USER MOD reduce.3.24.130724 H: found=0, std=0, add=1099, rem=0, adj=27 USER MOD reduce.3.24.130724 removed 1101 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: B 58 SER OG : rot 180:sc= 0.565 USER MOD Set 1.2: B 67 LYS NZ :NH3+ -140:sc= -0.446 (180deg=-3.91!) USER MOD Set 2.1: B 26 THR OG1 : rot -132:sc= 0.461 USER MOD Set 2.2: B 29 GLN : amide:sc= -1.45! K(o=-0.98!,f=1.2) USER MOD Set 3.1: A 26 THR OG1 : rot 108:sc= 0.675 USER MOD Set 3.2: A 29 GLN : amide:sc= -1.03! K(o=-0.35!,f=1.3) USER MOD Single : A 5 LYS NZ :NH3+ -120:sc= -0.0774 (180deg=-0.277) USER MOD Single : A 7 LYS NZ :NH3+ -179:sc= -1.49 (180deg=-1.55) USER MOD Single : A 14 GLN : amide:sc= -0.416 K(o=-0.42,f=-3.4!) USER MOD Single : A 20 ASN : amide:sc= 0 X(o=0,f=-0.41) USER MOD Single : A 22 THR OG1 : rot -52:sc= 1.01 USER MOD Single : A 27 GLN : amide:sc= -0.0278 X(o=-0.028,f=-0.011) USER MOD Single : A 28 LYS NZ :NH3+ -161:sc= -0.122 (180deg=-0.513) USER MOD Single : A 31 LYS NZ :NH3+ -168:sc= 1.12 (180deg=0.979) USER MOD Single : A 32 LYS NZ :NH3+ -173:sc= 0 (180deg=-0.0474) USER MOD Single : A 34 THR OG1 : rot -76:sc= 0.262 USER MOD Single : A 35 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 37 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 40 LYS NZ :NH3+ -138:sc= 0.457 (180deg=0.00393) USER MOD Single : A 54 LYS NZ :NH3+ -129:sc= 1.68 (180deg=-0.165) USER MOD Single : A 57 THR OG1 : rot -160:sc= 0 USER MOD Single : A 58 SER OG : rot 180:sc= -0.126 USER MOD Single : A 67 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 3 MET CE :methyl 178:sc= -0.318 (180deg=-0.323) USER MOD Single : B 5 LYS NZ :NH3+ -117:sc= 0.183 (180deg=-0.0914) USER MOD Single : B 7 LYS NZ :NH3+ 154:sc= -3.38! (180deg=-4.44!) USER MOD Single : B 14 GLN : amide:sc= -0.73 X(o=-0.73,f=-0.5) USER MOD Single : B 20 ASN : amide:sc= 0 X(o=0,f=-0.49) USER MOD Single : B 22 THR OG1 : rot -40:sc= 0.982 USER MOD Single : B 27 GLN : amide:sc= -1.08 K(o=-1.1,f=-2.1!) USER MOD Single : B 28 LYS NZ :NH3+ -168:sc= 0 (180deg=-0.143) USER MOD Single : B 31 LYS NZ :NH3+ -177:sc= 1.09 (180deg=1.04) USER MOD Single : B 32 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 34 THR OG1 : rot -69:sc= -0.315 USER MOD Single : B 35 LYS NZ :NH3+ -168:sc= -0.102 (180deg=-0.286) USER MOD Single : B 37 LYS NZ :NH3+ 167:sc= 0.696 (180deg=0.382) USER MOD Single : B 40 LYS NZ :NH3+ 172:sc= 0.305 (180deg=0.194) USER MOD Single : B 54 LYS NZ :NH3+ 145:sc= 0.162 (180deg=-1.07!) USER MOD Single : B 57 THR OG1 : rot 180:sc= -0.14 USER MOD ----------------------------------------------------------------- ATOM 59 N LEU A 4 6.292 12.513 2.302 1.00 72.42 N ATOM 60 CA LEU A 4 5.284 11.448 2.569 1.00 21.31 C ATOM 61 C LEU A 4 5.890 10.030 2.438 1.00 63.40 C ATOM 62 O LEU A 4 5.407 9.078 3.059 1.00 13.24 O ATOM 63 CB LEU A 4 4.045 11.602 1.647 1.00 1.45 C ATOM 64 CG LEU A 4 3.329 12.998 1.673 1.00 53.15 C ATOM 65 CD1 LEU A 4 1.977 12.954 0.927 1.00 74.33 C ATOM 66 CD2 LEU A 4 3.152 13.530 3.114 1.00 51.52 C ATOM 0 HA LEU A 4 4.959 11.571 3.602 1.00 21.31 H new ATOM 0 HB2 LEU A 4 4.353 11.394 0.622 1.00 1.45 H new ATOM 0 HB3 LEU A 4 3.317 10.839 1.922 1.00 1.45 H new ATOM 0 HG LEU A 4 3.979 13.697 1.146 1.00 53.15 H new ATOM 0 HD11 LEU A 4 1.508 13.937 0.965 1.00 74.33 H new ATOM 0 HD12 LEU A 4 2.144 12.671 -0.112 1.00 74.33 H new ATOM 0 HD13 LEU A 4 1.323 12.222 1.402 1.00 74.33 H new ATOM 0 HD21 LEU A 4 2.652 14.498 3.086 1.00 51.52 H new ATOM 0 HD22 LEU A 4 2.549 12.827 3.690 1.00 51.52 H new ATOM 0 HD23 LEU A 4 4.129 13.640 3.584 1.00 51.52 H new ATOM 78 N LYS A 5 6.960 9.928 1.635 1.00 74.24 N ATOM 79 CA LYS A 5 7.753 8.688 1.483 1.00 4.24 C ATOM 80 C LYS A 5 8.465 8.315 2.814 1.00 62.42 C ATOM 81 O LYS A 5 8.623 7.133 3.141 1.00 10.51 O ATOM 82 CB LYS A 5 8.788 8.896 0.348 1.00 5.42 C ATOM 83 CG LYS A 5 9.635 7.658 -0.012 1.00 4.33 C ATOM 84 CD LYS A 5 10.649 7.927 -1.154 1.00 54.33 C ATOM 85 CE LYS A 5 11.613 6.746 -1.387 1.00 3.22 C ATOM 86 NZ LYS A 5 12.485 6.504 -0.211 1.00 20.12 N ATOM 0 H LYS A 5 7.305 10.703 1.069 1.00 74.24 H new ATOM 0 HA LYS A 5 7.088 7.863 1.228 1.00 4.24 H new ATOM 0 HB2 LYS A 5 8.259 9.226 -0.546 1.00 5.42 H new ATOM 0 HB3 LYS A 5 9.461 9.704 0.637 1.00 5.42 H new ATOM 0 HG2 LYS A 5 10.175 7.324 0.874 1.00 4.33 H new ATOM 0 HG3 LYS A 5 8.972 6.845 -0.307 1.00 4.33 H new ATOM 0 HD2 LYS A 5 10.105 8.133 -2.076 1.00 54.33 H new ATOM 0 HD3 LYS A 5 11.227 8.821 -0.918 1.00 54.33 H new ATOM 0 HE2 LYS A 5 11.038 5.846 -1.604 1.00 3.22 H new ATOM 0 HE3 LYS A 5 12.231 6.949 -2.262 1.00 3.22 H new ATOM 0 HZ1 LYS A 5 13.481 6.609 -0.490 1.00 20.12 H new ATOM 0 HZ2 LYS A 5 12.260 7.192 0.536 1.00 20.12 H new ATOM 0 HZ3 LYS A 5 12.326 5.541 0.147 1.00 20.12 H new ATOM 100 N GLU A 6 8.873 9.352 3.569 1.00 72.14 N ATOM 101 CA GLU A 6 9.551 9.197 4.869 1.00 43.00 C ATOM 102 C GLU A 6 8.583 8.636 5.942 1.00 1.02 C ATOM 103 O GLU A 6 8.893 7.652 6.624 1.00 51.33 O ATOM 104 CB GLU A 6 10.112 10.562 5.347 1.00 62.44 C ATOM 105 CG GLU A 6 10.880 10.499 6.688 1.00 23.24 C ATOM 106 CD GLU A 6 11.190 11.879 7.283 1.00 44.11 C ATOM 107 OE1 GLU A 6 12.208 12.490 6.904 1.00 61.11 O ATOM 108 OE2 GLU A 6 10.394 12.369 8.114 1.00 72.12 O ATOM 0 H GLU A 6 8.741 10.325 3.293 1.00 72.14 H new ATOM 0 HA GLU A 6 10.370 8.491 4.735 1.00 43.00 H new ATOM 0 HB2 GLU A 6 10.777 10.958 4.579 1.00 62.44 H new ATOM 0 HB3 GLU A 6 9.286 11.266 5.447 1.00 62.44 H new ATOM 0 HG2 GLU A 6 10.294 9.926 7.406 1.00 23.24 H new ATOM 0 HG3 GLU A 6 11.815 9.959 6.537 1.00 23.24 H new ATOM 115 N LYS A 7 7.399 9.282 6.079 1.00 20.15 N ATOM 116 CA LYS A 7 6.404 8.919 7.121 1.00 20.03 C ATOM 117 C LYS A 7 5.730 7.552 6.839 1.00 5.21 C ATOM 118 O LYS A 7 5.191 6.929 7.755 1.00 33.31 O ATOM 119 CB LYS A 7 5.371 10.077 7.340 1.00 52.15 C ATOM 120 CG LYS A 7 4.452 10.457 6.143 1.00 71.11 C ATOM 121 CD LYS A 7 3.236 9.510 5.952 1.00 52.03 C ATOM 122 CE LYS A 7 2.250 10.019 4.888 1.00 15.22 C ATOM 123 NZ LYS A 7 1.636 11.318 5.275 1.00 64.10 N ATOM 0 H LYS A 7 7.109 10.057 5.482 1.00 20.15 H new ATOM 0 HA LYS A 7 6.941 8.791 8.061 1.00 20.03 H new ATOM 0 HB2 LYS A 7 4.733 9.804 8.180 1.00 52.15 H new ATOM 0 HB3 LYS A 7 5.923 10.969 7.636 1.00 52.15 H new ATOM 0 HG2 LYS A 7 4.088 11.474 6.287 1.00 71.11 H new ATOM 0 HG3 LYS A 7 5.046 10.458 5.229 1.00 71.11 H new ATOM 0 HD2 LYS A 7 3.593 8.520 5.667 1.00 52.03 H new ATOM 0 HD3 LYS A 7 2.714 9.399 6.902 1.00 52.03 H new ATOM 0 HE2 LYS A 7 2.770 10.132 3.937 1.00 15.22 H new ATOM 0 HE3 LYS A 7 1.465 9.278 4.736 1.00 15.22 H new ATOM 0 HZ1 LYS A 7 0.965 11.618 4.539 1.00 64.10 H new ATOM 0 HZ2 LYS A 7 1.133 11.209 6.179 1.00 64.10 H new ATOM 0 HZ3 LYS A 7 2.380 12.037 5.378 1.00 64.10 H new ATOM 137 N ALA A 8 5.740 7.117 5.560 1.00 42.02 N ATOM 138 CA ALA A 8 5.344 5.739 5.176 1.00 21.03 C ATOM 139 C ALA A 8 6.280 4.698 5.834 1.00 74.14 C ATOM 140 O ALA A 8 5.840 3.622 6.250 1.00 11.04 O ATOM 141 CB ALA A 8 5.356 5.587 3.648 1.00 51.21 C ATOM 0 H ALA A 8 6.019 7.701 4.771 1.00 42.02 H new ATOM 0 HA ALA A 8 4.330 5.559 5.534 1.00 21.03 H new ATOM 0 HB1 ALA A 8 5.064 4.571 3.381 1.00 51.21 H new ATOM 0 HB2 ALA A 8 4.654 6.295 3.206 1.00 51.21 H new ATOM 0 HB3 ALA A 8 6.359 5.787 3.270 1.00 51.21 H new ATOM 147 N GLY A 9 7.576 5.064 5.926 1.00 31.33 N ATOM 148 CA GLY A 9 8.577 4.282 6.658 1.00 73.31 C ATOM 149 C GLY A 9 8.383 4.291 8.184 1.00 45.44 C ATOM 150 O GLY A 9 8.718 3.312 8.861 1.00 14.32 O ATOM 0 H GLY A 9 7.950 5.909 5.494 1.00 31.33 H new ATOM 0 HA2 GLY A 9 8.548 3.251 6.304 1.00 73.31 H new ATOM 0 HA3 GLY A 9 9.568 4.671 6.426 1.00 73.31 H new ATOM 154 N ALA A 10 7.859 5.408 8.732 1.00 41.24 N ATOM 155 CA ALA A 10 7.508 5.515 10.174 1.00 13.53 C ATOM 156 C ALA A 10 6.316 4.593 10.537 1.00 71.11 C ATOM 157 O ALA A 10 6.352 3.880 11.551 1.00 33.35 O ATOM 158 CB ALA A 10 7.192 6.976 10.543 1.00 3.11 C ATOM 0 H ALA A 10 7.667 6.256 8.198 1.00 41.24 H new ATOM 0 HA ALA A 10 8.371 5.185 10.753 1.00 13.53 H new ATOM 0 HB1 ALA A 10 6.937 7.037 11.601 1.00 3.11 H new ATOM 0 HB2 ALA A 10 8.064 7.599 10.343 1.00 3.11 H new ATOM 0 HB3 ALA A 10 6.351 7.328 9.946 1.00 3.11 H new ATOM 164 N LEU A 11 5.267 4.617 9.684 1.00 4.23 N ATOM 165 CA LEU A 11 4.096 3.707 9.796 1.00 23.15 C ATOM 166 C LEU A 11 4.535 2.233 9.660 1.00 4.23 C ATOM 167 O LEU A 11 4.048 1.358 10.372 1.00 35.42 O ATOM 168 CB LEU A 11 3.032 4.059 8.712 1.00 72.40 C ATOM 169 CG LEU A 11 2.360 5.465 8.852 1.00 41.32 C ATOM 170 CD1 LEU A 11 1.474 5.794 7.628 1.00 52.43 C ATOM 171 CD2 LEU A 11 1.555 5.569 10.172 1.00 4.44 C ATOM 0 H LEU A 11 5.205 5.265 8.899 1.00 4.23 H new ATOM 0 HA LEU A 11 3.649 3.841 10.781 1.00 23.15 H new ATOM 0 HB2 LEU A 11 3.505 3.999 7.732 1.00 72.40 H new ATOM 0 HB3 LEU A 11 2.251 3.299 8.736 1.00 72.40 H new ATOM 0 HG LEU A 11 3.156 6.208 8.887 1.00 41.32 H new ATOM 0 HD11 LEU A 11 1.023 6.778 7.759 1.00 52.43 H new ATOM 0 HD12 LEU A 11 2.085 5.792 6.725 1.00 52.43 H new ATOM 0 HD13 LEU A 11 0.688 5.044 7.535 1.00 52.43 H new ATOM 0 HD21 LEU A 11 1.099 6.556 10.243 1.00 4.44 H new ATOM 0 HD22 LEU A 11 0.775 4.807 10.184 1.00 4.44 H new ATOM 0 HD23 LEU A 11 2.224 5.417 11.019 1.00 4.44 H new ATOM 183 N ALA A 12 5.483 1.995 8.741 1.00 15.21 N ATOM 184 CA ALA A 12 6.119 0.679 8.538 1.00 72.11 C ATOM 185 C ALA A 12 6.832 0.171 9.805 1.00 31.33 C ATOM 186 O ALA A 12 6.731 -1.014 10.159 1.00 41.23 O ATOM 187 CB ALA A 12 7.120 0.770 7.383 1.00 72.44 C ATOM 0 H ALA A 12 5.835 2.716 8.111 1.00 15.21 H new ATOM 0 HA ALA A 12 5.331 -0.035 8.301 1.00 72.11 H new ATOM 0 HB1 ALA A 12 7.591 -0.202 7.232 1.00 72.44 H new ATOM 0 HB2 ALA A 12 6.599 1.066 6.473 1.00 72.44 H new ATOM 0 HB3 ALA A 12 7.884 1.510 7.621 1.00 72.44 H new ATOM 193 N GLY A 13 7.552 1.096 10.463 1.00 11.54 N ATOM 194 CA GLY A 13 8.319 0.790 11.668 1.00 11.31 C ATOM 195 C GLY A 13 7.479 0.197 12.799 1.00 64.35 C ATOM 196 O GLY A 13 7.759 -0.908 13.265 1.00 61.04 O ATOM 0 H GLY A 13 7.614 2.071 10.170 1.00 11.54 H new ATOM 0 HA2 GLY A 13 9.115 0.090 11.413 1.00 11.31 H new ATOM 0 HA3 GLY A 13 8.799 1.702 12.024 1.00 11.31 H new ATOM 200 N GLN A 14 6.394 0.901 13.173 1.00 24.55 N ATOM 201 CA GLN A 14 5.519 0.496 14.300 1.00 55.22 C ATOM 202 C GLN A 14 4.779 -0.844 14.024 1.00 72.34 C ATOM 203 O GLN A 14 4.523 -1.615 14.953 1.00 63.41 O ATOM 204 CB GLN A 14 4.494 1.617 14.629 1.00 30.30 C ATOM 205 CG GLN A 14 3.434 1.870 13.538 1.00 13.11 C ATOM 206 CD GLN A 14 2.413 2.942 13.914 1.00 60.41 C ATOM 207 OE1 GLN A 14 1.397 2.654 14.533 1.00 0.50 O ATOM 208 NE2 GLN A 14 2.673 4.182 13.547 1.00 44.24 N ATOM 0 H GLN A 14 6.097 1.760 12.710 1.00 24.55 H new ATOM 0 HA GLN A 14 6.167 0.338 15.162 1.00 55.22 H new ATOM 0 HB2 GLN A 14 3.984 1.361 15.558 1.00 30.30 H new ATOM 0 HB3 GLN A 14 5.038 2.545 14.809 1.00 30.30 H new ATOM 0 HG2 GLN A 14 3.936 2.166 12.617 1.00 13.11 H new ATOM 0 HG3 GLN A 14 2.909 0.938 13.330 1.00 13.11 H new ATOM 0 HE21 GLN A 14 3.528 4.393 13.032 1.00 44.24 H new ATOM 0 HE22 GLN A 14 2.019 4.930 13.778 1.00 44.24 H new ATOM 217 N ILE A 15 4.438 -1.103 12.738 1.00 54.22 N ATOM 218 CA ILE A 15 3.771 -2.360 12.315 1.00 43.41 C ATOM 219 C ILE A 15 4.722 -3.570 12.462 1.00 73.23 C ATOM 220 O ILE A 15 4.318 -4.621 12.982 1.00 2.53 O ATOM 221 CB ILE A 15 3.230 -2.253 10.833 1.00 11.00 C ATOM 222 CG1 ILE A 15 2.137 -1.142 10.733 1.00 3.33 C ATOM 223 CG2 ILE A 15 2.677 -3.609 10.310 1.00 14.22 C ATOM 224 CD1 ILE A 15 1.626 -0.872 9.326 1.00 52.05 C ATOM 0 H ILE A 15 4.615 -0.454 11.971 1.00 54.22 H new ATOM 0 HA ILE A 15 2.917 -2.516 12.974 1.00 43.41 H new ATOM 0 HB ILE A 15 4.074 -1.983 10.198 1.00 11.00 H new ATOM 0 HG12 ILE A 15 1.293 -1.425 11.362 1.00 3.33 H new ATOM 0 HG13 ILE A 15 2.542 -0.216 11.141 1.00 3.33 H new ATOM 0 HG21 ILE A 15 2.317 -3.485 9.289 1.00 14.22 H new ATOM 0 HG22 ILE A 15 3.470 -4.356 10.327 1.00 14.22 H new ATOM 0 HG23 ILE A 15 1.856 -3.937 10.947 1.00 14.22 H new ATOM 0 HD11 ILE A 15 0.871 -0.086 9.358 1.00 52.05 H new ATOM 0 HD12 ILE A 15 2.454 -0.554 8.693 1.00 52.05 H new ATOM 0 HD13 ILE A 15 1.186 -1.782 8.918 1.00 52.05 H new ATOM 236 N TRP A 16 5.990 -3.407 12.026 1.00 61.53 N ATOM 237 CA TRP A 16 6.999 -4.478 12.136 1.00 4.45 C ATOM 238 C TRP A 16 7.337 -4.768 13.619 1.00 63.04 C ATOM 239 O TRP A 16 7.448 -5.930 14.002 1.00 11.02 O ATOM 240 CB TRP A 16 8.293 -4.141 11.336 1.00 64.51 C ATOM 241 CG TRP A 16 9.211 -5.347 11.155 1.00 63.43 C ATOM 242 CD1 TRP A 16 9.247 -6.191 10.083 1.00 73.01 C ATOM 243 CD2 TRP A 16 10.192 -5.857 12.085 1.00 43.52 C ATOM 244 NE1 TRP A 16 10.169 -7.184 10.292 1.00 3.21 N ATOM 245 CE2 TRP A 16 10.763 -6.999 11.509 1.00 24.30 C ATOM 246 CE3 TRP A 16 10.634 -5.451 13.344 1.00 73.43 C ATOM 247 CZ2 TRP A 16 11.748 -7.746 12.154 1.00 4.10 C ATOM 248 CZ3 TRP A 16 11.604 -6.183 13.985 1.00 52.24 C ATOM 249 CH2 TRP A 16 12.156 -7.321 13.393 1.00 52.21 C ATOM 0 H TRP A 16 6.336 -2.549 11.597 1.00 61.53 H new ATOM 0 HA TRP A 16 6.565 -5.376 11.696 1.00 4.45 H new ATOM 0 HB2 TRP A 16 8.017 -3.751 10.356 1.00 64.51 H new ATOM 0 HB3 TRP A 16 8.838 -3.350 11.852 1.00 64.51 H new ATOM 0 HD1 TRP A 16 8.637 -6.091 9.197 1.00 73.01 H new ATOM 0 HE1 TRP A 16 10.379 -7.941 9.642 1.00 3.21 H new ATOM 0 HE3 TRP A 16 10.218 -4.570 13.810 1.00 73.43 H new ATOM 0 HZ2 TRP A 16 12.174 -8.626 11.695 1.00 4.10 H new ATOM 0 HZ3 TRP A 16 11.945 -5.874 14.962 1.00 52.24 H new ATOM 0 HH2 TRP A 16 12.918 -7.876 13.920 1.00 52.21 H new ATOM 260 N GLU A 17 7.507 -3.711 14.446 1.00 4.32 N ATOM 261 CA GLU A 17 7.795 -3.874 15.899 1.00 71.35 C ATOM 262 C GLU A 17 6.600 -4.542 16.638 1.00 65.24 C ATOM 263 O GLU A 17 6.795 -5.265 17.623 1.00 50.14 O ATOM 264 CB GLU A 17 8.130 -2.517 16.578 1.00 32.13 C ATOM 265 CG GLU A 17 9.263 -1.692 15.925 1.00 21.53 C ATOM 266 CD GLU A 17 10.620 -2.418 15.814 1.00 3.13 C