM 1995 CB ALA A 133 27.284 17.509 -25.698 1.00 0.00 C ATOM 0 H ALA A 133 26.019 18.060 -23.583 1.00 0.00 H new ATOM 0 HA ALA A 133 28.723 18.182 -24.262 1.00 0.00 H new ATOM 0 HB1 ALA A 133 27.990 17.492 -26.529 1.00 0.00 H new ATOM 0 HB2 ALA A 133 27.226 16.516 -25.251 1.00 0.00 H new ATOM 0 HB3 ALA A 133 26.299 17.800 -26.064 1.00 0.00 H new ATOM 2001 N GLN A 134 26.740 20.612 -25.382 1.00 0.00 N ATOM 2002 CA GLN A 134 26.768 21.916 -26.001 1.00 0.00 C ATOM 2003 C GLN A 134 27.674 22.808 -25.194 1.00 0.00 C ATOM 2004 O GLN A 134 28.456 23.580 -25.748 1.00 0.00 O ATOM 2005 CB GLN A 134 25.377 22.579 -26.074 1.00 0.00 C ATOM 2006 CG GLN A 134 25.395 23.916 -26.829 1.00 0.00 C ATOM 2007 CD GLN A 134 23.969 24.444 -26.922 1.00 0.00 C ATOM 2008 OE1 GLN A 134 23.020 23.784 -26.511 1.00 0.00 O ATOM 2009 NE2 GLN A 134 23.812 25.671 -27.476 1.00 0.00 N ATOM 0 H GLN A 134 25.827 20.322 -25.032 1.00 0.00 H new ATOM 0 HA GLN A 134 27.124 21.784 -27.023 1.00 0.00 H new ATOM 0 HB2 GLN A 134 24.681 21.899 -26.565 1.00 0.00 H new ATOM 0 HB3 GLN A 134 25.004 22.743 -25.063 1.00 0.00 H new ATOM 0 HG2 GLN A 134 26.031 24.634 -26.311 1.00 0.00 H new ATOM 0 HG3 GLN A 134 25.814 23.781 -27.826 1.00 0.00 H new ATOM 0 HE21 GLN A 134 24.626 26.189 -27.806 1.00 0.00 H new ATOM 0 HE22 GLN A 134 22.880 26.076 -27.563 1.00 0.00 H new ATOM 2018 N GLU A 135 27.582 22.718 -23.849 1.00 0.00 N ATOM 2019 CA GLU A 135 28.413 23.534 -22.996 1.00 0.00 C ATOM 2020 C GLU A 135 29.853 23.118 -23.158 1.00 0.00 C ATOM 2021 O GLU A 135 30.748 23.964 -23.183 1.00 0.00 O ATOM 2022 CB GLU A 135 28.047 23.415 -21.504 1.00 0.00 C ATOM 2023 CG GLU A 135 26.697 24.073 -21.175 1.00 0.00 C ATOM 2024 CD GLU A 135 26.320 23.753 -19.732 1.00 0.00 C ATOM 2025 OE1 GLU A 135 26.950 22.838 -19.137 1.00 0.00 O ATOM 2026 OE2 GLU A 135 25.392 24.423 -19.206 1.00 0.00 O ATOM 0 H GLU A 135 26.945 22.093 -23.355 1.00 0.00 H new ATOM 0 HA GLU A 135 28.253 24.568 -23.300 1.00 0.00 H new ATOM 0 HB2 GLU A 135 28.012 22.362 -21.225 1.00 0.00 H new ATOM 0 HB3 GLU A 135 28.829 23.878 -20.903 1.00 0.00 H new ATOM 0 HG2 GLU A 135 26.761 25.152 -21.316 1.00 0.00 H new ATOM 0 HG3 GLU A 135 25.926 23.708 -21.854 1.00 0.00 H new ATOM 2033 N ALA A 136 30.114 21.790 -23.260 1.00 0.00 N ATOM 2034 CA ALA A 136 31.471 21.313 -23.405 1.00 0.00 C ATOM 2035 C ALA A 136 32.036 21.800 -24.714 1.00 0.00 C ATOM 2036 O ALA A 136 33.194 22.209 -24.783 1.00 0.00 O ATOM 2037 CB ALA A 136 31.569 19.776 -23.386 1.00 0.00 C ATOM 0 H ALA A 136 29.402 21.059 -23.243 1.00 0.00 H new ATOM 0 HA ALA A 136 32.033 21.700 -22.555 1.00 0.00 H new ATOM 0 HB1 ALA A 136 32.611 19.476 -23.499 1.00 0.00 H new ATOM 0 HB2 ALA A 136 31.183 19.399 -22.439 1.00 0.00 H new ATOM 0 HB3 ALA A 136 30.982 19.364 -24.207 1.00 0.00 H new ATOM 2043 N ALA A 137 31.220 21.750 -25.790 1.00 0.00 N ATOM 2044 CA ALA A 137 31.671 22.185 -27.091 1.00 0.00 C ATOM 2045 C ALA A 137 31.964 23.661 -27.048 1.00 0.00 C ATOM 2046 O ALA A 137 32.940 24.125 -27.635 1.00 0.00 O ATOM 2047 CB ALA A 137 30.629 21.933 -28.196 1.00 0.00 C ATOM 0 H ALA A 137 30.258 21.413 -25.764 1.00 0.00 H new ATOM 0 HA ALA A 137 32.563 21.606 -27.329 1.00 0.00 H new ATOM 0 HB1 ALA A 137 31.022 22.279 -29.152 1.00 0.00 H new ATOM 0 HB2 ALA A 137 30.414 20.866 -28.257 1.00 0.00 H new ATOM 0 HB3 ALA A 137 29.713 22.475 -27.962 1.00 0.00 H new