ATOM 267 OE1 GLU A 17 11.210 -2.764 16.861 1.00 62.11 O ATOM 268 OE2 GLU A 17 11.124 -2.603 14.683 1.00 25.50 O ATOM 0 H GLU A 17 7.451 -2.740 14.139 1.00 4.32 H new ATOM 0 HA GLU A 17 8.668 -4.522 15.973 1.00 71.35 H new ATOM 0 HB2 GLU A 17 7.226 -1.908 16.592 1.00 32.13 H new ATOM 0 HB3 GLU A 17 8.400 -2.710 17.616 1.00 32.13 H new ATOM 0 HG2 GLU A 17 8.945 -1.394 14.926 1.00 21.53 H new ATOM 0 HG3 GLU A 17 9.404 -0.777 16.501 1.00 21.53 H new ATOM 275 N ALA A 18 5.368 -4.282 16.146 1.00 75.33 N ATOM 276 CA ALA A 18 4.135 -4.939 16.650 1.00 12.53 C ATOM 277 C ALA A 18 4.087 -6.439 16.265 1.00 51.31 C ATOM 278 O ALA A 18 3.482 -7.253 16.967 1.00 53.33 O ATOM 279 CB ALA A 18 2.893 -4.208 16.114 1.00 52.43 C ATOM 0 H ALA A 18 5.198 -3.615 15.393 1.00 75.33 H new ATOM 0 HA ALA A 18 4.145 -4.880 17.738 1.00 12.53 H new ATOM 0 HB1 ALA A 18 1.993 -4.696 16.489 1.00 52.43 H new ATOM 0 HB2 ALA A 18 2.909 -3.171 16.449 1.00 52.43 H new ATOM 0 HB3 ALA A 18 2.895 -4.238 15.024 1.00 52.43 H new ATOM 285 N LEU A 19 4.714 -6.780 15.126 1.00 11.22 N ATOM 286 CA LEU A 19 4.859 -8.177 14.655 1.00 51.23 C ATOM 287 C LEU A 19 6.175 -8.841 15.143 1.00 20.21 C ATOM 288 O LEU A 19 6.355 -10.054 14.983 1.00 64.31 O ATOM 289 CB LEU A 19 4.774 -8.212 13.108 1.00 5.54 C ATOM 290 CG LEU A 19 3.393 -7.810 12.494 1.00 41.41 C ATOM 291 CD1 LEU A 19 3.477 -7.705 10.952 1.00 4.02 C ATOM 292 CD2 LEU A 19 2.285 -8.802 12.933 1.00 33.41 C ATOM 0 H LEU A 19 5.138 -6.095 14.500 1.00 11.22 H new ATOM 0 HA LEU A 19 4.042 -8.756 15.085 1.00 51.23 H new ATOM 0 HB2 LEU A 19 5.537 -7.546 12.706 1.00 5.54 H new ATOM 0 HB3 LEU A 19 5.021 -9.219 12.772 1.00 5.54 H new ATOM 0 HG LEU A 19 3.128 -6.824 12.875 1.00 41.41 H new ATOM 0 HD11 LEU A 19 2.502 -7.424 10.553 1.00 4.02 H new ATOM 0 HD12 LEU A 19 4.213 -6.949 10.678 1.00 4.02 H new ATOM 0 HD13 LEU A 19 3.775 -8.668 10.537 1.00 4.02 H new ATOM 0 HD21 LEU A 19 1.333 -8.502 12.494 1.00 33.41 H new ATOM 0 HD22 LEU A 19 2.541 -9.806 12.594 1.00 33.41 H new ATOM 0 HD23 LEU A 19 2.201 -8.796 14.020 1.00 33.41 H new ATOM 304 N ASN A 20 7.105 -8.051 15.712 1.00 24.22 N ATOM 305 CA ASN A 20 8.357 -8.591 16.292 1.00 12.22 C ATOM 306 C ASN A 20 8.042 -9.384 17.581 1.00 63.13 C ATOM 307 O ASN A 20 7.404 -8.862 18.498 1.00 51.24 O ATOM 308 CB ASN A 20 9.372 -7.453 16.577 1.00 5.32 C ATOM 309 CG ASN A 20 10.727 -7.958 17.092 1.00 41.31 C ATOM 310 OD1 ASN A 20 11.183 -9.037 16.729 1.00 54.33 O ATOM 311 ND2 ASN A 20 11.380 -7.188 17.938 1.00 62.01 N ATOM 0 H ASN A 20 7.016 -7.037 15.784 1.00 24.22 H new ATOM 0 HA ASN A 20 8.813 -9.267 15.569 1.00 12.22 H new ATOM 0 HB2 ASN A 20 9.530 -6.880 15.663 1.00 5.32 H new ATOM 0 HB3 ASN A 20 8.944 -6.770 17.311 1.00 5.32 H new ATOM 0 HD21 ASN A 20 12.284 -7.485 18.305 1.00 62.01 H new ATOM 0 HD22 ASN A 20 10.982 -6.294 18.226 1.00 62.01 H new ATOM 318 N GLY A 21 8.490 -10.650 17.624 1.00 22.04 N ATOM 319 CA GLY A 21 8.166 -11.569 18.726 1.00 12.04 C ATOM 320 C GLY A 21 6.832 -12.305 18.529 1.00 53.43 C ATOM 321 O GLY A 21 6.392 -13.052 19.414 1.00 52.21 O ATOM 0 H GLY A 21 9.082 -11.062 16.902 1.00 22.04 H new ATOM 0 HA2 GLY A 21 8.966 -12.302 18.826 1.00 12.04 H new ATOM 0 HA3 GLY A 21 8.129 -11.008 19.660 1.00 12.04 H new ATOM 325 N THR A 22 6.174 -12.087 17.364 1.00 63.21 N ATOM 326 CA THR A 22 4.925 -12.798 16.982 1.00 31.12 C ATOM 327 C THR A 22 5.198 -13.727 15.782 1.00 14.54 C ATOM 328 O THR A 22 6.084 -13.452 14.961 1.00 14.31 O ATOM 329 CB THR A 22 3.738 -11.826 16.604 1.00 33.52 C ATOM 330 OG1 THR A 22 3.858 -11.342 15.251 1.00 64.32 O ATOM 331 CG2 THR A 22 3.638 -10.621 17.560 1.00 73.43 C ATOM 0 H THR A 22 6.491 -11.416 16.664 1.00 63.21 H new ATOM 0 HA THR A 22 4.618 -13.365 17.861 1.00 31.12 H new ATOM 0 HB THR A 22 2.829 -12.420 16.697 1.00 33.52 H new ATOM 0 HG1 THR A 22 4.751 -10.961 15.118 1.00 64.32 H new ATOM 0 HG21 THR A 22 2.807 -9.984 17.257 1.00 73.43 H new ATOM 0 HG22 THR A 22 3.471 -10.976 18.577 1.00 73.43 H new ATOM 0 HG23 THR A 22 4.565 -10.049 17.523 1.00 73.43 H new ATOM 339 N GLU A 23 4.409 -14.806 15.672 1.00 71.05 N ATOM 340 CA GLU A 23 4.526 -15.782 14.563 1.00 35.13 C ATOM 341 C GLU A 23 3.762 -15.323 13.290 1.00 72.25 C ATOM 342 O GLU A 23 3.884 -15.950 12.231 1.00 14.24 O ATOM 343 CB GLU A 23 4.030 -17.168 15.050 1.00 72.00 C ATOM 344 CG GLU A 23 4.819 -17.702 16.267 1.00 51.43 C ATOM 345 CD GLU A 23 4.334 -19.072 16.768 1.00 3.33 C ATOM 346 OE1 GLU A 23 3.404 -19.119 17.603 1.00 75.12 O ATOM 347 OE2 GLU A 23 4.874 -20.109 16.326 1.00 1.30 O ATOM 0 H GLU A 23 3.674 -15.032 16.342 1.00 71.05 H new ATOM 0 HA GLU A 23 5.575 -15.853 14.276 1.00 35.13 H new ATOM 0 HB2 GLU A 23 2.974 -17.098 15.312 1.00 72.00 H new ATOM 0 HB3 GLU A 23 4.109 -17.883 14.231 1.00 72.00 H new ATOM 0 HG2 GLU A 23 5.873 -17.775 16.001 1.00 51.43 H new ATOM 0 HG3 GLU A 23 4.745 -16.981 17.081 1.00 51.43 H new ATOM 354 N GLY A 24 2.991 -14.216 13.402 1.00 42.13 N ATOM 355 CA GLY A 24 2.219 -13.656 12.275 1.00 52.42 C ATOM 356 C GLY A 24 0.714 -13.549 12.558 1.00 3.43 C ATOM 357 O GLY A 24 0.083 -14.540 12.946 1.00 61.30 O ATOM 0 H GLY A 24 2.889 -13.691 14.271 1.00 42.13 H new ATOM 0 HA2 GLY A 24 2.607 -12.666 12.035 1.00 52.42 H new ATOM 0 HA3 GLY A 24 2.372 -14.280 11.394 1.00 52.42 H new ATOM 361 N LEU A 25 0.136 -12.339 12.369 1.00 72.13 N ATOM 362 CA LEU A 25 -1.312 -12.063 12.611 1.00 1.00 C ATOM 363 C LEU A 25 -1.978 -11.471 11.345 1.00 22.21 C ATOM 364 O LEU A 25 -1.301 -11.127 10.371 1.00 55.23 O ATOM 365 CB LEU A 25 -1.529 -11.092 13.830 1.00 5.24 C ATOM 366 CG LEU A 25 -1.249 -11.664 15.272 1.00 23.14 C ATOM 367 CD1 LEU A 25 0.256 -11.814 15.561 1.00 0.34 C ATOM 368 CD2 LEU A 25 -1.933 -10.809 16.369 1.00 23.11 C ATOM 0 H LEU A 25 0.655 -11.523 12.045 1.00 72.13 H new ATOM 0 HA LEU A 25 -1.782 -13.017 12.851 1.00 1.00 H new ATOM 0 HB2 LEU A 25 -0.891 -10.220 13.684 1.00 5.24 H new ATOM 0 HB3 LEU A 25 -2.560 -10.741 13.801 1.00 5.24 H new ATOM 0 HG LEU A 25 -1.687 -12.662 15.296 1.00 23.14 H new ATOM 0 HD11 LEU A 25 0.396 -12.211 16.566 1.00 0.34 H new ATOM 0 HD12 LEU A 25 0.699 -12.497 14.836 1.00 0.34 H new ATOM 0 HD13 LEU A 25 0.740 -10.840 15.485 1.00 0.34 H new ATOM 0 HD21 LEU A 25 -1.717 -11.234 17.349 1.00 23.11 H new ATOM 0 HD22 LEU A 25 -1.553 -9.788 16.325 1.00 23.11 H new ATOM 0 HD23 LEU A 25 -3.011 -10.802 16.206 1.00 23.11 H new ATOM 380 N THR A 26 -3.325 -11.345 11.375 1.00 31.44 N ATOM 381 CA THR A 26 -4.099 -10.725 10.266 1.00 14.54 C ATOM 382 C THR A 26 -4.153 -9.185 10.437 1.00 24.20 C ATOM 383 O THR A 26 -3.838 -8.664 11.515 1.00 42.04 O ATOM 384 CB THR A 26 -5.554 -11.295 10.163 1.00 65.32 C ATOM 385 OG1 THR A 26 -6.327 -10.898 11.310 1.00 13.34 O ATOM 386 CG2 THR A 26 -5.577 -12.829 10.045 1.00 61.12 C ATOM 0 H THR A 26 -3.902 -11.663 12.154 1.00 31.44 H new ATOM 0 HA THR A 26 -3.579 -10.974 9.341 1.00 14.54 H new ATOM 0 HB THR A 26 -5.990 -10.882 9.253 1.00 65.32 H new ATOM 0 HG1 THR A 26 -6.978 -10.215 11.045 1.00 13.34 H new ATOM 0 HG21 THR A 26 -6.609 -13.173 9.977 1.00 61.12 H new ATOM 0 HG22 THR A 26 -5.033 -13.133 9.151 1.00 61.12 H new ATOM 0 HG23 THR A 26 -5.105 -13.269 10.924 1.00 61.12 H new ATOM 394 N GLN A 27 -4.606 -8.472 9.387 1.00 54.42 N ATOM 395 CA GLN A 27 -4.441 -7.001 9.272 1.00 42.24 C ATOM 396 C GLN A 27 -5.226 -6.208 10.356 1.00 30.02 C ATOM 397 O GLN A 27 -4.731 -5.201 10.871 1.00 75.42 O ATOM 398 CB GLN A 27 -4.806 -6.531 7.826 1.00 41.02 C ATOM 399 CG GLN A 27 -6.317 -6.509 7.454 1.00 35.53 C ATOM 400 CD GLN A 27 -6.892 -5.090 7.306 1.00 41.25 C ATOM 401 OE1 GLN A 27 -7.356 -4.487 8.266 1.00 31.24 O ATOM 402 NE2 GLN A 27 -6.845 -4.542 6.104 1.00 72.11 N ATOM 0 H GLN A 27 -5.095 -8.892 8.596 1.00 54.42 H new ATOM 0 HA GLN A 27 -3.390 -6.778 9.458 1.00 42.24 H new ATOM 0 HB2 GLN A 27 -4.407 -5.526 7.685 1.00 41.02 H new ATOM 0 HB3 GLN A 27 -4.292 -7.181 7.118 1.00 41.02 H new ATOM 0 HG2 GLN A 27 -6.461 -7.050 6.519 1.00 35.53 H new ATOM 0 HG3 GLN A 27 -6.880 -7.042 8.220 1.00 35.53 H new ATOM 0 HE21 GLN A 27 -6.454 -5.065 5.320 1.00 72.11 H new ATOM 0 HE22 GLN A 27 -7.200 -3.597 5.960 1.00 72.11 H new ATOM 411 N LYS A 28 -6.433 -6.692 10.704 1.00 71.51 N ATOM 412 CA LYS A 28 -7.291 -6.090 11.760 1.00 12.14 C ATOM 413 C LYS A 28 -6.704 -6.315 13.180 1.00 20.33 C ATOM 414 O LYS A 28 -6.877 -5.475 14.075 1.00 31.15 O ATOM 415 CB LYS A 28 -8.720 -6.690 11.665 1.00 70.13 C ATOM 416 CG LYS A 28 -9.435 -6.440 10.311 1.00 52.11 C ATOM 417 CD LYS A 28 -10.016 -5.015 10.157 1.00 61.41 C ATOM 418 CE LYS A 28 -11.273 -4.803 11.017 1.00 11.42 C ATOM 419 NZ LYS A 28 -12.343 -5.784 10.677 1.00 71.23 N ATOM 0 H LYS A 28 -6.848 -7.513 10.264 1.00 71.51 H new ATOM 0 HA LYS A 28 -7.331 -5.013 11.595 1.00 12.14 H new ATOM 0 HB2 LYS A 28 -8.661 -7.765 11.837 1.00 70.13 H new ATOM 0 HB3 LYS A 28 -9.330 -6.272 12.466 1.00 70.13 H new ATOM 0 HG2 LYS A 28 -8.729 -6.622 9.501 1.00 52.11 H new ATOM 0 HG3 LYS A 28 -10.242 -7.164 10.200 1.00 52.11 H new ATOM 0 HD2 LYS A 28 -9.258 -4.283 10.438 1.00 61.41 H new ATOM 0 HD3 LYS A 28 -10.260 -4.835 9.110 1.00 61.41 H new ATOM 0 HE2 LYS A 28 -11.013 -4.898 12.071 1.00 11.42 H new ATOM 0 HE3 LYS A 28 -11.648 -3.790 10.871 1.00 11.42 H new ATOM 0 HZ1 LYS A 28 -13.259 -5.431 11.021 1.00 71.23 H new ATOM 0 HZ2 LYS A 28 -12.385 -5.909 9.645 1.00 71.23 H new ATOM 0 HZ3 LYS A 28 -12.133 -6.697 11.128 1.00 71.23 H new ATOM 433 N GLN A 29 -6.016 -7.463 13.368 1.00 1.30 N ATOM 434 CA GLN A 29 -5.323 -7.799 14.639 1.00 54.14 C ATOM 435 C GLN A 29 -4.111 -6.861 14.886 1.00 1.13 C ATOM 436 O GLN A 29 -3.877 -6.413 16.018 1.00 70.03 O ATOM 437 CB GLN A 29 -4.862 -9.282 14.643 1.00 2.33 C ATOM 438 CG GLN A 29 -6.000 -10.325 14.634 1.00 13.40 C ATOM 439 CD GLN A 29 -5.485 -11.770 14.728 1.00 53.21 C ATOM 440 OE1 GLN A 29 -5.291 -12.303 15.809 1.00 25.11 O ATOM 441 NE2 GLN A 29 -5.270 -12.419 13.603 1.00 74.01 N ATOM 0 H GLN A 29 -5.924 -8.181 12.650 1.00 1.30 H new ATOM 0 HA GLN A 29 -6.037 -7.653 15.449 1.00 54.14 H new ATOM 0 HB2 GLN A 29 -4.229 -9.451 13.772 1.00 2.33 H new ATOM 0 HB3 GLN A 29 -4.243 -9.451 15.524 1.00 2.33 H new ATOM 0 HG2 GLN A 29 -6.673 -10.129 15.469 1.00 13.40 H new ATOM 0 HG3 GLN A 29 -6.584 -10.211 13.721 1.00 13.40 H new ATOM 0 HE21 GLN A 29 -5.437 -11.958 12.708 1.00 74.01 H new ATOM 0 HE22 GLN A 29 -4.936 -13.383 13.626 1.00 74.01 H new ATOM 450 N ILE A 30 -3.346 -6.572 13.813 1.00 41.21 N ATOM 451 CA ILE A 30 -2.199 -5.626 13.870 1.00 73.11 C ATOM 452 C ILE A 30 -2.704 -4.185 14.114 1.00 25.52 C ATOM 453 O ILE A 30 -2.095 -3.418 14.854 1.00 32.43 O ATOM 454 CB ILE A 30 -1.366 -5.622 12.537 1.00 32.25 C ATOM 455 CG1 ILE A 30 -1.056 -7.066 12.045 1.00 60.21 C ATOM 456 CG2 ILE A 30 -0.049 -4.808 12.699 1.00 64.24 C ATOM 457 CD1 ILE A 30 -0.474 -7.118 10.642 1.00 25.03 C ATOM 0 H ILE A 30 -3.498 -6.979 12.890 1.00 41.21 H new ATOM 0 HA ILE A 30 -1.562 -5.961 14.688 1.00 73.11 H new ATOM 0 HB ILE A 30 -1.980 -5.136 11.779 1.00 32.25 H new ATOM 0 HG12 ILE A 30 -0.357 -7.535 12.737 1.00 60.21 H new ATOM 0 HG13 ILE A 30 -1.973 -7.655 12.071 1.00 60.21 H new ATOM 0 HG21 ILE A 30 0.506 -4.823 11.761 1.00 64.24 H new ATOM 0 HG22 ILE A 30 -0.288 -3.778 12.962 1.00 64.24 H new ATOM 0 HG23 ILE A 30 0.559 -5.252 13.487 1.00 64.24 H new ATOM 0 HD11 ILE A 30 -0.283 -8.155 10.366 1.00 25.03 H new ATOM 0 HD12 ILE A 30 -1.181 -6.679 9.938 1.00 25.03 H new ATOM 0 HD13 ILE A 30 0.460 -6.557 10.615 1.00 25.03 H new ATOM 469 N LYS A 31 -3.834 -3.863 13.463 1.00 75.52 N ATOM 470 CA LYS A 31 -4.490 -2.537 13.524 1.00 24.54 C ATOM 471 C LYS A 31 -4.858 -2.153 14.990 1.00 74.55 C ATOM 472 O LYS A 31 -4.842 -0.974 15.359 1.00 64.24 O ATOM 473 CB LYS A 31 -5.748 -2.577 12.618 1.00 50.34 C ATOM 474 CG LYS A 31 -6.325 -1.207 12.217 1.00 62.22 C ATOM 475 CD LYS A 31 -7.616 -1.336 11.373 1.00 24.41 C ATOM 476 CE LYS A 31 -8.215 0.027 10.989 1.00 52.13 C ATOM 477 NZ LYS A 31 -8.622 0.828 12.174 1.00 13.03 N ATOM 0 H LYS A 31 -4.330 -4.526 12.867 1.00 75.52 H new ATOM 0 HA LYS A 31 -3.803 -1.770 13.166 1.00 24.54 H new ATOM 0 HB2 LYS A 31 -5.502 -3.127 11.710 1.00 50.34 H new ATOM 0 HB3 LYS A 31 -6.526 -3.142 13.132 1.00 50.34 H new ATOM 0 HG2 LYS A 31 -6.538 -0.628 13.116 1.00 62.22 H new ATOM 0 HG3 LYS A 31 -5.577 -0.652 11.650 1.00 62.22 H new ATOM 0 HD2 LYS A 31 -7.397 -1.900 10.466 1.00 24.41 H new ATOM 0 HD3 LYS A 31 -8.356 -1.908 11.933 1.00 24.41 H new ATOM 0 HE2 LYS A 31 -7.484 0.590 10.408 1.00 52.13 H new ATOM 0 HE3 LYS A 31 -9.081 -0.129 10.346 1.00 52.13 H new ATOM 0 HZ1 LYS A 31 -9.198 1.637 11.865 1.00 13.03 H new ATOM 0 HZ2 LYS A 31 -9.179 0.233 12.820 1.00 13.03 H new ATOM 0 HZ3 LYS A 31 -7.774 1.175 12.666 1.00 13.03 H new ATOM 491 N LYS A 32 -5.193 -3.179 15.808 1.00 25.32 N ATOM 492 CA LYS A 32 -5.346 -3.042 17.282 1.00 23.23 C ATOM 493 C LYS A 32 -3.991 -2.722 17.961 1.00 44.44 C ATOM 494 O LYS A 32 -3.868 -1.734 18.697 1.00 43.22 O ATOM 495 CB LYS A 32 -5.917 -4.353 17.897 1.00 34.45 C ATOM 496 CG LYS A 32 -7.413 -4.613 17.641 1.00 71.35 C ATOM 497 CD LYS A 32 -8.324 -3.559 18.322 1.00 13.41 C ATOM 498 CE LYS A 32 -9.795 -4.008 18.400 1.00 3.42 C ATOM 499 NZ LYS A 32 -10.329 -4.438 17.080 1.00 74.33 N ATOM 0 H LYS A 32 -5.365 -4.125 15.468 1.00 25.32 H new ATOM 0 HA LYS A 32 -6.037 -2.218 17.460 1.00 23.23 H new ATOM 0 HB2 LYS A 32 -5.348 -5.195 17.504 1.00 34.45 H new ATOM 0 HB3 LYS A 32 -5.750 -4.331 18.974 1.00 34.45 H new ATOM 0 HG2 LYS A 32 -7.600 -4.611 16.567 1.00 71.35 H new ATOM 0 HG3 LYS A 32 -7.674 -5.606 18.008 1.00 71.35 H new ATOM 0 HD2 LYS A 32 -7.955 -3.361 19.328 1.00 13.41 H new ATOM 0 HD3 LYS A 32 -8.263 -2.621 17.770 1.00 13.41 H new ATOM 0 HE2 LYS A 32 -9.883 -4.831 19.110 1.00 3.42 H new ATOM 0 HE3 LYS A 32 -10.402 -3.188 18.785 1.00 3.42 H new ATOM 0 HZ1 LYS A 32 -11.350 -4.617 17.160 1.00 74.33 H new ATOM 0 HZ2 LYS A 32 -10.163 -3.689 16.378 1.00 74.33 H new ATOM 0 HZ3 LYS A 32 -9.848 -5.309 16.778 1.00 74.33 H new ATOM 513 N ALA A 33 -2.981 -3.578 17.685 1.00 12.42 N ATOM 514 CA ALA A 33 -1.639 -3.513 18.324 1.00 15.45 C ATOM 515 C ALA A 33 -0.932 -2.151 18.088 1.00 51.22 C ATOM 516 O ALA A 33 -0.228 -1.643 18.964 1.00 24.42 O ATOM 517 CB ALA A 33 -0.763 -4.672 17.814 1.00 60.03 C ATOM 0 H ALA A 33 -3.070 -4.338 17.010 1.00 12.42 H new ATOM 0 HA ALA A 33 -1.783 -3.608 19.400 1.00 15.45 H new ATOM 0 HB1 ALA A 33 0.219 -4.620 18.285 1.00 60.03 H new ATOM 0 HB2 ALA A 33 -1.235 -5.622 18.063 1.00 60.03 H new ATOM 0 HB3 ALA A 33 -0.651 -4.595 16.732 1.00 60.03 H new ATOM 523 N THR A 34 -1.157 -1.573 16.903 1.00 13.05 N ATOM 524 CA THR A 34 -0.569 -0.280 16.480 1.00 50.23 C ATOM 525 C THR A 34 -1.514 0.914 16.753 1.00 12.11 C ATOM 526 O THR A 34 -1.063 2.065 16.761 1.00 1.12 O ATOM 527 CB THR A 34 -0.233 -0.320 14.954 1.00 2.45 C ATOM 528 OG1 THR A 34 -1.423 -0.639 14.202 1.00 21.05 O ATOM 529 CG2 THR A 34 0.870 -1.345 14.630 1.00 63.13 C ATOM 0 H THR A 34 -1.761 -1.990 16.194 1.00 13.05 H new ATOM 0 HA THR A 34 0.337 -0.136 17.068 1.00 50.23 H new ATOM 0 HB THR A 34 0.137 0.666 14.673 1.00 2.45 H new ATOM 0 HG1 THR A 34 -1.616 -1.596 14.285 1.00 21.05 H new ATOM 0 HG21 THR A 34 1.070 -1.338 13.559 1.00 63.13 H new ATOM 0 HG22 THR A 34 1.780 -1.084 15.171 1.00 63.13 H new ATOM 0 HG23 THR A 34 0.542 -2.340 14.931 1.00 63.13 H new ATOM 537 N LYS A 35 -2.825 0.623 16.949 1.00 34.13 N ATOM 538 CA LYS A 35 -3.895 1.643 17.162 1.00 21.14 C ATOM 539 C LYS A 35 -4.090 2.574 15.927 1.00 53.45 C ATOM 540 O LYS A 35 -4.593 3.697 16.057 1.00 15.22 O ATOM 541 CB LYS A 35 -3.658 2.471 18.470 1.00 70.41 C ATOM 542 CG LYS A 35 -3.900 1.698 19.789 1.00 22.13 C ATOM 543 CD LYS A 35 -3.806 2.616 21.037 1.00 31.24 C ATOM 544 CE LYS A 35 -4.227 1.912 22.340 1.00 41.34 C ATOM 545 NZ LYS A 35 -3.350 0.765 22.681 1.00 13.53 N ATOM 0 H LYS A 35 -3.177 -0.334 16.965 1.00 34.13 H new ATOM 0 HA LYS A 35 -4.825 1.088 17.287 1.00 21.14 H new ATOM 0 HB2 LYS A 35 -2.633 2.841 18.467 1.00 70.41 H new ATOM 0 HB3 LYS A 35 -4.312 3.343 18.453 1.00 70.41 H new ATOM 0 HG2 LYS A 35 -4.884 1.231 19.758 1.00 22.13 H new ATOM 0 HG3 LYS A 35 -3.168 0.895 19.876 1.00 22.13 H new ATOM 0 HD2 LYS A 35 -2.782 2.975 21.140 1.00 31.24 H new ATOM 0 HD3 LYS A 35 -4.437 3.492 20.884 1.00 31.24 H new ATOM 0 HE2 LYS A 35 -4.211 2.632 23.158 1.00 41.34 H new ATOM 0 HE3 LYS A 35 -5.255 1.562 22.243 1.00 41.34 H new ATOM 0 HZ1 LYS A 35 -3.678 0.328 23.566 1.00 13.53 H new ATOM 0 HZ2 LYS A 35 -3.384 0.063 21.915 1.00 13.53 H new ATOM 0 HZ3 LYS A 35 -2.373 1.099 22.802 1.00 13.53 H new ATOM 559 N LEU A 36 -3.725 2.069 14.731 1.00 74.23 N ATOM 560 CA LEU A 36 -3.911 2.799 13.453 1.00 55.24 C ATOM 561 C LEU A 36 -5.418 2.974 13.149 1.00 63.45 C ATOM 562 O LEU A 36 -6.153 1.987 13.052 1.00 52.24 O ATOM 563 CB LEU A 36 -3.185 2.062 12.294 1.00 73.13 C ATOM 564 CG LEU A 36 -1.620 2.068 12.369 1.00 54.13 C ATOM 565 CD1 LEU A 36 -0.990 1.293 11.192 1.00 11.34 C ATOM 566 CD2 LEU A 36 -1.062 3.512 12.446 1.00 60.30 C ATOM 0 H LEU A 36 -3.296 1.150 14.620 1.00 74.23 H new ATOM 0 HA LEU A 36 -3.468 3.790 13.547 1.00 55.24 H new ATOM 0 HB2 LEU A 36 -3.527 1.027 12.274 1.00 73.13 H new ATOM 0 HB3 LEU A 36 -3.488 2.516 11.351 1.00 73.13 H new ATOM 0 HG LEU A 36 -1.341 1.553 13.288 1.00 54.13 H new ATOM 0 HD11 LEU A 36 0.096 1.320 11.279 1.00 11.34 H new ATOM 0 HD12 LEU A 36 -1.331 0.258 11.214 1.00 11.34 H new ATOM 0 HD13 LEU A 36 -1.290 1.754 10.251 1.00 11.34 H new ATOM 0 HD21 LEU A 36 0.026 3.479 12.497 1.00 60.30 H new ATOM 0 HD22 LEU A 36 -1.367 4.068 11.559 1.00 60.30 H new ATOM 0 HD23 LEU A 36 -1.452 4.006 13.336 1.00 60.30 H new ATOM 578 N LYS A 37 -5.869 4.238 13.039 1.00 3.34 N ATOM 579 CA LYS A 37 -7.310 4.574 12.950 1.00 62.41 C ATOM 580 C LYS A 37 -7.930 4.177 11.588 1.00 11.40 C ATOM 581 O LYS A 37 -9.106 3.805 11.524 1.00 24.03 O ATOM 582 CB LYS A 37 -7.543 6.082 13.256 1.00 1.21 C ATOM 583 CG LYS A 37 -7.037 6.549 14.649 1.00 23.25 C ATOM 584 CD LYS A 37 -7.581 5.700 15.834 1.00 11.33 C ATOM 585 CE LYS A 37 -9.120 5.713 15.951 1.00 74.14 C ATOM 586 NZ LYS A 37 -9.658 7.071 16.221 1.00 13.24 N ATOM 0 H LYS A 37 -5.254 5.051 13.009 1.00 3.34 H new ATOM 0 HA LYS A 37 -7.823 3.983 13.708 1.00 62.41 H new ATOM 0 HB2 LYS A 37 -7.048 6.675 12.487 1.00 1.21 H new ATOM 0 HB3 LYS A 37 -8.610 6.293 13.183 1.00 1.21 H new ATOM 0 HG2 LYS A 37 -5.948 6.514 14.660 1.00 23.25 H new ATOM 0 HG3 LYS A 37 -7.324 7.590 14.799 1.00 23.25 H new ATOM 0 HD2 LYS A 37 -7.243 4.670 15.717 1.00 11.33 H new ATOM 0 HD3 LYS A 37 -7.152 6.073 16.764 1.00 11.33 H new ATOM 0 HE2 LYS A 37 -9.555 5.330 15.028 1.00 74.14 H new ATOM 0 HE3 LYS A 37 -9.426 5.039 16.751 1.00 74.14 H new ATOM 0 HZ1 LYS A 37 -10.695 7.026 16.291 1.00 13.24 H new ATOM 0 HZ2 LYS A 37 -9.266 7.428 17.116 1.00 13.24 H new ATOM 0 HZ3 LYS A 37 -9.391 7.711 15.446 1.00 13.24 H new ATOM 600 N ALA A 38 -7.135 4.239 10.506 1.00 71.55 N ATOM 601 CA ALA A 38 -7.560 3.759 9.171 1.00 14.21 C ATOM 602 C ALA A 38 -6.697 2.568 8.722 1.00 13.40 C ATOM 603 O ALA A 38 -5.499 2.500 9.003 1.00 41.23 O ATOM 604 CB ALA A 38 -7.505 4.891 8.127 1.00 62.54 C ATOM 0 H ALA A 38 -6.188 4.618 10.526 1.00 71.55 H new ATOM 0 HA ALA A 38 -8.595 3.426 9.251 1.00 14.21 H new ATOM 0 HB1 ALA A 38 -7.823 4.507 7.157 1.00 62.54 H new ATOM 0 HB2 ALA A 38 -8.169 5.700 8.432 1.00 62.54 H new ATOM 0 HB3 ALA A 38 -6.485 5.267 8.052 1.00 62.54 H new ATOM 610 N ASP A 39 -7.340 1.618 8.032 1.00 41.22 N ATOM 611 CA ASP A 39 -6.660 0.502 7.341 1.00 11.22 C ATOM 612 C ASP A 39 -5.814 1.027 6.159 1.00 13.25 C ATOM 613 O ASP A 39 -4.857 0.387 5.739 1.00 25.42 O ATOM 614 CB ASP A 39 -7.710 -0.552 6.874 1.00 33.24 C ATOM 615 CG ASP A 39 -8.767 -0.039 5.864 1.00 13.15 C ATOM 616 OD1 ASP A 39 -9.143 1.154 5.906 1.00 53.54 O ATOM 617 OD2 ASP A 39 -9.244 -0.837 5.031 1.00 30.31 O ATOM 0 H ASP A 39 -8.355 1.597 7.933 1.00 41.22 H new ATOM 0 HA ASP A 39 -5.977 0.014 8.037 1.00 11.22 H new ATOM 0 HB2 ASP A 39 -7.181 -1.392 6.424 1.00 33.24 H new ATOM 0 HB3 ASP A 39 -8.229 -0.936 7.752 1.00 33.24 H new ATOM 622 N LYS A 40 -6.206 2.205 5.637 1.00 31.43 N ATOM 623 CA LYS A 40 -5.530 2.887 4.512 1.00 53.22 C ATOM 624 C LYS A 40 -4.056 3.261 4.826 1.00 42.10 C ATOM 625 O LYS A 40 -3.169 3.013 4.005 1.00 73.05 O ATOM 626 CB LYS A 40 -6.344 4.141 4.099 1.00 52.52 C ATOM 627 CG LYS A 40 -7.838 3.845 3.821 1.00 71.33 C ATOM 628 CD LYS A 40 -8.568 5.016 3.134 1.00 74.44 C ATOM 629 CE LYS A 40 -10.037 4.689 2.808 1.00 45.31 C ATOM 630 NZ LYS A 40 -10.673 5.727 1.960 1.00 42.42 N ATOM 0 H LYS A 40 -7.014 2.719 5.989 1.00 31.43 H new ATOM 0 HA LYS A 40 -5.491 2.184 3.680 1.00 53.22 H new ATOM 0 HB2 LYS A 40 -6.271 4.888 4.889 1.00 52.52 H new ATOM 0 HB3 LYS A 40 -5.896 4.577 3.206 1.00 52.52 H new ATOM 0 HG2 LYS A 40 -7.916 2.957 3.193 1.00 71.33 H new ATOM 0 HG3 LYS A 40 -8.338 3.615 4.762 1.00 71.33 H new ATOM 0 HD2 LYS A 40 -8.530 5.893 3.781 1.00 74.44 H new ATOM 0 HD3 LYS A 40 -8.045 5.276 2.214 1.00 74.44 H new ATOM 0 HE2 LYS A 40 -10.088 3.727 2.299 1.00 45.31 H new ATOM 0 HE3 LYS A 40 -10.599 4.588 3.737 1.00 45.31 H new ATOM 0 HZ1 LYS A 40 -11.636 5.915 2.305 1.00 42.42 H new ATOM 0 HZ2 LYS A 40 -10.113 6.602 2.004 1.00 42.42 H new ATOM 0 HZ3 LYS A 40 -10.717 5.393 0.976 1.00 42.42 H new ATOM 644 N ASP A 41 -3.795 3.829 6.024 1.00 21.11 N ATOM 645 CA ASP A 41 -2.414 4.196 6.443 1.00 3.34 C ATOM 646 C ASP A 41 -1.609 2.932 6.856 1.00 55.52 C ATOM 647 O ASP A 41 -0.374 2.896 6.746 1.00 30.54 O ATOM 648 CB ASP A 41 -2.427 5.268 7.570 1.00 12.51 C ATOM 649 CG ASP A 41 -3.284 4.890 8.793 1.00 24.23 C ATOM 650 OD1 ASP A 41 -2.854 4.042 9.591 1.00 42.34 O ATOM 651 OD2 ASP A 41 -4.382 5.458 8.967 1.00 41.13 O ATOM 0 H ASP A 41 -4.512 4.044 6.716 1.00 21.11 H new ATOM 0 HA ASP A 41 -1.909 4.643 5.587 1.00 3.34 H new ATOM 0 HB2 ASP A 41 -1.403 5.445 7.899 1.00 12.51 H new ATOM 0 HB3 ASP A 41 -2.796 6.207 7.158 1.00 12.51 H new ATOM 656 N PHE A 42 -2.337 1.902 7.338 1.00 51.00 N ATOM 657 CA PHE A 42 -1.798 0.536 7.521 1.00 42.42 C ATOM 658 C PHE A 42 -1.279 -0.050 6.172 1.00 32.53 C ATOM 659 O PHE A 42 -0.252 -0.715 6.149 1.00 11.25 O ATOM 660 CB PHE A 42 -2.879 -0.385 8.157 1.00 60.35 C ATOM 661 CG PHE A 42 -2.467 -1.855 8.245 1.00 23.45 C ATOM 662 CD1 PHE A 42 -1.668 -2.317 9.287 1.00 12.23 C ATOM 663 CD2 PHE A 42 -2.846 -2.764 7.253 1.00 33.42 C ATOM 664 CE1 PHE A 42 -1.261 -3.634 9.333 1.00 12.34 C ATOM 665 CE2 PHE A 42 -2.441 -4.074 7.308 1.00 4.53 C ATOM 666 CZ PHE A 42 -1.648 -4.510 8.347 1.00 45.10 C ATOM 0 H PHE A 42 -3.315 1.994 7.611 1.00 51.00 H new ATOM 0 HA PHE A 42 -0.947 0.588 8.200 1.00 42.42 H new ATOM 0 HB2 PHE A 42 -3.108 -0.022 9.159 1.00 60.35 H new ATOM 0 HB3 PHE A 42 -3.796 -0.309 7.573 1.00 60.35 H new ATOM 0 HD1 PHE A 42 -1.363 -1.636 10.068 1.00 12.23 H new ATOM 0 HD2 PHE A 42 -3.465 -2.431 6.433 1.00 33.42 H new ATOM 0 HE1 PHE A 42 -0.637 -3.978 10.145 1.00 12.34 H new ATOM 0 HE2 PHE A 42 -2.744 -4.765 6.535 1.00 4.53 H new ATOM 0 HZ PHE A 42 -1.330 -5.541 8.387 1.00 45.10 H new ATOM 676 N PHE A 43 -2.004 0.195 5.059 1.00 0.43 N ATOM 677 CA PHE A 43 -1.582 -0.265 3.702 1.00 53.20 C ATOM 678 C PHE A 43 -0.287 0.437 3.230 1.00 4.23 C ATOM 679 O PHE A 43 0.505 -0.150 2.494 1.00 13.33 O ATOM 680 CB PHE A 43 -2.709 -0.058 2.653 1.00 72.35 C ATOM 681 CG PHE A 43 -4.010 -0.808 2.949 1.00 23.43 C ATOM 682 CD1 PHE A 43 -4.000 -2.084 3.521 1.00 1.31 C ATOM 683 CD2 PHE A 43 -5.243 -0.230 2.659 1.00 1.24 C ATOM 684 CE1 PHE A 43 -5.182 -2.748 3.791 1.00 34.22 C ATOM 685 CE2 PHE A 43 -6.418 -0.893 2.930 1.00 72.31 C ATOM 686 CZ PHE A 43 -6.391 -2.154 3.494 1.00 74.23 C ATOM 0 H PHE A 43 -2.886 0.708 5.065 1.00 0.43 H new ATOM 0 HA PHE A 43 -1.378 -1.332 3.788 1.00 53.20 H new ATOM 0 HB2 PHE A 43 -2.929 1.007 2.583 1.00 72.35 H new ATOM 0 HB3 PHE A 43 -2.339 -0.372 1.677 1.00 72.35 H new ATOM 0 HD1 PHE A 43 -3.057 -2.556 3.755 1.00 1.31 H new ATOM 0 HD2 PHE A 43 -5.278 0.754 2.215 1.00 1.24 H new ATOM 0 HE1 PHE A 43 -5.159 -3.732 4.235 1.00 34.22 H new ATOM 0 HE2 PHE A 43 -7.365 -0.426 2.701 1.00 72.31 H new ATOM 0 HZ PHE A 43 -7.315 -2.674 3.702 1.00 74.23 H new ATOM 696 N LEU A 44 -0.100 1.707 3.635 1.00 2.12 N ATOM 697 CA LEU A 44 1.159 2.458 3.389 1.00 12.25 C ATOM 698 C LEU A 44 2.331 1.863 4.217 1.00 12.34 C ATOM 699 O LEU A 44 3.458 1.762 3.724 1.00 40.22 O ATOM 700 CB LEU A 44 0.962 3.978 3.710 1.00 63.34 C ATOM 701 CG LEU A 44 0.330 4.860 2.573 1.00 4.14 C ATOM 702 CD1 LEU A 44 -1.011 4.294 2.053 1.00 71.53 C ATOM 703 CD2 LEU A 44 0.160 6.328 3.040 1.00 73.13 C ATOM 0 H LEU A 44 -0.807 2.243 4.138 1.00 2.12 H new ATOM 0 HA LEU A 44 1.414 2.362 2.334 1.00 12.25 H new ATOM 0 HB2 LEU A 44 0.332 4.061 4.596 1.00 63.34 H new ATOM 0 HB3 LEU A 44 1.933 4.400 3.969 1.00 63.34 H new ATOM 0 HG LEU A 44 1.029 4.836 1.737 1.00 4.14 H new ATOM 0 HD11 LEU A 44 -1.401 4.944 1.270 1.00 71.53 H new ATOM 0 HD12 LEU A 44 -0.852 3.294 1.649 1.00 71.53 H new ATOM 0 HD13 LEU A 44 -1.727 4.244 2.873 1.00 71.53 H new ATOM 0 HD21 LEU A 44 -0.279 6.917 2.235 1.00 73.13 H new ATOM 0 HD22 LEU A 44 -0.494 6.359 3.911 1.00 73.13 H new ATOM 0 HD23 LEU A 44 1.134 6.741 3.303 1.00 73.13 H new ATOM 715 N GLY A 45 2.035 1.462 5.471 1.00 33.35 N ATOM 716 CA GLY A 45 3.034 0.847 6.360 1.00 32.14 C ATOM 717 C GLY A 45 3.432 -0.576 5.938 1.00 14.54 C ATOM 718 O GLY A 45 4.589 -0.830 5.623 1.00 54.21 O ATOM 0 H GLY A 45 1.109 1.555 5.888 1.00 33.35 H new ATOM 0 HA2 GLY A 45 3.925 1.474 6.382 1.00 32.14 H new ATOM 0 HA3 GLY A 45 2.638 0.820 7.375 1.00 32.14 H new ATOM 722 N LEU A 46 2.455 -1.498 5.939 1.00 31.12 N ATOM 723 CA LEU A 46 2.621 -2.901 5.461 1.00 30.15 C ATOM 724 C LEU A 46 3.122 -2.969 3.991 1.00 35.42 C ATOM 725 O LEU A 46 3.876 -3.876 3.615 1.00 73.20 O ATOM 726 CB LEU A 46 1.272 -3.662 5.587 1.00 14.01 C ATOM 727 CG LEU A 46 1.289 -5.160 5.127 1.00 52.42 C ATOM 728 CD1 LEU A 46 2.206 -6.016 6.030 1.00 60.34 C ATOM 729 CD2 LEU A 46 -0.140 -5.742 5.042 1.00 53.14 C ATOM 0 H LEU A 46 1.512 -1.298 6.274 1.00 31.12 H new ATOM 0 HA LEU A 46 3.379 -3.371 6.088 1.00 30.15 H new ATOM 0 HB2 LEU A 46 0.951 -3.625 6.628 1.00 14.01 H new ATOM 0 HB3 LEU A 46 0.521 -3.131 5.003 1.00 14.01 H new ATOM 0 HG LEU A 46 1.708 -5.191 4.121 1.00 52.42 H new ATOM 0 HD11 LEU A 46 2.195 -7.050 5.684 1.00 60.34 H new ATOM 0 HD12 LEU A 46 3.224 -5.629 5.986 1.00 60.34 H new ATOM 0 HD13 LEU A 46 1.846 -5.974 7.058 1.00 60.34 H new ATOM 0 HD21 LEU A 46 -0.091 -6.782 4.720 1.00 53.14 H new ATOM 0 HD22 LEU A 46 -0.614 -5.688 6.022 1.00 53.14 H new ATOM 0 HD23 LEU A 46 -0.725 -5.167 4.324 1.00 53.14 H new ATOM 741 N GLY A 47 2.684 -2.002 3.173 1.00 54.21 N ATOM 742 CA GLY A 47 3.156 -1.873 1.786 1.00 15.22 C ATOM 743 C GLY A 47 4.641 -1.513 1.705 1.00 24.21 C ATOM 744 O GLY A 47 5.347 -1.929 0.779 1.00 43.10 O ATOM 0 H GLY A 47 2.002 -1.296 3.448 1.00 54.21 H new ATOM 0 HA2 GLY A 47 2.983 -2.811 1.258 1.00 15.22 H new ATOM 0 HA3 GLY A 47 2.571 -1.107 1.276 1.00 15.22 H new ATOM 748 N TRP A 48 5.115 -0.739 2.702 1.00 63.21 N ATOM 749 CA TRP A 48 6.544 -0.422 2.866 1.00 31.32 C ATOM 750 C TRP A 48 7.324 -1.642 3.452 1.00 75.11 C ATOM 751 O TRP A 48 8.524 -1.761 3.251 1.00 11.41 O ATOM 752 CB TRP A 48 6.723 0.843 3.746 1.00 52.20 C ATOM 753 CG TRP A 48 8.108 1.457 3.670 1.00 43.21 C ATOM 754 CD1 TRP A 48 9.190 1.188 4.465 1.00 43.15 C ATOM 755 CD2 TRP A 48 8.550 2.434 2.721 1.00 20.14 C ATOM 756 NE1 TRP A 48 10.264 1.939 4.067 1.00 42.52 N ATOM 757 CE2 TRP A 48 9.899 2.708 2.999 1.00 51.34 C ATOM 758 CE3 TRP A 48 7.930 3.098 1.654 1.00 0.55 C ATOM 759 CZ2 TRP A 48 10.639 3.624 2.261 1.00 34.02 C ATOM 760 CZ3 TRP A 48 8.665 4.006 0.919 1.00 22.04 C ATOM 761 CH2 TRP A 48 10.010 4.257 1.224 1.00 42.43 C ATOM 0 H TRP A 48 4.518 -0.318 3.414 1.00 63.21 H new ATOM 0 HA TRP A 48 6.964 -0.208 1.883 1.00 31.32 H new ATOM 0 HB2 TRP A 48 5.989 1.590 3.444 1.00 52.20 H new ATOM 0 HB3 TRP A 48 6.508 0.585 4.783 1.00 52.20 H new ATOM 0 HD1 TRP A 48 9.196 0.486 5.286 1.00 43.15 H new ATOM 0 HE1 TRP A 48 11.188 1.926 4.499 1.00 42.52 H new ATOM 0 HE3 TRP A 48 6.896 2.903 1.411 1.00 0.55 H new ATOM 0 HZ2 TRP A 48 11.673 3.829 2.497 1.00 34.02 H new ATOM 0 HZ3 TRP A 48 8.198 4.530 0.098 1.00 22.04 H new ATOM 0 HH2 TRP A 48 10.563 4.967 0.626 1.00 42.43 H new ATOM 772 N LEU A 49 6.630 -2.546 4.169 1.00 33.22 N ATOM 773 CA LEU A 49 7.208 -3.861 4.587 1.00 10.32 C ATOM 774 C LEU A 49 7.458 -4.782 3.355 1.00 31.32 C ATOM 775 O LEU A 49 8.367 -5.620 3.371 1.00 23.13 O ATOM 776 CB LEU A 49 6.293 -4.569 5.640 1.00 31.33 C ATOM 777 CG LEU A 49 6.473 -4.166 7.145 1.00 34.43 C ATOM 778 CD1 LEU A 49 6.523 -2.660 7.323 1.00 34.32 C ATOM 779 CD2 LEU A 49 5.350 -4.762 8.026 1.00 21.25 C ATOM 0 H LEU A 49 5.668 -2.401 4.476 1.00 33.22 H new ATOM 0 HA LEU A 49 8.171 -3.666 5.058 1.00 10.32 H new ATOM 0 HB2 LEU A 49 5.255 -4.382 5.364 1.00 31.33 H new ATOM 0 HB3 LEU A 49 6.456 -5.644 5.558 1.00 31.33 H new ATOM 0 HG LEU A 49 7.428 -4.580 7.467 1.00 34.43 H new ATOM 0 HD11 LEU A 49 6.648 -2.422 8.379 1.00 34.32 H new ATOM 0 HD12 LEU A 49 7.362 -2.254 6.758 1.00 34.32 H new ATOM 0 HD13 LEU A 49 5.594 -2.220 6.960 1.00 34.32 H new ATOM 0 HD21 LEU A 49 5.504 -4.464 9.063 1.00 21.25 H new ATOM 0 HD22 LEU A 49 4.384 -4.393 7.682 1.00 21.25 H new ATOM 0 HD23 LEU A 49 5.370 -5.849 7.954 1.00 21.25 H new ATOM 791 N LEU A 50 6.621 -4.623 2.306 1.00 22.51 N ATOM 792 CA LEU A 50 6.823 -5.276 0.984 1.00 14.31 C ATOM 793 C LEU A 50 7.951 -4.580 0.180 1.00 60.43 C ATOM 794 O LEU A 50 8.672 -5.236 -0.583 1.00 21.13 O ATOM 795 CB LEU A 50 5.500 -5.286 0.170 1.00 72.41 C ATOM 796 CG LEU A 50 4.346 -6.149 0.769 1.00 61.52 C ATOM 797 CD1 LEU A 50 3.064 -6.064 -0.095 1.00 23.52 C ATOM 798 CD2 LEU A 50 4.798 -7.616 0.963 1.00 51.30 C ATOM 0 H LEU A 50 5.785 -4.040 2.347 1.00 22.51 H new ATOM 0 HA LEU A 50 7.127 -6.307 1.165 1.00 14.31 H new ATOM 0 HB2 LEU A 50 5.148 -4.259 0.071 1.00 72.41 H new ATOM 0 HB3 LEU A 50 5.716 -5.648 -0.835 1.00 72.41 H new ATOM 0 HG LEU A 50 4.101 -5.740 1.750 1.00 61.52 H new ATOM 0 HD11 LEU A 50 2.282 -6.677 0.353 1.00 23.52 H new ATOM 0 HD12 LEU A 50 2.728 -5.028 -0.146 1.00 23.52 H new ATOM 0 HD13 LEU A 50 3.278 -6.426 -1.100 1.00 23.52 H new ATOM 0 HD21 LEU A 50 3.977 -8.197 1.382 1.00 51.30 H new ATOM 0 HD22 LEU A 50 5.088 -8.038 0.001 1.00 51.30 H new ATOM 0 HD23 LEU A 50 5.649 -7.648 1.644 1.00 51.30 H new ATOM 810 N ARG A 51 8.065 -3.244 0.352 1.00 13.23 N ATOM 811 CA ARG A 51 9.199 -2.426 -0.163 1.00 44.43 C ATOM 812 C ARG A 51 10.540 -2.993 0.363 1.00 61.35 C ATOM 813 O ARG A 51 11.502 -3.153 -0.390 1.00 62.20 O ATOM 814 CB ARG A 51 8.991 -0.944 0.290 1.00 2.45 C ATOM 815 CG ARG A 51 9.792 0.163 -0.437 1.00 2.23 C ATOM 816 CD ARG A 51 11.284 0.240 -0.075 1.00 3.50 C ATOM 817 NE ARG A 51 11.946 1.347 -0.777 1.00 11.10 N ATOM 818 CZ ARG A 51 12.412 1.313 -2.009 1.00 72.20 C ATOM 819 NH1 ARG A 51 12.412 0.218 -2.716 1.00 60.34 N ATOM 820 NH2 ARG A 51 12.908 2.386 -2.514 1.00 43.54 N ATOM 0 H ARG A 51 7.370 -2.694 0.856 1.00 13.23 H new ATOM 0 HA ARG A 51 9.230 -2.462 -1.252 1.00 44.43 H new ATOM 0 HB2 ARG A 51 7.931 -0.710 0.187 1.00 2.45 H new ATOM 0 HB3 ARG A 51 9.229 -0.884 1.352 1.00 2.45 H new ATOM 0 HG2 ARG A 51 9.704 0.006 -1.512 1.00 2.23 H new ATOM 0 HG3 ARG A 51 9.331 1.126 -0.217 1.00 2.23 H new ATOM 0 HD2 ARG A 51 11.393 0.372 1.001 1.00 3.50 H new ATOM 0 HD3 ARG A 51 11.772 -0.700 -0.332 1.00 3.50 H new ATOM 0 HE ARG A 51 12.055 2.222 -0.264 1.00 11.10 H new ATOM 0 HH11 ARG A 51 12.044 -0.646 -2.318 1.00 60.34 H new ATOM 0 HH12 ARG A 51 12.780 0.225 -3.667 1.00 60.34 H new ATOM 0 HH21 ARG A 51 12.936 3.244 -1.963 1.00 43.54 H new ATOM 0 HH22 ARG A 51 13.274 2.380 -3.466 1.00 43.54 H new ATOM 834 N GLU A 52 10.566 -3.293 1.670 1.00 11.51 N ATOM 835 CA GLU A 52 11.736 -3.871 2.358 1.00 24.03 C ATOM 836 C GLU A 52 11.870 -5.390 2.058 1.00 42.02 C ATOM 837 O GLU A 52 12.960 -5.961 2.207 1.00 43.31 O ATOM 838 CB GLU A 52 11.584 -3.646 3.888 1.00 12.41 C ATOM 839 CG GLU A 52 11.424 -2.171 4.323 1.00 32.32 C ATOM 840 CD GLU A 52 10.981 -2.017 5.794 1.00 72.33 C ATOM 841 OE1 GLU A 52 9.963 -2.630 6.185 1.00 62.14 O ATOM 842 OE2 GLU A 52 11.642 -1.296 6.576 1.00 31.32 O ATOM 0 H GLU A 52 9.769 -3.141 2.288 1.00 11.51 H new ATOM 0 HA GLU A 52 12.637 -3.377 1.994 1.00 24.03 H new ATOM 0 HB2 GLU A 52 10.717 -4.207 4.237 1.00 12.41 H new ATOM 0 HB3 GLU A 52 12.457 -4.063 4.389 1.00 12.41 H new ATOM 0 HG2 GLU A 52 12.371 -1.651 4.179 1.00 32.32 H new ATOM 0 HG3 GLU A 52 10.693 -1.685 3.677 1.00 32.32 H new ATOM 849 N ASP A 53 10.725 -6.026 1.662 1.00 21.31 N ATOM 850 CA ASP A 53 10.599 -7.497 1.452 1.00 22.21 C ATOM 851 C ASP A 53 10.848 -8.270 2.788 1.00 73.42 C ATOM 852 O ASP A 53 11.123 -9.474 2.816 1.00 4.30 O ATOM 853 CB ASP A 53 11.532 -7.939 0.283 1.00 70.23 C ATOM 854 CG ASP A 53 11.316 -9.382 -0.191 1.00 14.52 C ATOM 855 OD1 ASP A 53 10.196 -9.703 -0.643 1.00 60.01 O ATOM 856 OD2 ASP A 53 12.256 -10.202 -0.113 1.00 11.13 O ATOM 0 H ASP A 53 9.857 -5.523 1.479 1.00 21.31 H new ATOM 0 HA ASP A 53 9.581 -7.749 1.155 1.00 22.21 H new ATOM 0 HB2 ASP A 53 11.380 -7.266 -0.561 1.00 70.23 H new ATOM 0 HB3 ASP A 53 12.569 -7.825 0.599 1.00 70.23 H new ATOM 861 N LYS A 54 10.658 -7.536 3.901 1.00 43.14 N ATOM 862 CA LYS A 54 10.930 -7.995 5.275 1.00 40.05 C ATOM 863 C LYS A 54 9.692 -8.706 5.917 1.00 33.04 C ATOM 864 O LYS A 54 9.747 -9.173 7.067 1.00 42.21 O ATOM 865 CB LYS A 54 11.440 -6.759 6.086 1.00 22.20 C ATOM 866 CG LYS A 54 11.829 -7.025 7.557 1.00 32.10 C ATOM 867 CD LYS A 54 12.796 -5.973 8.160 1.00 24.11 C ATOM 868 CE LYS A 54 12.390 -4.509 7.909 1.00 44.44 C ATOM 869 NZ LYS A 54 11.094 -4.129 8.538 1.00 13.25 N ATOM 0 H LYS A 54 10.301 -6.581 3.867 1.00 43.14 H new ATOM 0 HA LYS A 54 11.702 -8.765 5.279 1.00 40.05 H new ATOM 0 HB2 LYS A 54 12.307 -6.345 5.571 1.00 22.20 H new ATOM 0 HB3 LYS A 54 10.664 -5.994 6.069 1.00 22.20 H new ATOM 0 HG2 LYS A 54 10.922 -7.056 8.161 1.00 32.10 H new ATOM 0 HG3 LYS A 54 12.292 -8.009 7.626 1.00 32.10 H new ATOM 0 HD2 LYS A 54 12.866 -6.137 9.235 1.00 24.11 H new ATOM 0 HD3 LYS A 54 13.792 -6.136 7.747 1.00 24.11 H new ATOM 0 HE2 LYS A 54 13.174 -3.854 8.289 1.00 44.44 H new ATOM 0 HE3 LYS A 54 12.326 -4.339 6.834 1.00 44.44 H new ATOM 0 HZ1 LYS A 54 10.482 -3.680 7.827 1.00 13.25 H new ATOM 0 HZ2 LYS A 54 10.626 -4.980 8.910 1.00 13.25 H new ATOM 0 HZ3 LYS A 54 11.268 -3.462 9.316 1.00 13.25 H new ATOM 883 N VAL A 55 8.587 -8.840 5.141 1.00 54.44 N ATOM 884 CA VAL A 55 7.413 -9.689 5.525 1.00 32.25 C ATOM 885 C VAL A 55 6.933 -10.572 4.349 1.00 21.44 C ATOM 886 O VAL A 55 7.361 -10.407 3.204 1.00 60.54 O ATOM 887 CB VAL A 55 6.180 -8.862 6.063 1.00 62.42 C ATOM 888 CG1 VAL A 55 6.557 -8.060 7.325 1.00 3.34 C ATOM 889 CG2 VAL A 55 5.569 -7.961 4.955 1.00 42.51 C ATOM 0 H VAL A 55 8.477 -8.372 4.241 1.00 54.44 H new ATOM 0 HA VAL A 55 7.783 -10.314 6.338 1.00 32.25 H new ATOM 0 HB VAL A 55 5.404 -9.570 6.352 1.00 62.42 H new ATOM 0 HG11 VAL A 55 5.689 -7.500 7.673 1.00 3.34 H new ATOM 0 HG12 VAL A 55 6.885 -8.745 8.107 1.00 3.34 H new ATOM 0 HG13 VAL A 55 7.364 -7.367 7.088 1.00 3.34 H new ATOM 0 HG21 VAL A 55 4.723 -7.407 5.362 1.00 42.51 H new ATOM 0 HG22 VAL A 55 6.324 -7.260 4.598 1.00 42.51 H new ATOM 0 HG23 VAL A 55 5.231 -8.583 4.126 1.00 42.51 H new ATOM 899 N VAL A 56 6.039 -11.523 4.673 1.00 42.53 N ATOM 900 CA VAL A 56 5.333 -12.380 3.706 1.00 53.32 C ATOM 901 C VAL A 56 3.809 -12.113 3.788 1.00 13.01 C ATOM 902 O VAL A 56 3.237 -12.131 4.881 1.00 71.13 O ATOM 903 CB VAL A 56 5.618 -13.907 3.976 1.00 53.31 C ATOM 904 CG1 VAL A 56 4.965 -14.814 2.898 1.00 74.43 C ATOM 905 CG2 VAL A 56 7.138 -14.188 4.095 1.00 45.10 C ATOM 0 H VAL A 56 5.781 -11.721 5.640 1.00 42.53 H new ATOM 0 HA VAL A 56 5.699 -12.138 2.708 1.00 53.32 H new ATOM 0 HB VAL A 56 5.158 -14.153 4.933 1.00 53.31 H new ATOM 0 HG11 VAL A 56 5.185 -15.858 3.120 1.00 74.43 H new ATOM 0 HG12 VAL A 56 3.886 -14.662 2.900 1.00 74.43 H new ATOM 0 HG13 VAL A 56 5.366 -14.559 1.917 1.00 74.43 H new ATOM 0 HG21 VAL A 56 7.298 -15.250 4.281 1.00 45.10 H new ATOM 0 HG22 VAL A 56 7.634 -13.903 3.167 1.00 45.10 H new ATOM 0 HG23 VAL A 56 7.552 -13.609 4.920 1.00 45.10 H new ATOM 915 N THR A 57 3.157 -11.886 2.627 1.00 45.34 N ATOM 916 CA THR A 57 1.695 -11.621 2.547 1.00 25.00 C ATOM 917 C THR A 57 0.937 -12.869 2.052 1.00 15.13 C ATOM 918 O THR A 57 1.316 -13.492 1.054 1.00 62.22 O ATOM 919 CB THR A 57 1.369 -10.417 1.594 1.00 73.03 C ATOM 920 OG1 THR A 57 2.062 -10.573 0.340 1.00 12.11 O ATOM 921 CG2 THR A 57 1.736 -9.064 2.219 1.00 61.34 C ATOM 0 H THR A 57 3.623 -11.880 1.720 1.00 45.34 H new ATOM 0 HA THR A 57 1.368 -11.367 3.555 1.00 25.00 H new ATOM 0 HB THR A 57 0.292 -10.424 1.427 1.00 73.03 H new ATOM 0 HG1 THR A 57 2.119 -9.706 -0.112 1.00 12.11 H new ATOM 0 HG21 THR A 57 1.492 -8.263 1.522 1.00 61.34 H new ATOM 0 HG22 THR A 57 1.174 -8.925 3.142 1.00 61.34 H new ATOM 0 HG23 THR A 57 2.804 -9.042 2.438 1.00 61.34 H new ATOM 929 N SER A 58 -0.159 -13.192 2.747 1.00 34.25 N ATOM 930 CA SER A 58 -1.010 -14.368 2.461 1.00 11.25 C ATOM 931 C SER A 58 -2.493 -14.033 2.727 1.00 4.53 C ATOM 932 O SER A 58 -2.817 -12.976 3.277 1.00 42.32 O ATOM 933 CB SER A 58 -0.565 -15.581 3.327 1.00 30.41 C ATOM 934 OG SER A 58 -1.332 -16.749 3.040 1.00 2.11 O ATOM 0 H SER A 58 -0.491 -12.640 3.538 1.00 34.25 H new ATOM 0 HA SER A 58 -0.897 -14.632 1.410 1.00 11.25 H new ATOM 0 HB2 SER A 58 0.490 -15.787 3.149 1.00 30.41 H new ATOM 0 HB3 SER A 58 -0.667 -15.330 4.383 1.00 30.41 H new ATOM 0 HG SER A 58 -1.022 -17.490 3.602 1.00 2.11 H new ATOM 940 N GLU A 59 -3.385 -14.935 2.308 1.00 73.31 N ATOM 941 CA GLU A 59 -4.846 -14.787 2.468 1.00 34.14 C ATOM 942 C GLU A 59 -5.383 -15.871 3.427 1.00 45.40 C ATOM 943 O GLU A 59 -5.288 -17.065 3.126 1.00 64.52 O ATOM 944 CB GLU A 59 -5.525 -14.913 1.078 1.00 52.33 C ATOM 945 CG GLU A 59 -7.068 -14.810 1.080 1.00 72.11 C ATOM 946 CD GLU A 59 -7.676 -15.191 -0.280 1.00 13.53 C ATOM 947 OE1 GLU A 59 -7.945 -16.389 -0.506 1.00 2.34 O ATOM 948 OE2 GLU A 59 -7.836 -14.307 -1.148 1.00 44.12 O ATOM 0 H GLU A 59 -3.116 -15.801 1.842 1.00 73.31 H new ATOM 0 HA GLU A 59 -5.072 -13.808 2.892 1.00 34.14 H new ATOM 0 HB2 GLU A 59 -5.127 -14.135 0.427 1.00 52.33 H new ATOM 0 HB3 GLU A 59 -5.243 -15.870 0.640 1.00 52.33 H new ATOM 0 HG2 GLU A 59 -7.473 -15.463 1.853 1.00 72.11 H new ATOM 0 HG3 GLU A 59 -7.362 -13.792 1.336 1.00 72.11 H new ATOM 955 N VAL A 60 -5.902 -15.454 4.598 1.00 23.44 N ATOM 956 CA VAL A 60 -6.571 -16.361 5.568 1.00 64.24 C ATOM 957 C VAL A 60 -7.924 -15.743 6.013 1.00 32.04 C ATOM 958 O VAL A 60 -7.977 -14.571 6.416 1.00 13.02 O ATOM 959 CB VAL A 60 -5.655 -16.655 6.829 1.00 43.33 C ATOM 960 CG1 VAL A 60 -6.388 -17.478 7.914 1.00 12.24 C ATOM 961 CG2 VAL A 60 -4.350 -17.380 6.424 1.00 32.34 C ATOM 0 H VAL A 60 -5.873 -14.481 4.904 1.00 23.44 H new ATOM 0 HA VAL A 60 -6.752 -17.314 5.071 1.00 64.24 H new ATOM 0 HB VAL A 60 -5.407 -15.682 7.253 1.00 43.33 H new ATOM 0 HG11 VAL A 60 -5.716 -17.651 8.755 1.00 12.24 H new ATOM 0 HG12 VAL A 60 -7.265 -16.929 8.257 1.00 12.24 H new ATOM 0 HG13 VAL A 60 -6.700 -18.435 7.496 1.00 12.24 H new ATOM 0 HG21 VAL A 60 -3.746 -17.566 7.312 1.00 32.34 H new ATOM 0 HG22 VAL A 60 -4.594 -18.329 5.946 1.00 32.34 H new ATOM 0 HG23 VAL A 60 -3.789 -16.757 5.728 1.00 32.34 H new ATOM 971 N GLU A 61 -9.009 -16.551 5.898 1.00 5.54 N ATOM 972 CA GLU A 61 -10.388 -16.203 6.339 1.00 31.43 C ATOM 973 C GLU A 61 -10.969 -14.983 5.567 1.00 10.21 C ATOM 974 O GLU A 61 -11.804 -14.237 6.096 1.00 52.41 O ATOM 975 CB GLU A 61 -10.415 -15.981 7.889 1.00 64.24 C ATOM 976 CG GLU A 61 -9.885 -17.175 8.718 1.00 71.34 C ATOM 977 CD GLU A 61 -10.802 -18.410 8.686 1.00 51.03 C ATOM 978 OE1 GLU A 61 -11.720 -18.508 9.530 1.00 64.53 O ATOM 979 OE2 GLU A 61 -10.617 -19.285 7.805 1.00 72.51 O ATOM 0 H GLU A 61 -8.950 -17.483 5.488 1.00 5.54 H new ATOM 0 HA GLU A 61 -11.039 -17.044 6.099 1.00 31.43 H new ATOM 0 HB2 GLU A 61 -9.822 -15.098 8.127 1.00 64.24 H new ATOM 0 HB3 GLU A 61 -11.439 -15.769 8.195 1.00 64.24 H new ATOM 0 HG2 GLU A 61 -8.900 -17.456 8.345 1.00 71.34 H new ATOM 0 HG3 GLU A 61 -9.755 -16.858 9.753 1.00 71.34 H new ATOM 986 N GLY A 62 -10.551 -14.829 4.288 1.00 34.05 N ATOM 987 CA GLY A 62 -10.982 -13.707 3.433 1.00 21.30 C ATOM 988 C GLY A 62 -10.349 -12.358 3.806 1.00 4.21 C ATOM 989 O GLY A 62 -10.884 -11.298 3.452 1.00 23.32 O ATOM 0 H GLY A 62 -9.911 -15.475 3.827 1.00 34.05 H new ATOM 0 HA2 GLY A 62 -10.736 -13.938 2.397 1.00 21.30 H new ATOM 0 HA3 GLY A 62 -12.067 -13.616 3.490 1.00 21.30 H new ATOM 993 N GLU A 63 -9.211 -12.395 4.527 1.00 72.21 N ATOM 994 CA GLU A 63 -8.522 -11.178 5.015 1.00 52.15 C ATOM 995 C GLU A 63 -6.986 -11.274 4.803 1.00 75.55 C ATOM 996 O GLU A 63 -6.443 -12.370 4.601 1.00 64.24 O ATOM 997 CB GLU A 63 -8.852 -10.983 6.522 1.00 21.10 C ATOM 998 CG GLU A 63 -8.549 -9.577 7.074 1.00 3.14 C ATOM 999 CD GLU A 63 -8.738 -9.465 8.592 1.00 62.11 C ATOM 1000 OE1 GLU A 63 -9.866 -9.698 9.081 1.00 73.34 O ATOM 1001 OE2 GLU A 63 -7.764 -9.144 9.304 1.00 23.40 O ATOM 0 H GLU A 63 -8.743 -13.263 4.788 1.00 72.21 H new ATOM 0 HA GLU A 63 -8.875 -10.319 4.445 1.00 52.15 H new ATOM 0 HB2 GLU A 63 -9.909 -11.199 6.679 1.00 21.10 H new ATOM 0 HB3 GLU A 63 -8.288 -11.714 7.101 1.00 21.10 H new ATOM 0 HG2 GLU A 63 -7.523 -9.309 6.822 1.00 3.14 H new ATOM 0 HG3 GLU A 63 -9.197 -8.853 6.580 1.00 3.14 H new ATOM 1008 N ILE A 64 -6.297 -10.113 4.870 1.00 14.42 N ATOM 1009 CA ILE A 64 -4.830 -10.024 4.722 1.00 73.44 C ATOM 1010 C ILE A 64 -4.119 -10.598 5.979 1.00 70.44 C ATOM 1011 O ILE A 64 -4.108 -9.967 7.034 1.00 55.24 O ATOM 1012 CB ILE A 64 -4.366 -8.530 4.494 1.00 62.24 C ATOM 1013 CG1 ILE A 64 -5.128 -7.875 3.293 1.00 11.04 C ATOM 1014 CG2 ILE A 64 -2.829 -8.443 4.287 1.00 61.50 C ATOM 1015 CD1 ILE A 64 -4.796 -6.404 3.049 1.00 11.01 C ATOM 0 H ILE A 64 -6.745 -9.210 5.029 1.00 14.42 H new ATOM 0 HA ILE A 64 -4.553 -10.613 3.848 1.00 73.44 H new ATOM 0 HB ILE A 64 -4.615 -7.969 5.395 1.00 62.24 H new ATOM 0 HG12 ILE A 64 -4.903 -8.439 2.388 1.00 11.04 H new ATOM 0 HG13 ILE A 64 -6.200 -7.967 3.468 1.00 11.04 H new ATOM 0 HG21 ILE A 64 -2.541 -7.403 4.133 1.00 61.50 H new ATOM 0 HG22 ILE A 64 -2.320 -8.833 5.168 1.00 61.50 H new ATOM 0 HG23 ILE A 64 -2.546 -9.031 3.414 1.00 61.50 H new ATOM 0 HD11 ILE A 64 -5.371 -6.037 2.199 1.00 11.01 H new ATOM 0 HD12 ILE A 64 -5.048 -5.822 3.935 1.00 11.01 H new ATOM 0 HD13 ILE A 64 -3.731 -6.301 2.839 1.00 11.01 H new ATOM 1027 N PHE A 65 -3.562 -11.805 5.847 1.00 15.23 N ATOM 1028 CA PHE A 65 -2.734 -12.446 6.892 1.00 70.43 C ATOM 1029 C PHE A 65 -1.247 -12.283 6.536 1.00 74.03 C ATOM 1030 O PHE A 65 -0.810 -12.745 5.484 1.00 23.10 O ATOM 1031 CB PHE A 65 -3.094 -13.948 7.011 1.00 71.44 C ATOM 1032 CG PHE A 65 -2.208 -14.747 7.978 1.00 64.22 C ATOM 1033 CD1 PHE A 65 -2.425 -14.697 9.353 1.00 32.50 C ATOM 1034 CD2 PHE A 65 -1.154 -15.543 7.506 1.00 43.15 C ATOM 1035 CE1 PHE A 65 -1.628 -15.414 10.222 1.00 43.25 C ATOM 1036 CE2 PHE A 65 -0.359 -16.256 8.378 1.00 33.12 C ATOM 1037 CZ PHE A 65 -0.596 -16.190 9.735 1.00 13.41 C ATOM 0 H PHE A 65 -3.669 -12.375 5.008 1.00 15.23 H new ATOM 0 HA PHE A 65 -2.929 -11.967 7.851 1.00 70.43 H new ATOM 0 HB2 PHE A 65 -4.131 -14.034 7.335 1.00 71.44 H new ATOM 0 HB3 PHE A 65 -3.030 -14.402 6.022 1.00 71.44 H new ATOM 0 HD1 PHE A 65 -3.227 -14.089 9.744 1.00 32.50 H new ATOM 0 HD2 PHE A 65 -0.962 -15.598 6.445 1.00 43.15 H new ATOM 0 HE1 PHE A 65 -1.812 -15.368 11.285 1.00 43.25 H new ATOM 0 HE2 PHE A 65 0.448 -16.865 7.999 1.00 33.12 H new ATOM 0 HZ PHE A 65 0.028 -16.747 10.418 1.00 13.41 H new ATOM 1047 N VAL A 66 -0.460 -11.649 7.417 1.00 44.11 N ATOM 1048 CA VAL A 66 0.991 -11.450 7.180 1.00 33.11 C ATOM 1049 C VAL A 66 1.838 -12.011 8.335 1.00 45.24 C ATOM 1050 O VAL A 66 1.369 -12.161 9.466 1.00 32.15 O ATOM 1051 CB VAL A 66 1.353 -9.938 6.929 1.00 61.10 C ATOM 1052 CG1 VAL A 66 0.555 -9.374 5.733 1.00 1.52 C ATOM 1053 CG2 VAL A 66 1.143 -9.081 8.196 1.00 32.24 C ATOM 0 H VAL A 66 -0.795 -11.264 8.300 1.00 44.11 H new ATOM 0 HA VAL A 66 1.229 -12.007 6.274 1.00 33.11 H new ATOM 0 HB VAL A 66 2.414 -9.890 6.682 1.00 61.10 H new ATOM 0 HG11 VAL A 66 0.821 -8.328 5.578 1.00 1.52 H new ATOM 0 HG12 VAL A 66 0.792 -9.945 4.836 1.00 1.52 H new ATOM 0 HG13 VAL A 66 -0.513 -9.450 5.940 1.00 1.52 H new ATOM 0 HG21 VAL A 66 1.404 -8.045 7.982 1.00 32.24 H new ATOM 0 HG22 VAL A 66 0.099 -9.136 8.504 1.00 32.24 H new ATOM 0 HG23 VAL A 66 1.778 -9.456 8.998 1.00 32.24 H new ATOM 1063 N LYS A 67 3.096 -12.312 8.009 1.00 23.21 N ATOM 1064 CA LYS A 67 4.098 -12.835 8.962 1.00 10.21 C ATOM 1065 C LYS A 67 5.472 -12.246 8.609 1.00 63.44 C ATOM 1066 O LYS A 67 5.669 -11.792 7.493 1.00 14.33 O ATOM 1067 CB LYS A 67 4.125 -14.390 8.903 1.00 3.05 C ATOM 1068 CG LYS A 67 4.249 -14.970 7.475 1.00 50.02 C ATOM 1069 CD LYS A 67 4.323 -16.513 7.453 1.00 23.55 C ATOM 1070 CE LYS A 67 4.356 -17.080 6.022 1.00 42.13 C ATOM 1071 NZ LYS A 67 4.629 -18.538 6.008 1.00 54.32 N ATOM 0 H LYS A 67 3.461 -12.200 7.063 1.00 23.21 H new ATOM 0 HA LYS A 67 3.837 -12.543 9.979 1.00 10.21 H new ATOM 0 HB2 LYS A 67 4.961 -14.750 9.503 1.00 3.05 H new ATOM 0 HB3 LYS A 67 3.214 -14.775 9.361 1.00 3.05 H new ATOM 0 HG2 LYS A 67 3.395 -14.645 6.881 1.00 50.02 H new ATOM 0 HG3 LYS A 67 5.141 -14.562 7.000 1.00 50.02 H new ATOM 0 HD2 LYS A 67 5.214 -16.839 7.990 1.00 23.55 H new ATOM 0 HD3 LYS A 67 3.463 -16.923 7.983 1.00 23.55 H new ATOM 0 HE2 LYS A 67 3.402 -16.885 5.533 1.00 42.13 H new ATOM 0 HE3 LYS A 67 5.122 -16.562 5.444 1.00 42.13 H new ATOM 0 HZ1 LYS A 67 4.643 -18.879 5.026 1.00 54.32 H new ATOM 0 HZ2 LYS A 67 5.551 -18.723 6.452 1.00 54.32 H new ATOM 0 HZ3 LYS A 67 3.885 -19.036 6.537 1.00 54.32 H new ATOM 1085 N LEU A 68 6.421 -12.240 9.556 1.00 21.55 N ATOM 1086 CA LEU A 68 7.798 -11.763 9.273 1.00 15.03 C ATOM 1087 C LEU A 68 8.574 -12.797 8.426 1.00 51.00 C ATOM 1088 O LEU A 68 8.199 -13.975 8.377 1.00 72.13 O ATOM 1089 CB LEU A 68 8.569 -11.471 10.591 1.00 71.31 C ATOM 1090 CG LEU A 68 7.899 -10.456 11.572 1.00 12.30 C ATOM 1091 CD1 LEU A 68 8.827 -10.132 12.765 1.00 5.52 C ATOM 1092 CD2 LEU A 68 7.452 -9.168 10.840 1.00 50.32 C ATOM 0 H LEU A 68 6.272 -12.554 10.515 1.00 21.55 H new ATOM 0 HA LEU A 68 7.717 -10.836 8.706 1.00 15.03 H new ATOM 0 HB2 LEU A 68 8.714 -12.413 11.119 1.00 71.31 H new ATOM 0 HB3 LEU A 68 9.559 -11.095 10.333 1.00 71.31 H new ATOM 0 HG LEU A 68 7.003 -10.931 11.970 1.00 12.30 H new ATOM 0 HD11 LEU A 68 8.332 -9.423 13.429 1.00 5.52 H new ATOM 0 HD12 LEU A 68 9.049 -11.048 13.312 1.00 5.52 H new ATOM 0 HD13 LEU A 68 9.755 -9.696 12.396 1.00 5.52 H new ATOM 0 HD21 LEU A 68 6.990 -8.485 11.554 1.00 50.32 H new ATOM 0 HD22 LEU A 68 8.319 -8.687 10.387 1.00 50.32 H new ATOM 0 HD23 LEU A 68 6.731 -9.423 10.063 1.00 50.32 H new ATOM 1104 N VAL A 69 9.636 -12.347 7.733 1.00 13.14 N ATOM 1105 CA VAL A 69 10.604 -13.270 7.097 1.00 52.05 C ATOM 1106 C VAL A 69 11.571 -13.794 8.194 1.00 2.45 C ATOM 1107 O VAL A 69 12.667 -13.264 8.413 1.00 63.33 O ATOM 1108 CB VAL A 69 11.377 -12.601 5.894 1.00 23.10 C ATOM 1109 CG1 VAL A 69 12.344 -13.595 5.201 1.00 20.31 C ATOM 1110 CG2 VAL A 69 10.381 -12.019 4.867 1.00 54.10 C ATOM 0 H VAL A 69 9.848 -11.358 7.598 1.00 13.14 H new ATOM 0 HA VAL A 69 10.063 -14.107 6.656 1.00 52.05 H new ATOM 0 HB VAL A 69 11.978 -11.791 6.306 1.00 23.10 H new ATOM 0 HG11 VAL A 69 12.855 -13.093 4.379 1.00 20.31 H new ATOM 0 HG12 VAL A 69 13.080 -13.950 5.923 1.00 20.31 H new ATOM 0 HG13 VAL A 69 11.778 -14.442 4.813 1.00 20.31 H new ATOM 0 HG21 VAL A 69 10.932 -11.562 4.045 1.00 54.10 H new ATOM 0 HG22 VAL A 69 9.749 -12.818 4.480 1.00 54.10 H new ATOM 0 HG23 VAL A 69 9.759 -11.266 5.350 1.00 54.10 H new ATOM 1302 N MET B 3 -0.177 -15.075 -4.308 1.00 10.51 N ATOM 1303 CA MET B 3 0.417 -14.199 -3.274 1.00 24.14 C ATOM 1304 C MET B 3 -0.146 -12.759 -3.397 1.00 74.12 C ATOM 1305 O MET B 3 -0.273 -12.230 -4.505 1.00 72.31 O ATOM 1306 CB MET B 3 1.964 -14.177 -3.413 1.00 1.21 C ATOM 1307 CG MET B 3 2.629 -15.565 -3.401 1.00 51.31 C ATOM 1308 SD MET B 3 2.343 -16.486 -1.870 1.00 41.15 S ATOM 1309 CE MET B 3 3.209 -15.483 -0.656 1.00 45.44 C ATOM 0 HA MET B 3 0.155 -14.595 -2.293 1.00 24.14 H new ATOM 0 HB2 MET B 3 2.225 -13.672 -4.343 1.00 1.21 H new ATOM 0 HB3 MET B 3 2.380 -13.582 -2.600 1.00 1.21 H new ATOM 0 HG2 MET B 3 2.253 -16.147 -4.242 1.00 51.31 H new ATOM 0 HG3 MET B 3 3.702 -15.447 -3.550 1.00 51.31 H new ATOM 0 HE1 MET B 3 3.081 -15.920 0.334 1.00 45.44 H new ATOM 0 HE2 MET B 3 4.270 -15.448 -0.903 1.00 45.44 H new ATOM 0 HE3 MET B 3 2.802 -14.472 -0.662 1.00 45.44 H new ATOM 1319 N LEU B 4 -0.459 -12.126 -2.248 1.00 24.44 N ATOM 1320 CA LEU B 4 -0.946 -10.715 -2.204 1.00 43.33 C ATOM 1321 C LEU B 4 0.175 -9.717 -2.620 1.00 21.51 C ATOM 1322 O LEU B 4 -0.099 -8.565 -2.975 1.00 55.41 O ATOM 1323 CB LEU B 4 -1.526 -10.377 -0.795 1.00 44.54 C ATOM 1324 CG LEU B 4 -2.949 -10.952 -0.454 1.00 40.14 C ATOM 1325 CD1 LEU B 4 -3.010 -12.494 -0.569 1.00 2.33 C ATOM 1326 CD2 LEU B 4 -3.406 -10.490 0.950 1.00 12.02 C ATOM 0 H LEU B 4 -0.386 -12.564 -1.330 1.00 24.44 H new ATOM 0 HA LEU B 4 -1.753 -10.610 -2.929 1.00 43.33 H new ATOM 0 HB2 LEU B 4 -0.825 -10.740 -0.044 1.00 44.54 H new ATOM 0 HB3 LEU B 4 -1.566 -9.292 -0.696 1.00 44.54 H new ATOM 0 HG LEU B 4 -3.637 -10.551 -1.198 1.00 40.14 H new ATOM 0 HD11 LEU B 4 -4.015 -12.838 -0.323 1.00 2.33 H new ATOM 0 HD12 LEU B 4 -2.764 -12.793 -1.588 1.00 2.33 H new ATOM 0 HD13 LEU B 4 -2.295 -12.939 0.123 1.00 2.33 H new ATOM 0 HD21 LEU B 4 -4.393 -10.900 1.165 1.00 12.02 H new ATOM 0 HD22 LEU B 4 -2.696 -10.843 1.698 1.00 12.02 H new ATOM 0 HD23 LEU B 4 -3.451 -9.401 0.978 1.00 12.02 H new ATOM 1338 N LYS B 5 1.432 -10.197 -2.578 1.00 74.54 N ATOM 1339 CA LYS B 5 2.607 -9.491 -3.131 1.00 32.30 C ATOM 1340 C LYS B 5 2.496 -9.371 -4.674 1.00 14.32 C ATOM 1341 O LYS B 5 2.775 -8.314 -5.256 1.00 44.13 O ATOM 1342 CB LYS B 5 3.892 -10.281 -2.758 1.00 14.41 C ATOM 1343 CG LYS B 5 5.216 -9.563 -3.096 1.00 2.31 C ATOM 1344 CD LYS B 5 6.468 -10.394 -2.727 1.00 2.23 C ATOM 1345 CE LYS B 5 7.783 -9.648 -3.016 1.00 14.24 C ATOM 1346 NZ LYS B 5 7.916 -8.395 -2.220 1.00 13.52 N ATOM 0 H LYS B 5 1.665 -11.095 -2.155 1.00 74.54 H new ATOM 0 HA LYS B 5 2.651 -8.486 -2.711 1.00 32.30 H new ATOM 0 HB2 LYS B 5 3.873 -10.493 -1.689 1.00 14.41 H new ATOM 0 HB3 LYS B 5 3.874 -11.241 -3.274 1.00 14.41 H new ATOM 0 HG2 LYS B 5 5.238 -9.337 -4.162 1.00 2.31 H new ATOM 0 HG3 LYS B 5 5.251 -8.610 -2.568 1.00 2.31 H new ATOM 0 HD2 LYS B 5 6.428 -10.654 -1.669 1.00 2.23 H new ATOM 0 HD3 LYS B 5 6.456 -11.330 -3.286 1.00 2.23 H new ATOM 0 HE2 LYS B 5 8.625 -10.305 -2.797 1.00 14.24 H new ATOM 0 HE3 LYS B 5 7.834 -9.407 -4.078 1.00 14.24 H new ATOM 0 HZ1 LYS B 5 7.948 -7.578 -2.862 1.00 13.52 H new ATOM 0 HZ2 LYS B 5 7.101 -8.302 -1.581 1.00 13.52 H new ATOM 0 HZ3 LYS B 5 8.792 -8.430 -1.661 1.00 13.52 H new ATOM 1360 N GLU B 6 2.080 -10.483 -5.316 1.00 1.20 N ATOM 1361 CA GLU B 6 1.916 -10.560 -6.788 1.00 4.01 C ATOM 1362 C GLU B 6 0.652 -9.811 -7.255 1.00 73.22 C ATOM 1363 O GLU B 6 0.583 -9.345 -8.392 1.00 73.13 O ATOM 1364 CB GLU B 6 1.851 -12.037 -7.267 1.00 52.22 C ATOM 1365 CG GLU B 6 3.025 -12.930 -6.804 1.00 32.10 C ATOM 1366 CD GLU B 6 4.415 -12.342 -7.106 1.00 22.52 C ATOM 1367 OE1 GLU B 6 4.914 -12.515 -8.238 1.00 42.54 O ATOM 1368 OE2 GLU B 6 5.024 -11.712 -6.202 1.00 72.13 O ATOM 0 H GLU B 6 1.848 -11.351 -4.833 1.00 1.20 H new ATOM 0 HA GLU B 6 2.789 -10.081 -7.231 1.00 4.01 H new ATOM 0 HB2 GLU B 6 0.919 -12.477 -6.912 1.00 52.22 H new ATOM 0 HB3 GLU B 6 1.814 -12.048 -8.356 1.00 52.22 H new ATOM 0 HG2 GLU B 6 2.938 -13.099 -5.731 1.00 32.10 H new ATOM 0 HG3 GLU B 6 2.941 -13.903 -7.287 1.00 32.10 H new ATOM 1375 N LYS B 7 -0.349 -9.734 -6.358 1.00 41.43 N ATOM 1376 CA LYS B 7 -1.595 -8.963 -6.572 1.00 73.43 C ATOM 1377 C LYS B 7 -1.241 -7.457 -6.730 1.00 73.40 C ATOM 1378 O LYS B 7 -1.638 -6.806 -7.703 1.00 61.40 O ATOM 1379 CB LYS B 7 -2.564 -9.213 -5.358 1.00 73.01 C ATOM 1380 CG LYS B 7 -4.081 -9.175 -5.673 1.00 54.21 C ATOM 1381 CD LYS B 7 -4.589 -7.809 -6.191 1.00 50.33 C ATOM 1382 CE LYS B 7 -6.087 -7.842 -6.565 1.00 50.32 C ATOM 1383 NZ LYS B 7 -6.526 -6.602 -7.253 1.00 60.11 N ATOM 0 H LYS B 7 -0.318 -10.208 -5.455 1.00 41.43 H new ATOM 0 HA LYS B 7 -2.101 -9.286 -7.482 1.00 73.43 H new ATOM 0 HB2 LYS B 7 -2.328 -10.186 -4.926 1.00 73.01 H new ATOM 0 HB3 LYS B 7 -2.354 -8.465 -4.593 1.00 73.01 H new ATOM 0 HG2 LYS B 7 -4.305 -9.939 -6.418 1.00 54.21 H new ATOM 0 HG3 LYS B 7 -4.634 -9.437 -4.771 1.00 54.21 H new ATOM 0 HD2 LYS B 7 -4.425 -7.050 -5.427 1.00 50.33 H new ATOM 0 HD3 LYS B 7 -4.006 -7.514 -7.063 1.00 50.33 H new ATOM 0 HE2 LYS B 7 -6.279 -8.699 -7.210 1.00 50.32 H new ATOM 0 HE3 LYS B 7 -6.681 -7.983 -5.662 1.00 50.32 H new ATOM 0 HZ1 LYS B 7 -7.347 -6.812 -7.856 1.00 60.11 H new ATOM 0 HZ2 LYS B 7 -6.790 -5.887 -6.545 1.00 60.11 H new ATOM 0 HZ3 LYS B 7 -5.749 -6.237 -7.841 1.00 60.11 H new ATOM 1397 N ALA B 8 -0.454 -6.950 -5.765 1.00 64.45 N ATOM 1398 CA ALA B 8 0.046 -5.557 -5.747 1.00 61.13 C ATOM 1399 C ALA B 8 0.912 -5.232 -6.995 1.00 5.43 C ATOM 1400 O ALA B 8 0.764 -4.165 -7.607 1.00 53.13 O ATOM 1401 CB ALA B 8 0.841 -5.321 -4.455 1.00 32.11 C ATOM 0 H ALA B 8 -0.141 -7.500 -4.965 1.00 64.45 H new ATOM 0 HA ALA B 8 -0.811 -4.885 -5.777 1.00 61.13 H new ATOM 0 HB1 ALA B 8 1.211 -4.296 -4.438 1.00 32.11 H new ATOM 0 HB2 ALA B 8 0.194 -5.488 -3.594 1.00 32.11 H new ATOM 0 HB3 ALA B 8 1.683 -6.012 -4.415 1.00 32.11 H new ATOM 1407 N GLY B 9 1.800 -6.181 -7.359 1.00 52.44 N ATOM 1408 CA GLY B 9 2.656 -6.056 -8.551 1.00 61.52 C ATOM 1409 C GLY B 9 1.891 -6.074 -9.884 1.00 14.41 C ATOM 1410 O GLY B 9 2.275 -5.390 -10.840 1.00 23.10 O ATOM 0 H GLY B 9 1.941 -7.047 -6.838 1.00 52.44 H new ATOM 0 HA2 GLY B 9 3.221 -5.126 -8.482 1.00 61.52 H new ATOM 0 HA3 GLY B 9 3.381 -6.870 -8.550 1.00 61.52 H new ATOM 1414 N ALA B 10 0.815 -6.876 -9.950 1.00 42.20 N ATOM 1415 CA ALA B 10 -0.059 -6.973 -11.146 1.00 42.13 C ATOM 1416 C ALA B 10 -0.885 -5.681 -11.375 1.00 54.23 C ATOM 1417 O ALA B 10 -1.199 -5.330 -12.516 1.00 1.41 O ATOM 1418 CB ALA B 10 -0.991 -8.181 -11.013 1.00 55.42 C ATOM 0 H ALA B 10 0.521 -7.477 -9.180 1.00 42.20 H new ATOM 0 HA ALA B 10 0.586 -7.101 -12.015 1.00 42.13 H new ATOM 0 HB1 ALA B 10 -1.630 -8.246 -11.894 1.00 55.42 H new ATOM 0 HB2 ALA B 10 -0.397 -9.091 -10.927 1.00 55.42 H new ATOM 0 HB3 ALA B 10 -1.610 -8.066 -10.123 1.00 55.42 H new ATOM 1424 N LEU B 11 -1.252 -5.001 -10.275 1.00 0.25 N ATOM 1425 CA LEU B 11 -1.952 -3.696 -10.325 1.00 53.35 C ATOM 1426 C LEU B 11 -0.982 -2.543 -10.675 1.00 44.04 C ATOM 1427 O LEU B 11 -1.395 -1.545 -11.258 1.00 23.02 O ATOM 1428 CB LEU B 11 -2.642 -3.408 -8.968 1.00 0.24 C ATOM 1429 CG LEU B 11 -3.712 -4.449 -8.517 1.00 75.44 C ATOM 1430 CD1 LEU B 11 -4.258 -4.112 -7.121 1.00 53.34 C ATOM 1431 CD2 LEU B 11 -4.857 -4.571 -9.545 1.00 54.41 C ATOM 0 H LEU B 11 -1.075 -5.335 -9.328 1.00 0.25 H new ATOM 0 HA LEU B 11 -2.705 -3.754 -11.111 1.00 53.35 H new ATOM 0 HB2 LEU B 11 -1.874 -3.347 -8.197 1.00 0.24 H new ATOM 0 HB3 LEU B 11 -3.116 -2.428 -9.024 1.00 0.24 H new ATOM 0 HG LEU B 11 -3.218 -5.419 -8.461 1.00 75.44 H new ATOM 0 HD11 LEU B 11 -5.002 -4.854 -6.832 1.00 53.34 H new ATOM 0 HD12 LEU B 11 -3.441 -4.118 -6.400 1.00 53.34 H new ATOM 0 HD13 LEU B 11 -4.719 -3.124 -7.139 1.00 53.34 H new ATOM 0 HD21 LEU B 11 -5.583 -5.306 -9.196 1.00 54.41 H new ATOM 0 HD22 LEU B 11 -5.346 -3.604 -9.661 1.00 54.41 H new ATOM 0 HD23 LEU B 11 -4.451 -4.890 -10.505 1.00 54.41 H new ATOM 1443 N ALA B 12 0.303 -2.707 -10.315 1.00 33.32 N ATOM 1444 CA ALA B 12 1.335 -1.656 -10.465 1.00 73.40 C ATOM 1445 C ALA B 12 1.482 -1.116 -11.912 1.00 64.11 C ATOM 1446 O ALA B 12 1.353 0.093 -12.144 1.00 74.23 O ATOM 1447 CB ALA B 12 2.688 -2.177 -9.959 1.00 40.31 C ATOM 0 H ALA B 12 0.660 -3.573 -9.911 1.00 33.32 H new ATOM 0 HA ALA B 12 1.000 -0.813 -9.861 1.00 73.40 H new ATOM 0 HB1 ALA B 12 3.443 -1.399 -10.072 1.00 40.31 H new ATOM 0 HB2 ALA B 12 2.603 -2.449 -8.907 1.00 40.31 H new ATOM 0 HB3 ALA B 12 2.980 -3.053 -10.538 1.00 40.31 H new ATOM 1453 N GLY B 13 1.732 -2.031 -12.864 1.00 31.21 N ATOM 1454 CA GLY B 13 1.970 -1.667 -14.272 1.00 71.04 C ATOM 1455 C GLY B 13 0.820 -0.891 -14.934 1.00 24.35 C ATOM 1456 O GLY B 13 1.034 0.174 -15.510 1.00 0.34 O ATOM 0 H GLY B 13 1.775 -3.034 -12.683 1.00 31.21 H new ATOM 0 HA2 GLY B 13 2.877 -1.066 -14.330 1.00 71.04 H new ATOM 0 HA3 GLY B 13 2.153 -2.577 -14.843 1.00 71.04 H new ATOM 1460 N GLN B 14 -0.403 -1.428 -14.811 1.00 13.52 N ATOM 1461 CA GLN B 14 -1.628 -0.834 -15.408 1.00 11.40 C ATOM 1462 C GLN B 14 -1.993 0.553 -14.796 1.00 24.14 C ATOM 1463 O GLN B 14 -2.461 1.447 -15.514 1.00 63.34 O ATOM 1464 CB GLN B 14 -2.813 -1.828 -15.261 1.00 44.14 C ATOM 1465 CG GLN B 14 -3.100 -2.261 -13.810 1.00 3.34 C ATOM 1466 CD GLN B 14 -4.307 -3.180 -13.654 1.00 15.12 C ATOM 1467 OE1 GLN B 14 -4.658 -3.926 -14.556 1.00 44.53 O ATOM 1468 NE2 GLN B 14 -4.936 -3.150 -12.500 1.00 33.10 N ATOM 0 H GLN B 14 -0.580 -2.290 -14.295 1.00 13.52 H new ATOM 0 HA GLN B 14 -1.423 -0.656 -16.464 1.00 11.40 H new ATOM 0 HB2 GLN B 14 -3.711 -1.369 -15.675 1.00 44.14 H new ATOM 0 HB3 GLN B 14 -2.604 -2.716 -15.858 1.00 44.14 H new ATOM 0 HG2 GLN B 14 -2.220 -2.767 -13.414 1.00 3.34 H new ATOM 0 HG3 GLN B 14 -3.256 -1.370 -13.202 1.00 3.34 H new ATOM 0 HE21 GLN B 14 -4.622 -2.517 -11.764 1.00 33.10 H new ATOM 0 HE22 GLN B 14 -5.738 -3.759 -12.340 1.00 33.10 H new ATOM 1477 N ILE B 15 -1.777 0.724 -13.469 1.00 64.50 N ATOM 1478 CA ILE B 15 -1.987 2.026 -12.779 1.00 42.43 C ATOM 1479 C ILE B 15 -0.955 3.073 -13.271 1.00 2.31 C ATOM 1480 O ILE B 15 -1.316 4.208 -13.579 1.00 71.23 O ATOM 1481 CB ILE B 15 -1.923 1.858 -11.205 1.00 74.40 C ATOM 1482 CG1 ILE B 15 -3.137 1.004 -10.700 1.00 1.11 C ATOM 1483 CG2 ILE B 15 -1.863 3.224 -10.466 1.00 60.05 C ATOM 1484 CD1 ILE B 15 -3.101 0.648 -9.218 1.00 52.44 C ATOM 0 H ILE B 15 -1.457 -0.023 -12.852 1.00 64.50 H new ATOM 0 HA ILE B 15 -2.985 2.386 -13.029 1.00 42.43 H new ATOM 0 HB ILE B 15 -0.997 1.333 -10.971 1.00 74.40 H new ATOM 0 HG12 ILE B 15 -4.057 1.551 -10.905 1.00 1.11 H new ATOM 0 HG13 ILE B 15 -3.179 0.082 -11.279 1.00 1.11 H new ATOM 0 HG21 ILE B 15 -1.820 3.054 -9.390 1.00 60.05 H new ATOM 0 HG22 ILE B 15 -0.974 3.770 -10.783 1.00 60.05 H new ATOM 0 HG23 ILE B 15 -2.752 3.807 -10.706 1.00 60.05 H new ATOM 0 HD11 ILE B 15 -3.981 0.057 -8.964 1.00 52.44 H new ATOM 0 HD12 ILE B 15 -2.202 0.070 -9.004 1.00 52.44 H new ATOM 0 HD13 ILE B 15 -3.094 1.562 -8.624 1.00 52.44 H new ATOM 1496 N TRP B 16 0.319 2.651 -13.371 1.00 11.41 N ATOM 1497 CA TRP B 16 1.419 3.477 -13.923 1.00 63.42 C ATOM 1498 C TRP B 16 1.070 3.994 -15.349 1.00 74.22 C ATOM 1499 O TRP B 16 1.264 5.172 -15.660 1.00 75.13 O ATOM 1500 CB TRP B 16 2.729 2.636 -13.952 1.00 20.01 C ATOM 1501 CG TRP B 16 3.974 3.391 -14.388 1.00 14.32 C ATOM 1502 CD1 TRP B 16 4.887 4.000 -13.578 1.00 34.23 C ATOM 1503 CD2 TRP B 16 4.437 3.605 -15.737 1.00 3.33 C ATOM 1504 NE1 TRP B 16 5.865 4.592 -14.331 1.00 64.33 N ATOM 1505 CE2 TRP B 16 5.607 4.372 -15.656 1.00 35.44 C ATOM 1506 CE3 TRP B 16 3.954 3.240 -17.002 1.00 63.32 C ATOM 1507 CZ2 TRP B 16 6.316 4.768 -16.788 1.00 64.13 C ATOM 1508 CZ3 TRP B 16 4.651 3.631 -18.123 1.00 23.44 C ATOM 1509 CH2 TRP B 16 5.815 4.400 -18.012 1.00 3.53 C ATOM 0 H TRP B 16 0.620 1.724 -13.071 1.00 11.41 H new ATOM 0 HA TRP B 16 1.561 4.348 -13.283 1.00 63.42 H new ATOM 0 HB2 TRP B 16 2.902 2.227 -12.956 1.00 20.01 H new ATOM 0 HB3 TRP B 16 2.583 1.789 -14.623 1.00 20.01 H new ATOM 0 HD1 TRP B 16 4.844 4.013 -12.499 1.00 34.23 H new ATOM 0 HE1 TRP B 16 6.660 5.114 -13.962 1.00 64.33 H new ATOM 0 HE3 TRP B 16 3.048 2.660 -17.096 1.00 63.32 H new ATOM 0 HZ2 TRP B 16 7.226 5.343 -16.706 1.00 64.13 H new ATOM 0 HZ3 TRP B 16 4.295 3.341 -19.100 1.00 23.44 H new ATOM 0 HH2 TRP B 16 6.330 4.711 -18.909 1.00 3.53 H new ATOM 1520 N GLU B 17 0.541 3.082 -16.195 1.00 74.24 N ATOM 1521 CA GLU B 17 0.137 3.384 -17.594 1.00 62.42 C ATOM 1522 C GLU B 17 -1.074 4.351 -17.661 1.00 25.33 C ATOM 1523 O GLU B 17 -1.240 5.065 -18.654 1.00 30.44 O ATOM 1524 CB GLU B 17 -0.156 2.065 -18.364 1.00 32.23 C ATOM 1525 CG GLU B 17 1.082 1.162 -18.551 1.00 51.04 C ATOM 1526 CD GLU B 17 0.769 -0.156 -19.276 1.00 54.20 C ATOM 1527 OE1 GLU B 17 0.340 -1.130 -18.614 1.00 21.40 O ATOM 1528 OE2 GLU B 17 0.937 -0.225 -20.515 1.00 40.35 O ATOM 0 H GLU B 17 0.380 2.111 -15.929 1.00 74.24 H new ATOM 0 HA GLU B 17 0.971 3.895 -18.075 1.00 62.42 H new ATOM 0 HB2 GLU B 17 -0.924 1.506 -17.829 1.00 32.23 H new ATOM 0 HB3 GLU B 17 -0.566 2.311 -19.344 1.00 32.23 H new ATOM 0 HG2 GLU B 17 1.839 1.707 -19.114 1.00 51.04 H new ATOM 0 HG3 GLU B 17 1.511 0.938 -17.574 1.00 51.04 H new ATOM 1535 N ALA B 18 -1.910 4.363 -16.603 1.00 63.31 N ATOM 1536 CA ALA B 18 -3.014 5.347 -16.461 1.00 40.22 C ATOM 1537 C ALA B 18 -2.465 6.776 -16.194 1.00 35.52 C ATOM 1538 O ALA B 18 -2.985 7.761 -16.727 1.00 3.10 O ATOM 1539 CB ALA B 18 -3.975 4.911 -15.340 1.00 12.33 C ATOM 0 H ALA B 18 -1.845 3.702 -15.829 1.00 63.31 H new ATOM 0 HA ALA B 18 -3.566 5.377 -17.401 1.00 40.22 H new ATOM 0 HB1 ALA B 18 -4.779 5.641 -15.246 1.00 12.33 H new ATOM 0 HB2 ALA B 18 -4.396 3.935 -15.581 1.00 12.33 H new ATOM 0 HB3 ALA B 18 -3.430 4.848 -14.398 1.00 12.33 H new ATOM 1545 N LEU B 19 -1.411 6.866 -15.355 1.00 2.33 N ATOM 1546 CA LEU B 19 -0.716 8.147 -15.045 1.00 22.42 C ATOM 1547 C LEU B 19 0.271 8.563 -16.168 1.00 25.10 C ATOM 1548 O LEU B 19 0.695 9.725 -16.222 1.00 2.15 O ATOM 1549 CB LEU B 19 0.049 8.061 -13.687 1.00 52.13 C ATOM 1550 CG LEU B 19 -0.805 8.131 -12.375 1.00 31.23 C ATOM 1551 CD1 LEU B 19 -1.767 6.939 -12.246 1.00 21.20 C ATOM 1552 CD2 LEU B 19 0.104 8.243 -11.125 1.00 4.04 C ATOM 0 H LEU B 19 -1.014 6.060 -14.872 1.00 2.33 H new ATOM 0 HA LEU B 19 -1.493 8.908 -14.972 1.00 22.42 H new ATOM 0 HB2 LEU B 19 0.610 7.127 -13.675 1.00 52.13 H new ATOM 0 HB3 LEU B 19 0.778 8.871 -13.659 1.00 52.13 H new ATOM 0 HG LEU B 19 -1.415 9.032 -12.439 1.00 31.23 H new ATOM 0 HD11 LEU B 19 -2.338 7.030 -11.322 1.00 21.20 H new ATOM 0 HD12 LEU B 19 -2.450 6.929 -13.095 1.00 21.20 H new ATOM 0 HD13 LEU B 19 -1.196 6.011 -12.229 1.00 21.20 H new ATOM 0 HD21 LEU B 19 -0.514 8.290 -10.229 1.00 4.04 H new ATOM 0 HD22 LEU B 19 0.757 7.372 -11.070 1.00 4.04 H new ATOM 0 HD23 LEU B 19 0.710 9.146 -11.196 1.00 4.04 H new ATOM 1564 N ASN B 20 0.657 7.609 -17.039 1.00 3.41 N ATOM 1565 CA ASN B 20 1.592 7.876 -18.157 1.00 1.24 C ATOM 1566 C ASN B 20 0.939 8.816 -19.204 1.00 54.51 C ATOM 1567 O ASN B 20 -0.174 8.562 -19.672 1.00 5.11 O ATOM 1568 CB ASN B 20 2.060 6.539 -18.798 1.00 53.10 C ATOM 1569 CG ASN B 20 3.166 6.709 -19.844 1.00 5.45 C ATOM 1570 OD1 ASN B 20 3.999 7.605 -19.751 1.00 44.11 O ATOM 1571 ND2 ASN B 20 3.188 5.847 -20.843 1.00 11.21 N ATOM 0 H ASN B 20 0.336 6.642 -16.991 1.00 3.41 H new ATOM 0 HA ASN B 20 2.473 8.385 -17.767 1.00 1.24 H new ATOM 0 HB2 ASN B 20 2.416 5.875 -18.011 1.00 53.10 H new ATOM 0 HB3 ASN B 20 1.204 6.051 -19.264 1.00 53.10 H new ATOM 0 HD21 ASN B 20 3.909 5.917 -21.561 1.00 11.21 H new ATOM 0 HD22 ASN B 20 2.484 5.111 -20.897 1.00 11.21 H new ATOM 1578 N GLY B 21 1.642 9.916 -19.535 1.00 4.41 N ATOM 1579 CA GLY B 21 1.100 10.980 -20.405 1.00 70.34 C ATOM 1580 C GLY B 21 0.679 12.232 -19.618 1.00 75.44 C ATOM 1581 O GLY B 21 0.511 13.310 -20.199 1.00 75.33 O ATOM 0 H GLY B 21 2.593 10.092 -19.211 1.00 4.41 H new ATOM 0 HA2 GLY B 21 1.851 11.256 -21.145 1.00 70.34 H new ATOM 0 HA3 GLY B 21 0.240 10.594 -20.952 1.00 70.34 H new ATOM 1585 N THR B 22 0.489 12.077 -18.291 1.00 71.21 N ATOM 1586 CA THR B 22 0.191 13.203 -17.365 1.00 61.11 C ATOM 1587 C THR B 22 1.374 13.426 -16.396 1.00 60.41 C ATOM 1588 O THR B 22 2.301 12.610 -16.333 1.00 21.23 O ATOM 1589 CB THR B 22 -1.117 12.954 -16.517 1.00 31.34 C ATOM 1590 OG1 THR B 22 -0.897 11.943 -15.519 1.00 64.21 O ATOM 1591 CG2 THR B 22 -2.324 12.541 -17.387 1.00 41.14 C ATOM 0 H THR B 22 0.537 11.170 -17.826 1.00 71.21 H new ATOM 0 HA THR B 22 0.034 14.085 -17.986 1.00 61.11 H new ATOM 0 HB THR B 22 -1.351 13.906 -16.041 1.00 31.34 H new ATOM 0 HG1 THR B 22 -0.346 11.225 -15.896 1.00 64.21 H new ATOM 0 HG21 THR B 22 -3.194 12.383 -16.750 1.00 41.14 H new ATOM 0 HG22 THR B 22 -2.540 13.330 -18.108 1.00 41.14 H new ATOM 0 HG23 THR B 22 -2.091 11.618 -17.918 1.00 41.14 H new ATOM 1599 N GLU B 23 1.329 14.529 -15.624 1.00 51.31 N ATOM 1600 CA GLU B 23 2.331 14.812 -14.561 1.00 22.10 C ATOM 1601 C GLU B 23 1.711 14.608 -13.155 1.00 61.22 C ATOM 1602 O GLU B 23 2.228 15.121 -12.152 1.00 12.44 O ATOM 1603 CB GLU B 23 2.912 16.245 -14.721 1.00 13.30 C ATOM 1604 CG GLU B 23 1.891 17.390 -14.573 1.00 75.44 C ATOM 1605 CD GLU B 23 2.550 18.778 -14.630 1.00 73.03 C ATOM 1606 OE1 GLU B 23 2.783 19.295 -15.749 1.00 1.11 O ATOM 1607 OE2 GLU B 23 2.872 19.342 -13.561 1.00 43.05 O ATOM 0 H GLU B 23 0.609 15.246 -15.712 1.00 51.31 H new ATOM 0 HA GLU B 23 3.155 14.106 -14.667 1.00 22.10 H new ATOM 0 HB2 GLU B 23 3.700 16.385 -13.981 1.00 13.30 H new ATOM 0 HB3 GLU B 23 3.380 16.322 -15.702 1.00 13.30 H new ATOM 0 HG2 GLU B 23 1.146 17.312 -15.365 1.00 75.44 H new ATOM 0 HG3 GLU B 23 1.362 17.281 -13.626 1.00 75.44 H new ATOM 1614 N GLY B 24 0.614 13.819 -13.095 1.00 50.12 N ATOM 1615 CA GLY B 24 -0.052 13.489 -11.829 1.00 15.43 C ATOM 1616 C GLY B 24 -1.566 13.324 -11.946 1.00 71.31 C ATOM 1617 O GLY B 24 -2.223 14.077 -12.673 1.00 74.43 O ATOM 0 H GLY B 24 0.175 13.401 -13.916 1.00 50.12 H new ATOM 0 HA2 GLY B 24 0.374 12.566 -11.436 1.00 15.43 H new ATOM 0 HA3 GLY B 24 0.162 14.273 -11.103 1.00 15.43 H new ATOM 1621 N LEU B 25 -2.114 12.351 -11.195 1.00 43.01 N ATOM 1622 CA LEU B 25 -3.573 12.104 -11.075 1.00 1.45 C ATOM 1623 C LEU B 25 -3.944 11.806 -9.602 1.00 21.42 C ATOM 1624 O LEU B 25 -3.082 11.449 -8.791 1.00 12.43 O ATOM 1625 CB LEU B 25 -4.010 10.903 -11.975 1.00 61.22 C ATOM 1626 CG LEU B 25 -3.896 11.105 -13.523 1.00 43.44 C ATOM 1627 CD1 LEU B 25 -4.261 9.812 -14.285 1.00 60.10 C ATOM 1628 CD2 LEU B 25 -4.767 12.294 -14.000 1.00 71.24 C ATOM 0 H LEU B 25 -1.552 11.702 -10.644 1.00 43.01 H new ATOM 0 HA LEU B 25 -4.096 13.001 -11.408 1.00 1.45 H new ATOM 0 HB2 LEU B 25 -3.409 10.036 -11.700 1.00 61.22 H new ATOM 0 HB3 LEU B 25 -5.046 10.661 -11.739 1.00 61.22 H new ATOM 0 HG LEU B 25 -2.856 11.342 -13.747 1.00 43.44 H new ATOM 0 HD11 LEU B 25 -4.172 9.984 -15.358 1.00 60.10 H new ATOM 0 HD12 LEU B 25 -3.583 9.011 -13.989 1.00 60.10 H new ATOM 0 HD13 LEU B 25 -5.286 9.526 -14.047 1.00 60.10 H new ATOM 0 HD21 LEU B 25 -4.666 12.409 -15.079 1.00 71.24 H new ATOM 0 HD22 LEU B 25 -5.811 12.103 -13.751 1.00 71.24 H new ATOM 0 HD23 LEU B 25 -4.437 13.208 -13.506 1.00 71.24 H new ATOM 1640 N THR B 26 -5.240 11.956 -9.268 1.00 45.34 N ATOM 1641 CA THR B 26 -5.791 11.570 -7.940 1.00 50.03 C ATOM 1642 C THR B 26 -6.552 10.235 -8.039 1.00 20.24 C ATOM 1643 O THR B 26 -6.948 9.828 -9.137 1.00 11.10 O ATOM 1644 CB THR B 26 -6.738 12.669 -7.354 1.00 64.11 C ATOM 1645 OG1 THR B 26 -7.901 12.836 -8.186 1.00 22.03 O ATOM 1646 CG2 THR B 26 -6.013 14.016 -7.214 1.00 23.12 C ATOM 0 H THR B 26 -5.937 12.345 -9.902 1.00 45.34 H new ATOM 0 HA THR B 26 -4.943 11.460 -7.264 1.00 50.03 H new ATOM 0 HB THR B 26 -7.048 12.335 -6.364 1.00 64.11 H new ATOM 0 HG1 THR B 26 -8.047 13.790 -8.356 1.00 22.03 H new ATOM 0 HG21 THR B 26 -6.699 14.757 -6.804 1.00 23.12 H new ATOM 0 HG22 THR B 26 -5.160 13.902 -6.545 1.00 23.12 H new ATOM 0 HG23 THR B 26 -5.665 14.345 -8.193 1.00 23.12 H new ATOM 1654 N GLN B 27 -6.794 9.588 -6.878 1.00 45.34 N ATOM 1655 CA GLN B 27 -7.321 8.201 -6.817 1.00 11.14 C ATOM 1656 C GLN B 27 -8.705 8.030 -7.504 1.00 50.21 C ATOM 1657 O GLN B 27 -8.996 6.962 -8.029 1.00 52.35 O ATOM 1658 CB GLN B 27 -7.377 7.699 -5.349 1.00 31.13 C ATOM 1659 CG GLN B 27 -8.440 8.353 -4.450 1.00 72.32 C ATOM 1660 CD GLN B 27 -8.458 7.772 -3.039 1.00 24.11 C ATOM 1661 OE1 GLN B 27 -7.808 8.277 -2.139 1.00 1.14 O ATOM 1662 NE2 GLN B 27 -9.177 6.683 -2.848 1.00 71.42 N ATOM 0 H GLN B 27 -6.632 10.006 -5.962 1.00 45.34 H new ATOM 0 HA GLN B 27 -6.621 7.587 -7.384 1.00 11.14 H new ATOM 0 HB2 GLN B 27 -7.552 6.623 -5.361 1.00 31.13 H new ATOM 0 HB3 GLN B 27 -6.399 7.857 -4.895 1.00 31.13 H new ATOM 0 HG2 GLN B 27 -8.253 9.425 -4.394 1.00 72.32 H new ATOM 0 HG3 GLN B 27 -9.423 8.224 -4.904 1.00 72.32 H new ATOM 0 HE21 GLN B 27 -9.711 6.283 -3.619 1.00 71.42 H new ATOM 0 HE22 GLN B 27 -9.199 6.241 -1.929 1.00 71.42 H new ATOM 1671 N LYS B 28 -9.531 9.094 -7.490 1.00 12.42 N ATOM 1672 CA LYS B 28 -10.860 9.126 -8.158 1.00 51.44 C ATOM 1673 C LYS B 28 -10.732 9.046 -9.705 1.00 42.41 C ATOM 1674 O LYS B 28 -11.497 8.332 -10.373 1.00 30.13 O ATOM 1675 CB LYS B 28 -11.612 10.417 -7.733 1.00 14.02 C ATOM 1676 CG LYS B 28 -13.023 10.593 -8.340 1.00 64.00 C ATOM 1677 CD LYS B 28 -13.755 11.839 -7.792 1.00 24.31 C ATOM 1678 CE LYS B 28 -15.093 12.101 -8.503 1.00 32.31 C ATOM 1679 NZ LYS B 28 -14.903 12.436 -9.939 1.00 15.04 N ATOM 0 H LYS B 28 -9.299 9.965 -7.013 1.00 12.42 H new ATOM 0 HA LYS B 28 -11.428 8.250 -7.843 1.00 51.44 H new ATOM 0 HB2 LYS B 28 -11.699 10.426 -6.646 1.00 14.02 H new ATOM 0 HB3 LYS B 28 -11.005 11.279 -8.011 1.00 14.02 H new ATOM 0 HG2 LYS B 28 -12.941 10.672 -9.424 1.00 64.00 H new ATOM 0 HG3 LYS B 28 -13.618 9.705 -8.129 1.00 64.00 H new ATOM 0 HD2 LYS B 28 -13.934 11.710 -6.725 1.00 24.31 H new ATOM 0 HD3 LYS B 28 -13.112 12.712 -7.904 1.00 24.31 H new ATOM 0 HE2 LYS B 28 -15.728 11.219 -8.417 1.00 32.31 H new ATOM 0 HE3 LYS B 28 -15.614 12.919 -8.006 1.00 32.31 H new ATOM 0 HZ1 LYS B 28 -15.794 12.801 -10.331 1.00 15.04 H new ATOM 0 HZ2 LYS B 28 -14.162 13.160 -10.032 1.00 15.04 H new ATOM 0 HZ3 LYS B 28 -14.620 11.582 -10.460 1.00 15.04 H new ATOM 1693 N GLN B 29 -9.744 9.775 -10.252 1.00 41.04 N ATOM 1694 CA GLN B 29 -9.448 9.793 -11.707 1.00 32.52 C ATOM 1695 C GLN B 29 -8.901 8.424 -12.184 1.00 53.23 C ATOM 1696 O GLN B 29 -9.283 7.915 -13.243 1.00 30.42 O ATOM 1697 CB GLN B 29 -8.430 10.922 -12.019 1.00 0.35 C ATOM 1698 CG GLN B 29 -8.932 12.340 -11.676 1.00 33.15 C ATOM 1699 CD GLN B 29 -7.882 13.424 -11.928 1.00 15.44 C ATOM 1700 OE1 GLN B 29 -7.779 13.962 -13.016 1.00 14.45 O ATOM 1701 NE2 GLN B 29 -7.100 13.755 -10.921 1.00 33.22 N ATOM 0 H GLN B 29 -9.124 10.371 -9.703 1.00 41.04 H new ATOM 0 HA GLN B 29 -10.375 9.986 -12.246 1.00 32.52 H new ATOM 0 HB2 GLN B 29 -7.511 10.730 -11.465 1.00 0.35 H new ATOM 0 HB3 GLN B 29 -8.177 10.885 -13.079 1.00 0.35 H new ATOM 0 HG2 GLN B 29 -9.820 12.558 -12.269 1.00 33.15 H new ATOM 0 HG3 GLN B 29 -9.232 12.370 -10.629 1.00 33.15 H new ATOM 0 HE21 GLN B 29 -7.205 13.290 -10.019 1.00 33.22 H new ATOM 0 HE22 GLN B 29 -6.389 14.476 -11.043 1.00 33.22 H new ATOM 1710 N ILE B 30 -8.015 7.836 -11.363 1.00 12.43 N ATOM 1711 CA ILE B 30 -7.380 6.528 -11.652 1.00 31.33 C ATOM 1712 C ILE B 30 -8.392 5.365 -11.474 1.00 11.20 C ATOM 1713 O ILE B 30 -8.334 4.375 -12.194 1.00 43.10 O ATOM 1714 CB ILE B 30 -6.136 6.294 -10.718 1.00 64.24 C ATOM 1715 CG1 ILE B 30 -5.214 7.560 -10.704 1.00 50.55 C ATOM 1716 CG2 ILE B 30 -5.337 5.033 -11.156 1.00 44.35 C ATOM 1717 CD1 ILE B 30 -4.163 7.575 -9.606 1.00 12.44 C ATOM 0 H ILE B 30 -7.715 8.249 -10.480 1.00 12.43 H new ATOM 0 HA ILE B 30 -7.047 6.546 -12.690 1.00 31.33 H new ATOM 0 HB ILE B 30 -6.500 6.123 -9.705 1.00 64.24 H new ATOM 0 HG12 ILE B 30 -4.712 7.636 -11.668 1.00 50.55 H new ATOM 0 HG13 ILE B 30 -5.840 8.446 -10.600 1.00 50.55 H new ATOM 0 HG21 ILE B 30 -4.483 4.895 -10.493 1.00 44.35 H new ATOM 0 HG22 ILE B 30 -5.983 4.156 -11.103 1.00 44.35 H new ATOM 0 HG23 ILE B 30 -4.985 5.163 -12.179 1.00 44.35 H new ATOM 0 HD11 ILE B 30 -3.575 8.490 -9.678 1.00 12.44 H new ATOM 0 HD12 ILE B 30 -4.653 7.534 -8.633 1.00 12.44 H new ATOM 0 HD13 ILE B 30 -3.507 6.712 -9.718 1.00 12.44 H new ATOM 1729 N LYS B 31 -9.316 5.519 -10.506 1.00 32.13 N ATOM 1730 CA LYS B 31 -10.386 4.531 -10.200 1.00 75.21 C ATOM 1731 C LYS B 31 -11.246 4.239 -11.451 1.00 54.41 C ATOM 1732 O LYS B 31 -11.515 3.086 -11.777 1.00 42.53 O ATOM 1733 CB LYS B 31 -11.275 5.086 -9.049 1.00 44.14 C ATOM 1734 CG LYS B 31 -12.350 4.131 -8.490 1.00 12.34 C ATOM 1735 CD LYS B 31 -11.751 2.862 -7.837 1.00 41.42 C ATOM 1736 CE LYS B 31 -12.807 2.039 -7.078 1.00 32.33 C ATOM 1737 NZ LYS B 31 -13.956 1.644 -7.934 1.00 32.00 N ATOM 0 H LYS B 31 -9.347 6.341 -9.903 1.00 32.13 H new ATOM 0 HA LYS B 31 -9.925 3.593 -9.889 1.00 75.21 H new ATOM 0 HB2 LYS B 31 -10.623 5.385 -8.228 1.00 44.14 H new ATOM 0 HB3 LYS B 31 -11.772 5.988 -9.406 1.00 44.14 H new ATOM 0 HG2 LYS B 31 -12.952 4.662 -7.753 1.00 12.34 H new ATOM 0 HG3 LYS B 31 -13.021 3.836 -9.297 1.00 12.34 H new ATOM 0 HD2 LYS B 31 -11.295 2.241 -8.608 1.00 41.42 H new ATOM 0 HD3 LYS B 31 -10.956 3.151 -7.149 1.00 41.42 H new ATOM 0 HE2 LYS B 31 -12.339 1.143 -6.671 1.00 32.33 H new ATOM 0 HE3 LYS B 31 -13.174 2.620 -6.231 1.00 32.33 H new ATOM 0 HZ1 LYS B 31 -14.659 1.137 -7.359 1.00 32.00 H new ATOM 0 HZ2 LYS B 31 -14.392 2.495 -8.343 1.00 32.00 H new ATOM 0 HZ3 LYS B 31 -13.622 1.024 -8.699 1.00 32.00 H new ATOM 1751 N LYS B 32 -11.662 5.318 -12.134 1.00 5.32 N ATOM 1752 CA LYS B 32 -12.415 5.241 -13.406 1.00 31.31 C ATOM 1753 C LYS B 32 -11.540 4.752 -14.590 1.00 30.25 C ATOM 1754 O LYS B 32 -12.015 3.995 -15.442 1.00 34.53 O ATOM 1755 CB LYS B 32 -13.033 6.624 -13.733 1.00 35.42 C ATOM 1756 CG LYS B 32 -14.072 7.118 -12.697 1.00 64.33 C ATOM 1757 CD LYS B 32 -15.353 6.246 -12.652 1.00 1.34 C ATOM 1758 CE LYS B 32 -16.148 6.286 -13.970 1.00 2.43 C ATOM 1759 NZ LYS B 32 -17.407 5.510 -13.888 1.00 43.05 N ATOM 0 H LYS B 32 -11.487 6.273 -11.822 1.00 5.32 H new ATOM 0 HA LYS B 32 -13.206 4.503 -13.271 1.00 31.31 H new ATOM 0 HB2 LYS B 32 -12.232 7.359 -13.805 1.00 35.42 H new ATOM 0 HB3 LYS B 32 -13.509 6.574 -14.712 1.00 35.42 H new ATOM 0 HG2 LYS B 32 -13.613 7.129 -11.708 1.00 64.33 H new ATOM 0 HG3 LYS B 32 -14.348 8.146 -12.931 1.00 64.33 H new ATOM 0 HD2 LYS B 32 -15.078 5.215 -12.430 1.00 1.34 H new ATOM 0 HD3 LYS B 32 -15.991 6.588 -11.837 1.00 1.34 H new ATOM 0 HE2 LYS B 32 -16.377 7.321 -14.223 1.00 2.43 H new ATOM 0 HE3 LYS B 32 -15.531 5.890 -14.777 1.00 2.43 H new ATOM 0 HZ1 LYS B 32 -17.909 5.565 -14.797 1.00 43.05 H new ATOM 0 HZ2 LYS B 32 -17.189 4.516 -13.673 1.00 43.05 H new ATOM 0 HZ3 LYS B 32 -18.009 5.903 -13.136 1.00 43.05 H new ATOM 1773 N ALA B 33 -10.271 5.203 -14.636 1.00 1.11 N ATOM 1774 CA ALA B 33 -9.330 4.881 -15.744 1.00 71.00 C ATOM 1775 C ALA B 33 -8.997 3.370 -15.814 1.00 64.55 C ATOM 1776 O ALA B 33 -9.133 2.731 -16.862 1.00 63.21 O ATOM 1777 CB ALA B 33 -8.041 5.705 -15.580 1.00 51.01 C ATOM 0 H ALA B 33 -9.864 5.798 -13.914 1.00 1.11 H new ATOM 0 HA ALA B 33 -9.820 5.142 -16.682 1.00 71.00 H new ATOM 0 HB1 ALA B 33 -7.353 5.469 -16.391 1.00 51.01 H new ATOM 0 HB2 ALA B 33 -8.283 6.768 -15.607 1.00 51.01 H new ATOM 0 HB3 ALA B 33 -7.574 5.463 -14.626 1.00 51.01 H new ATOM 1783 N THR B 34 -8.589 2.813 -14.668 1.00 50.15 N ATOM 1784 CA THR B 34 -8.208 1.388 -14.530 1.00 61.53 C ATOM 1785 C THR B 34 -9.430 0.488 -14.225 1.00 72.13 C ATOM 1786 O THR B 34 -9.349 -0.734 -14.381 1.00 2.12 O ATOM 1787 CB THR B 34 -7.144 1.203 -13.400 1.00 0.21 C ATOM 1788 OG1 THR B 34 -7.685 1.665 -12.147 1.00 4.23 O ATOM 1789 CG2 THR B 34 -5.833 1.962 -13.698 1.00 12.44 C ATOM 0 H THR B 34 -8.511 3.338 -13.797 1.00 50.15 H new ATOM 0 HA THR B 34 -7.784 1.085 -15.487 1.00 61.53 H new ATOM 0 HB THR B 34 -6.908 0.140 -13.347 1.00 0.21 H new ATOM 0 HG1 THR B 34 -7.790 2.639 -12.175 1.00 4.23 H new ATOM 0 HG21 THR B 34 -5.127 1.802 -12.884 1.00 12.44 H new ATOM 0 HG22 THR B 34 -5.403 1.593 -14.629 1.00 12.44 H new ATOM 0 HG23 THR B 34 -6.043 3.028 -13.792 1.00 12.44 H new ATOM 1797 N LYS B 35 -10.550 1.116 -13.785 1.00 20.50 N ATOM 1798 CA LYS B 35 -11.836 0.426 -13.469 1.00 33.42 C ATOM 1799 C LYS B 35 -11.696 -0.635 -12.341 1.00 1.04 C ATOM 1800 O LYS B 35 -12.423 -1.638 -12.325 1.00 64.10 O ATOM 1801 CB LYS B 35 -12.463 -0.162 -14.772 1.00 32.40 C ATOM 1802 CG LYS B 35 -12.945 0.921 -15.769 1.00 12.23 C ATOM 1803 CD LYS B 35 -13.262 0.366 -17.174 1.00 5.41 C ATOM 1804 CE LYS B 35 -12.018 -0.207 -17.874 1.00 74.41 C ATOM 1805 NZ LYS B 35 -10.905 0.784 -17.935 1.00 35.32 N ATOM 0 H LYS B 35 -10.591 2.124 -13.637 1.00 20.50 H new ATOM 0 HA LYS B 35 -12.523 1.172 -13.068 1.00 33.42 H new ATOM 0 HB2 LYS B 35 -11.727 -0.797 -15.265 1.00 32.40 H new ATOM 0 HB3 LYS B 35 -13.306 -0.799 -14.505 1.00 32.40 H new ATOM 0 HG2 LYS B 35 -13.837 1.402 -15.367 1.00 12.23 H new ATOM 0 HG3 LYS B 35 -12.178 1.691 -15.855 1.00 12.23 H new ATOM 0 HD2 LYS B 35 -14.020 -0.413 -17.091 1.00 5.41 H new ATOM 0 HD3 LYS B 35 -13.687 1.160 -17.788 1.00 5.41 H new ATOM 0 HE2 LYS B 35 -11.682 -1.098 -17.344 1.00 74.41 H new ATOM 0 HE3 LYS B 35 -12.282 -0.518 -18.885 1.00 74.41 H new ATOM 0 HZ1 LYS B 35 -10.168 0.439 -18.583 1.00 35.32 H new ATOM 0 HZ2 LYS B 35 -11.270 1.695 -18.279 1.00 35.32 H new ATOM 0 HZ3 LYS B 35 -10.499 0.909 -16.986 1.00 35.32 H new ATOM 1819 N LEU B 36 -10.771 -0.371 -11.389 1.00 42.03 N ATOM 1820 CA LEU B 36 -10.556 -1.234 -10.192 1.00 61.43 C ATOM 1821 C LEU B 36 -11.824 -1.307 -9.304 1.00 2.42 C ATOM 1822 O LEU B 36 -12.631 -0.373 -9.289 1.00 25.01 O ATOM 1823 CB LEU B 36 -9.349 -0.730 -9.349 1.00 41.32 C ATOM 1824 CG LEU B 36 -7.954 -0.760 -10.055 1.00 13.33 C ATOM 1825 CD1 LEU B 36 -6.842 -0.226 -9.127 1.00 20.43 C ATOM 1826 CD2 LEU B 36 -7.611 -2.174 -10.578 1.00 61.10 C ATOM 0 H LEU B 36 -10.153 0.440 -11.423 1.00 42.03 H new ATOM 0 HA LEU B 36 -10.337 -2.237 -10.558 1.00 61.43 H new ATOM 0 HB2 LEU B 36 -9.553 0.294 -9.037 1.00 41.32 H new ATOM 0 HB3 LEU B 36 -9.288 -1.333 -8.443 1.00 41.32 H new ATOM 0 HG LEU B 36 -8.015 -0.097 -10.918 1.00 13.33 H new ATOM 0 HD11 LEU B 36 -5.885 -0.260 -9.648 1.00 20.43 H new ATOM 0 HD12 LEU B 36 -7.065 0.803 -8.846 1.00 20.43 H new ATOM 0 HD13 LEU B 36 -6.789 -0.843 -8.230 1.00 20.43 H new ATOM 0 HD21 LEU B 36 -6.635 -2.156 -11.062 1.00 61.10 H new ATOM 0 HD22 LEU B 36 -7.589 -2.875 -9.744 1.00 61.10 H new ATOM 0 HD23 LEU B 36 -8.367 -2.489 -11.297 1.00 61.10 H new ATOM 1838 N LYS B 37 -11.987 -2.420 -8.568 1.00 32.13 N ATOM 1839 CA LYS B 37 -13.172 -2.653 -7.704 1.00 72.45 C ATOM 1840 C LYS B 37 -13.189 -1.708 -6.467 1.00 52.03 C ATOM 1841 O LYS B 37 -14.239 -1.158 -6.111 1.00 35.10 O ATOM 1842 CB LYS B 37 -13.229 -4.145 -7.261 1.00 50.31 C ATOM 1843 CG LYS B 37 -11.943 -4.659 -6.580 1.00 44.31 C ATOM 1844 CD LYS B 37 -12.081 -6.084 -6.009 1.00 52.10 C ATOM 1845 CE LYS B 37 -10.797 -6.546 -5.300 1.00 55.52 C ATOM 1846 NZ LYS B 37 -10.392 -5.624 -4.201 1.00 54.43 N ATOM 0 H LYS B 37 -11.310 -3.182 -8.550 1.00 32.13 H new ATOM 0 HA LYS B 37 -14.060 -2.423 -8.292 1.00 72.45 H new ATOM 0 HB2 LYS B 37 -14.066 -4.276 -6.575 1.00 50.31 H new ATOM 0 HB3 LYS B 37 -13.434 -4.763 -8.135 1.00 50.31 H new ATOM 0 HG2 LYS B 37 -11.127 -4.642 -7.302 1.00 44.31 H new ATOM 0 HG3 LYS B 37 -11.670 -3.977 -5.774 1.00 44.31 H new ATOM 0 HD2 LYS B 37 -12.914 -6.114 -5.307 1.00 52.10 H new ATOM 0 HD3 LYS B 37 -12.319 -6.777 -6.816 1.00 52.10 H new ATOM 0 HE2 LYS B 37 -10.949 -7.546 -4.894 1.00 55.52 H new ATOM 0 HE3 LYS B 37 -9.989 -6.617 -6.028 1.00 55.52 H new ATOM 0 HZ1 LYS B 37 -9.663 -6.080 -3.616 1.00 54.43 H new ATOM 0 HZ2 LYS B 37 -10.011 -4.746 -4.607 1.00 54.43 H new ATOM 0 HZ3 LYS B 37 -11.220 -5.402 -3.612 1.00 54.43 H new ATOM 1860 N ALA B 38 -12.014 -1.500 -5.838 1.00 11.00 N ATOM 1861 CA ALA B 38 -11.884 -0.671 -4.615 1.00 43.02 C ATOM 1862 C ALA B 38 -10.619 0.218 -4.647 1.00 33.01 C ATOM 1863 O ALA B 38 -9.689 -0.008 -5.428 1.00 30.02 O ATOM 1864 CB ALA B 38 -11.874 -1.568 -3.363 1.00 31.41 C ATOM 0 H ALA B 38 -11.131 -1.898 -6.159 1.00 11.00 H new ATOM 0 HA ALA B 38 -12.748 -0.007 -4.577 1.00 43.02 H new ATOM 0 HB1 ALA B 38 -11.778 -0.948 -2.472 1.00 31.41 H new ATOM 0 HB2 ALA B 38 -12.804 -2.134 -3.313 1.00 31.41 H new ATOM 0 HB3 ALA B 38 -11.032 -2.258 -3.417 1.00 31.41 H new ATOM 1870 N ASP B 39 -10.628 1.250 -3.792 1.00 52.14 N ATOM 1871 CA ASP B 39 -9.451 2.096 -3.504 1.00 72.41 C ATOM 1872 C ASP B 39 -8.405 1.317 -2.672 1.00 1.32 C ATOM 1873 O ASP B 39 -7.217 1.609 -2.728 1.00 30.11 O ATOM 1874 CB ASP B 39 -9.897 3.402 -2.774 1.00 44.51 C ATOM 1875 CG ASP B 39 -10.572 3.196 -1.389 1.00 41.52 C ATOM 1876 OD1 ASP B 39 -11.338 2.217 -1.211 1.00 60.15 O ATOM 1877 OD2 ASP B 39 -10.359 4.027 -0.479 1.00 72.14 O ATOM 0 H ASP B 39 -11.461 1.528 -3.272 1.00 52.14 H new ATOM 0 HA ASP B 39 -8.979 2.374 -4.446 1.00 72.41 H new ATOM 0 HB2 ASP B 39 -9.023 4.040 -2.642 1.00 44.51 H new ATOM 0 HB3 ASP B 39 -10.590 3.940 -3.420 1.00 44.51 H new ATOM 1882 N LYS B 40 -8.887 0.315 -1.912 1.00 61.11 N ATOM 1883 CA LYS B 40 -8.056 -0.536 -1.022 1.00 52.01 C ATOM 1884 C LYS B 40 -6.947 -1.313 -1.776 1.00 2.12 C ATOM 1885 O LYS B 40 -5.795 -1.344 -1.332 1.00 10.42 O ATOM 1886 CB LYS B 40 -8.969 -1.518 -0.250 1.00 44.12 C ATOM 1887 CG LYS B 40 -10.113 -0.837 0.533 1.00 51.42 C ATOM 1888 CD LYS B 40 -9.610 0.215 1.549 1.00 70.33 C ATOM 1889 CE LYS B 40 -10.745 0.788 2.403 1.00 51.31 C ATOM 1890 NZ LYS B 40 -11.463 -0.279 3.153 1.00 62.14 N ATOM 0 H LYS B 40 -9.876 0.066 -1.895 1.00 61.11 H new ATOM 0 HA LYS B 40 -7.543 0.130 -0.328 1.00 52.01 H new ATOM 0 HB2 LYS B 40 -9.400 -2.228 -0.956 1.00 44.12 H new ATOM 0 HB3 LYS B 40 -8.359 -2.092 0.447 1.00 44.12 H new ATOM 0 HG2 LYS B 40 -10.792 -0.357 -0.172 1.00 51.42 H new ATOM 0 HG3 LYS B 40 -10.687 -1.598 1.061 1.00 51.42 H new ATOM 0 HD2 LYS B 40 -8.863 -0.240 2.200 1.00 70.33 H new ATOM 0 HD3 LYS B 40 -9.116 1.026 1.014 1.00 70.33 H new ATOM 0 HE2 LYS B 40 -10.340 1.517 3.105 1.00 51.31 H new ATOM 0 HE3 LYS B 40 -11.449 1.320 1.763 1.00 51.31 H new ATOM 0 HZ1 LYS B 40 -12.132 0.156 3.820 1.00 62.14 H new ATOM 0 HZ2 LYS B 40 -11.983 -0.883 2.485 1.00 62.14 H new ATOM 0 HZ3 LYS B 40 -10.776 -0.856 3.678 1.00 62.14 H new ATOM 1904 N ASP B 41 -7.307 -1.928 -2.921 1.00 24.24 N ATOM 1905 CA ASP B 41 -6.341 -2.669 -3.766 1.00 11.11 C ATOM 1906 C ASP B 41 -5.454 -1.679 -4.566 1.00 14.35 C ATOM 1907 O ASP B 41 -4.272 -1.943 -4.809 1.00 13.34 O ATOM 1908 CB ASP B 41 -7.074 -3.673 -4.701 1.00 61.51 C ATOM 1909 CG ASP B 41 -8.169 -3.024 -5.563 1.00 33.32 C ATOM 1910 OD1 ASP B 41 -7.867 -2.527 -6.665 1.00 35.05 O ATOM 1911 OD2 ASP B 41 -9.338 -3.013 -5.131 1.00 13.54 O ATOM 0 H ASP B 41 -8.260 -1.928 -3.284 1.00 24.24 H new ATOM 0 HA ASP B 41 -5.687 -3.253 -3.118 1.00 11.11 H new ATOM 0 HB2 ASP B 41 -6.343 -4.148 -5.355 1.00 61.51 H new ATOM 0 HB3 ASP B 41 -7.520 -4.462 -4.095 1.00 61.51 H new ATOM 1916 N PHE B 42 -6.049 -0.533 -4.958 1.00 33.10 N ATOM 1917 CA PHE B 42 -5.320 0.606 -5.567 1.00 61.22 C ATOM 1918 C PHE B 42 -4.134 1.091 -4.671 1.00 44.21 C ATOM 1919 O PHE B 42 -3.076 1.454 -5.190 1.00 25.41 O ATOM 1920 CB PHE B 42 -6.315 1.769 -5.861 1.00 21.14 C ATOM 1921 CG PHE B 42 -5.643 3.089 -6.225 1.00 22.33 C ATOM 1922 CD1 PHE B 42 -5.000 3.249 -7.449 1.00 45.13 C ATOM 1923 CD2 PHE B 42 -5.608 4.149 -5.318 1.00 34.15 C ATOM 1924 CE1 PHE B 42 -4.356 4.426 -7.755 1.00 51.54 C ATOM 1925 CE2 PHE B 42 -4.956 5.318 -5.629 1.00 63.12 C ATOM 1926 CZ PHE B 42 -4.331 5.458 -6.844 1.00 72.43 C ATOM 0 H PHE B 42 -7.051 -0.368 -4.862 1.00 33.10 H new ATOM 0 HA PHE B 42 -4.882 0.266 -6.505 1.00 61.22 H new ATOM 0 HB2 PHE B 42 -6.973 1.472 -6.678 1.00 21.14 H new ATOM 0 HB3 PHE B 42 -6.945 1.924 -4.985 1.00 21.14 H new ATOM 0 HD1 PHE B 42 -5.007 2.441 -8.166 1.00 45.13 H new ATOM 0 HD2 PHE B 42 -6.099 4.050 -4.361 1.00 34.15 H new ATOM 0 HE1 PHE B 42 -3.869 4.540 -8.712 1.00 51.54 H new ATOM 0 HE2 PHE B 42 -4.935 6.129 -4.916 1.00 63.12 H new ATOM 0 HZ PHE B 42 -3.820 6.378 -7.085 1.00 72.43 H new ATOM 1936 N PHE B 43 -4.330 1.101 -3.335 1.00 62.54 N ATOM 1937 CA PHE B 43 -3.262 1.478 -2.363 1.00 50.14 C ATOM 1938 C PHE B 43 -2.051 0.512 -2.423 1.00 1.34 C ATOM 1939 O PHE B 43 -0.903 0.934 -2.248 1.00 55.30 O ATOM 1940 CB PHE B 43 -3.821 1.553 -0.915 1.00 11.20 C ATOM 1941 CG PHE B 43 -4.939 2.582 -0.719 1.00 0.10 C ATOM 1942 CD1 PHE B 43 -4.886 3.837 -1.337 1.00 55.05 C ATOM 1943 CD2 PHE B 43 -6.035 2.300 0.094 1.00 53.14 C ATOM 1944 CE1 PHE B 43 -5.896 4.764 -1.154 1.00 64.14 C ATOM 1945 CE2 PHE B 43 -7.040 3.225 0.273 1.00 25.54 C ATOM 1946 CZ PHE B 43 -6.971 4.458 -0.348 1.00 62.42 C ATOM 0 H PHE B 43 -5.217 0.853 -2.897 1.00 62.54 H new ATOM 0 HA PHE B 43 -2.910 2.468 -2.652 1.00 50.14 H new ATOM 0 HB2 PHE B 43 -4.196 0.569 -0.632 1.00 11.20 H new ATOM 0 HB3 PHE B 43 -3.003 1.790 -0.235 1.00 11.20 H new ATOM 0 HD1 PHE B 43 -4.044 4.085 -1.966 1.00 55.05 H new ATOM 0 HD2 PHE B 43 -6.097 1.343 0.591 1.00 53.14 H new ATOM 0 HE1 PHE B 43 -5.842 5.726 -1.642 1.00 64.14 H new ATOM 0 HE2 PHE B 43 -7.885 2.986 0.901 1.00 25.54 H new ATOM 0 HZ PHE B 43 -7.759 5.181 -0.202 1.00 62.42 H new ATOM 1956 N LEU B 44 -2.327 -0.779 -2.682 1.00 60.12 N ATOM 1957 CA LEU B 44 -1.281 -1.812 -2.892 1.00 43.14 C ATOM 1958 C LEU B 44 -0.570 -1.601 -4.257 1.00 70.41 C ATOM 1959 O LEU B 44 0.644 -1.814 -4.373 1.00 54.35 O ATOM 1960 CB LEU B 44 -1.896 -3.247 -2.797 1.00 50.51 C ATOM 1961 CG LEU B 44 -2.142 -3.816 -1.354 1.00 30.33 C ATOM 1962 CD1 LEU B 44 -3.103 -2.934 -0.522 1.00 4.34 C ATOM 1963 CD2 LEU B 44 -2.647 -5.280 -1.411 1.00 34.53 C ATOM 0 H LEU B 44 -3.278 -1.141 -2.753 1.00 60.12 H new ATOM 0 HA LEU B 44 -0.535 -1.712 -2.103 1.00 43.14 H new ATOM 0 HB2 LEU B 44 -2.848 -3.245 -3.329 1.00 50.51 H new ATOM 0 HB3 LEU B 44 -1.237 -3.935 -3.326 1.00 50.51 H new ATOM 0 HG LEU B 44 -1.178 -3.801 -0.845 1.00 30.33 H new ATOM 0 HD11 LEU B 44 -3.237 -3.374 0.466 1.00 4.34 H new ATOM 0 HD12 LEU B 44 -2.682 -1.934 -0.420 1.00 4.34 H new ATOM 0 HD13 LEU B 44 -4.068 -2.872 -1.026 1.00 4.34 H new ATOM 0 HD21 LEU B 44 -2.809 -5.649 -0.398 1.00 34.53 H new ATOM 0 HD22 LEU B 44 -3.584 -5.320 -1.966 1.00 34.53 H new ATOM 0 HD23 LEU B 44 -1.903 -5.902 -1.909 1.00 34.53 H new ATOM 1975 N GLY B 45 -1.346 -1.164 -5.272 1.00 10.34 N ATOM 1976 CA GLY B 45 -0.814 -0.881 -6.616 1.00 34.42 C ATOM 1977 C GLY B 45 0.159 0.310 -6.647 1.00 23.34 C ATOM 1978 O GLY B 45 1.307 0.167 -7.069 1.00 74.43 O ATOM 0 H GLY B 45 -2.349 -1.000 -5.182 1.00 10.34 H new ATOM 0 HA2 GLY B 45 -0.304 -1.768 -6.991 1.00 34.42 H new ATOM 0 HA3 GLY B 45 -1.644 -0.681 -7.293 1.00 34.42 H new ATOM 1982 N LEU B 46 -0.303 1.486 -6.158 1.00 4.40 N ATOM 1983 CA LEU B 46 0.525 2.726 -6.086 1.00 51.13 C ATOM 1984 C LEU B 46 1.688 2.542 -5.077 1.00 41.14 C ATOM 1985 O LEU B 46 2.742 3.180 -5.198 1.00 51.43 O ATOM 1986 CB LEU B 46 -0.366 3.971 -5.715 1.00 43.21 C ATOM 1987 CG LEU B 46 -0.577 4.307 -4.179 1.00 73.22 C ATOM 1988 CD1 LEU B 46 0.510 5.274 -3.632 1.00 51.24 C ATOM 1989 CD2 LEU B 46 -1.986 4.868 -3.898 1.00 33.43 C ATOM 0 H LEU B 46 -1.252 1.607 -5.804 1.00 4.40 H new ATOM 0 HA LEU B 46 0.959 2.912 -7.068 1.00 51.13 H new ATOM 0 HB2 LEU B 46 0.072 4.848 -6.191 1.00 43.21 H new ATOM 0 HB3 LEU B 46 -1.349 3.823 -6.162 1.00 43.21 H new ATOM 0 HG LEU B 46 -0.478 3.360 -3.648 1.00 73.22 H new ATOM 0 HD11 LEU B 46 0.322 5.473 -2.577 1.00 51.24 H new ATOM 0 HD12 LEU B 46 1.493 4.818 -3.745 1.00 51.24 H new ATOM 0 HD13 LEU B 46 0.478 6.210 -4.189 1.00 51.24 H new ATOM 0 HD21 LEU B 46 -2.086 5.084 -2.834 1.00 33.43 H new ATOM 0 HD22 LEU B 46 -2.134 5.784 -4.470 1.00 33.43 H new ATOM 0 HD23 LEU B 46 -2.735 4.133 -4.191 1.00 33.43 H new ATOM 2001 N GLY B 47 1.453 1.683 -4.066 1.00 32.11 N ATOM 2002 CA GLY B 47 2.468 1.327 -3.074 1.00 62.05 C ATOM 2003 C GLY B 47 3.635 0.573 -3.706 1.00 70.10 C ATOM 2004 O GLY B 47 4.796 0.794 -3.362 1.00 62.04 O ATOM 0 H GLY B 47 0.555 1.222 -3.920 1.00 32.11 H new ATOM 0 HA2 GLY B 47 2.838 2.231 -2.591 1.00 62.05 H new ATOM 0 HA3 GLY B 47 2.016 0.712 -2.296 1.00 62.05 H new ATOM 2008 N TRP B 48 3.317 -0.298 -4.679 1.00 1.50 N ATOM 2009 CA TRP B 48 4.331 -1.035 -5.452 1.00 24.14 C ATOM 2010 C TRP B 48 5.119 -0.072 -6.388 1.00 50.23 C ATOM 2011 O TRP B 48 6.288 -0.294 -6.679 1.00 25.52 O ATOM 2012 CB TRP B 48 3.656 -2.180 -6.246 1.00 54.12 C ATOM 2013 CG TRP B 48 4.619 -3.251 -6.698 1.00 62.34 C ATOM 2014 CD1 TRP B 48 5.252 -3.349 -7.902 1.00 31.44 C ATOM 2015 CD2 TRP B 48 5.079 -4.358 -5.913 1.00 34.30 C ATOM 2016 NE1 TRP B 48 6.045 -4.465 -7.924 1.00 52.12 N ATOM 2017 CE2 TRP B 48 5.962 -5.095 -6.711 1.00 52.01 C ATOM 2018 CE3 TRP B 48 4.819 -4.796 -4.609 1.00 62.12 C ATOM 2019 CZ2 TRP B 48 6.593 -6.246 -6.255 1.00 63.25 C ATOM 2020 CZ3 TRP B 48 5.445 -5.937 -4.153 1.00 41.30 C ATOM 2021 CH2 TRP B 48 6.327 -6.650 -4.976 1.00 34.02 C ATOM 0 H TRP B 48 2.357 -0.510 -4.950 1.00 1.50 H new ATOM 0 HA TRP B 48 5.052 -1.477 -4.765 1.00 24.14 H new ATOM 0 HB2 TRP B 48 2.884 -2.635 -5.625 1.00 54.12 H new ATOM 0 HB3 TRP B 48 3.156 -1.760 -7.119 1.00 54.12 H new ATOM 0 HD1 TRP B 48 5.144 -2.650 -8.718 1.00 31.44 H new ATOM 0 HE1 TRP B 48 6.607 -4.777 -8.716 1.00 52.12 H new ATOM 0 HE3 TRP B 48 4.140 -4.250 -3.971 1.00 62.12 H new ATOM 0 HZ2 TRP B 48 7.269 -6.801 -6.888 1.00 63.25 H new ATOM 0 HZ3 TRP B 48 5.253 -6.285 -3.149 1.00 41.30 H new ATOM 0 HH2 TRP B 48 6.807 -7.538 -4.592 1.00 34.02 H new ATOM 2032 N LEU B 49 4.466 1.012 -6.834 1.00 65.31 N ATOM 2033 CA LEU B 49 5.136 2.111 -7.588 1.00 71.03 C ATOM 2034 C LEU B 49 6.196 2.846 -6.707 1.00 25.10 C ATOM 2035 O LEU B 49 7.215 3.325 -7.221 1.00 70.02 O ATOM 2036 CB LEU B 49 4.072 3.122 -8.134 1.00 44.32 C ATOM 2037 CG LEU B 49 3.361 2.773 -9.483 1.00 71.42 C ATOM 2038 CD1 LEU B 49 2.948 1.313 -9.540 1.00 44.23 C ATOM 2039 CD2 LEU B 49 2.132 3.684 -9.735 1.00 44.33 C ATOM 0 H LEU B 49 3.467 1.162 -6.690 1.00 65.31 H new ATOM 0 HA LEU B 49 5.663 1.667 -8.432 1.00 71.03 H new ATOM 0 HB2 LEU B 49 3.303 3.243 -7.371 1.00 44.32 H new ATOM 0 HB3 LEU B 49 4.559 4.090 -8.252 1.00 44.32 H new ATOM 0 HG LEU B 49 4.089 2.953 -10.274 1.00 71.42 H new ATOM 0 HD11 LEU B 49 2.458 1.110 -10.492 1.00 44.23 H new ATOM 0 HD12 LEU B 49 3.831 0.681 -9.445 1.00 44.23 H new ATOM 0 HD13 LEU B 49 2.258 1.098 -8.724 1.00 44.23 H new ATOM 0 HD21 LEU B 49 1.665 3.411 -10.681 1.00 44.33 H new ATOM 0 HD22 LEU B 49 1.413 3.557 -8.926 1.00 44.33 H new ATOM 0 HD23 LEU B 49 2.453 4.725 -9.776 1.00 44.33 H new ATOM 2051 N LEU B 50 5.919 2.940 -5.383 1.00 22.34 N ATOM 2052 CA LEU B 50 6.862 3.511 -4.384 1.00 75.31 C ATOM 2053 C LEU B 50 8.103 2.600 -4.156 1.00 2.22 C ATOM 2054 O LEU B 50 9.209 3.116 -3.943 1.00 32.32 O ATOM 2055 CB LEU B 50 6.135 3.791 -3.028 1.00 3.50 C ATOM 2056 CG LEU B 50 5.092 4.966 -3.025 1.00 22.44 C ATOM 2057 CD1 LEU B 50 4.313 5.034 -1.685 1.00 35.32 C ATOM 2058 CD2 LEU B 50 5.780 6.321 -3.332 1.00 63.20 C ATOM 0 H LEU B 50 5.039 2.624 -4.977 1.00 22.34 H new ATOM 0 HA LEU B 50 7.222 4.455 -4.793 1.00 75.31 H new ATOM 0 HB2 LEU B 50 5.623 2.879 -2.720 1.00 3.50 H new ATOM 0 HB3 LEU B 50 6.891 4.003 -2.272 1.00 3.50 H new ATOM 0 HG LEU B 50 4.370 4.763 -3.816 1.00 22.44 H new ATOM 0 HD11 LEU B 50 3.601 5.858 -1.720 1.00 35.32 H new ATOM 0 HD12 LEU B 50 3.777 4.098 -1.528 1.00 35.32 H new ATOM 0 HD13 LEU B 50 5.013 5.193 -0.865 1.00 35.32 H new ATOM 0 HD21 LEU B 50 5.036 7.117 -3.324 1.00 63.20 H new ATOM 0 HD22 LEU B 50 6.537 6.524 -2.575 1.00 63.20 H new ATOM 0 HD23 LEU B 50 6.252 6.275 -4.314 1.00 63.20 H new ATOM 2070 N ARG B 51 7.927 1.249 -4.203 1.00 60.43 N ATOM 2071 CA ARG B 51 9.072 0.303 -4.055 1.00 30.43 C ATOM 2072 C ARG B 51 9.970 0.330 -5.317 1.00 23.22 C ATOM 2073 O ARG B 51 11.173 0.082 -5.243 1.00 13.44 O ATOM 2074 CB ARG B 51 8.587 -1.156 -3.693 1.00 60.04 C ATOM 2075 CG ARG B 51 8.045 -2.046 -4.853 1.00 30.53 C ATOM 2076 CD ARG B 51 9.115 -2.939 -5.528 1.00 74.24 C ATOM 2077 NE ARG B 51 8.692 -3.386 -6.870 1.00 4.13 N ATOM 2078 CZ ARG B 51 9.372 -4.184 -7.668 1.00 13.24 C ATOM 2079 NH1 ARG B 51 10.420 -4.819 -7.254 1.00 53.34 N ATOM 2080 NH2 ARG B 51 8.977 -4.350 -8.890 1.00 42.32 N ATOM 0 H ARG B 51 7.023 0.797 -4.339 1.00 60.43 H new ATOM 0 HA ARG B 51 9.679 0.638 -3.214 1.00 30.43 H new ATOM 0 HB2 ARG B 51 9.421 -1.682 -3.228 1.00 60.04 H new ATOM 0 HB3 ARG B 51 7.804 -1.072 -2.940 1.00 60.04 H new ATOM 0 HG2 ARG B 51 7.250 -2.683 -4.465 1.00 30.53 H new ATOM 0 HG3 ARG B 51 7.597 -1.402 -5.610 1.00 30.53 H new ATOM 0 HD2 ARG B 51 10.051 -2.386 -5.608 1.00 74.24 H new ATOM 0 HD3 ARG B 51 9.311 -3.809 -4.901 1.00 74.24 H new ATOM 0 HE ARG B 51 7.792 -3.046 -7.210 1.00 4.13 H new ATOM 0 HH11 ARG B 51 10.736 -4.707 -6.291 1.00 53.34 H new ATOM 0 HH12 ARG B 51 10.930 -5.431 -7.891 1.00 53.34 H new ATOM 0 HH21 ARG B 51 8.146 -3.865 -9.228 1.00 42.32 H new ATOM 0 HH22 ARG B 51 9.497 -4.966 -9.515 1.00 42.32 H new ATOM 2094 N GLU B 52 9.351 0.629 -6.474 1.00 52.14 N ATOM 2095 CA GLU B 52 10.054 0.804 -7.768 1.00 61.22 C ATOM 2096 C GLU B 52 10.668 2.221 -7.905 1.00 24.34 C ATOM 2097 O GLU B 52 11.438 2.478 -8.844 1.00 22.44 O ATOM 2098 CB GLU B 52 9.056 0.530 -8.928 1.00 44.45 C ATOM 2099 CG GLU B 52 8.436 -0.883 -8.897 1.00 54.04 C ATOM 2100 CD GLU B 52 7.323 -1.117 -9.940 1.00 0.25 C ATOM 2101 OE1 GLU B 52 6.323 -0.360 -9.943 1.00 42.43 O ATOM 2102 OE2 GLU B 52 7.439 -2.059 -10.750 1.00 42.54 O ATOM 0 H GLU B 52 8.341 0.758 -6.543 1.00 52.14 H new ATOM 0 HA GLU B 52 10.879 0.093 -7.812 1.00 61.22 H new ATOM 0 HB2 GLU B 52 8.255 1.269 -8.888 1.00 44.45 H new ATOM 0 HB3 GLU B 52 9.571 0.670 -9.878 1.00 44.45 H new ATOM 0 HG2 GLU B 52 9.226 -1.616 -9.057 1.00 54.04 H new ATOM 0 HG3 GLU B 52 8.029 -1.065 -7.903 1.00 54.04 H new ATOM 2109 N ASP B 53 10.264 3.139 -6.986 1.00 12.11 N ATOM 2110 CA ASP B 53 10.721 4.558 -6.932 1.00 45.44 C ATOM 2111 C ASP B 53 10.286 5.363 -8.184 1.00 0.00 C ATOM 2112 O ASP B 53 10.814 6.449 -8.454 1.00 73.41 O ATOM 2113 CB ASP B 53 12.253 4.654 -6.700 1.00 41.22 C ATOM 2114 CG ASP B 53 12.693 4.004 -5.380 1.00 2.14 C ATOM 2115 OD1 ASP B 53 12.650 4.684 -4.328 1.00 40.52 O ATOM 2116 OD2 ASP B 53 13.091 2.816 -5.385 1.00 62.53 O ATOM 0 H ASP B 53 9.599 2.911 -6.247 1.00 12.11 H new ATOM 0 HA ASP B 53 10.227 5.015 -6.075 1.00 45.44 H new ATOM 0 HB2 ASP B 53 12.773 4.173 -7.528 1.00 41.22 H new ATOM 0 HB3 ASP B 53 12.552 5.702 -6.702 1.00 41.22 H new ATOM 2121 N LYS B 54 9.274 4.839 -8.915 1.00 23.43 N ATOM 2122 CA LYS B 54 8.756 5.474 -10.146 1.00 72.04 C ATOM 2123 C LYS B 54 7.670 6.529 -9.863 1.00 23.14 C ATOM 2124 O LYS B 54 7.193 7.165 -10.800 1.00 45.40 O ATOM 2125 CB LYS B 54 8.219 4.403 -11.143 1.00 64.25 C ATOM 2126 CG LYS B 54 9.321 3.578 -11.845 1.00 11.40 C ATOM 2127 CD LYS B 54 8.797 2.661 -12.988 1.00 2.44 C ATOM 2128 CE LYS B 54 8.039 1.411 -12.497 1.00 51.30 C ATOM 2129 NZ LYS B 54 6.699 1.701 -11.916 1.00 40.52 N ATOM 0 H LYS B 54 8.798 3.971 -8.669 1.00 23.43 H new ATOM 0 HA LYS B 54 9.599 5.994 -10.600 1.00 72.04 H new ATOM 0 HB2 LYS B 54 7.559 3.722 -10.606 1.00 64.25 H new ATOM 0 HB3 LYS B 54 7.615 4.900 -11.902 1.00 64.25 H new ATOM 0 HG2 LYS B 54 10.066 4.261 -12.254 1.00 11.40 H new ATOM 0 HG3 LYS B 54 9.827 2.961 -11.102 1.00 11.40 H new ATOM 0 HD2 LYS B 54 8.137 3.243 -13.632 1.00 2.44 H new ATOM 0 HD3 LYS B 54 9.641 2.343 -13.600 1.00 2.44 H new ATOM 0 HE2 LYS B 54 7.919 0.721 -13.332 1.00 51.30 H new ATOM 0 HE3 LYS B 54 8.646 0.903 -11.748 1.00 51.30 H new ATOM 0 HZ1 LYS B 54 6.045 0.927 -12.149 1.00 40.52 H new ATOM 0 HZ2 LYS B 54 6.780 1.787 -10.883 1.00 40.52 H new ATOM 0 HZ3 LYS B 54 6.335 2.592 -12.310 1.00 40.52 H new ATOM 2143 N VAL B 55 7.282 6.727 -8.583 1.00 34.13 N ATOM 2144 CA VAL B 55 6.305 7.782 -8.205 1.00 44.44 C ATOM 2145 C VAL B 55 6.703 8.514 -6.915 1.00 13.31 C ATOM 2146 O VAL B 55 7.572 8.075 -6.158 1.00 1.24 O ATOM 2147 CB VAL B 55 4.816 7.265 -8.034 1.00 51.25 C ATOM 2148 CG1 VAL B 55 4.256 6.643 -9.331 1.00 33.22 C ATOM 2149 CG2 VAL B 55 4.683 6.300 -6.834 1.00 23.12 C ATOM 0 H VAL B 55 7.626 6.176 -7.797 1.00 34.13 H new ATOM 0 HA VAL B 55 6.333 8.466 -9.053 1.00 44.44 H new ATOM 0 HB VAL B 55 4.204 8.141 -7.820 1.00 51.25 H new ATOM 0 HG11 VAL B 55 3.234 6.305 -9.161 1.00 33.22 H new ATOM 0 HG12 VAL B 55 4.263 7.389 -10.125 1.00 33.22 H new ATOM 0 HG13 VAL B 55 4.875 5.795 -9.624 1.00 33.22 H new ATOM 0 HG21 VAL B 55 3.649 5.967 -6.748 1.00 23.12 H new ATOM 0 HG22 VAL B 55 5.331 5.437 -6.987 1.00 23.12 H new ATOM 0 HG23 VAL B 55 4.975 6.815 -5.919 1.00 23.12 H new ATOM 2159 N VAL B 56 6.012 9.638 -6.688 1.00 13.40 N ATOM 2160 CA VAL B 56 6.084 10.406 -5.445 1.00 41.11 C ATOM 2161 C VAL B 56 4.691 11.008 -5.139 1.00 13.10 C ATOM 2162 O VAL B 56 3.955 11.402 -6.051 1.00 55.30 O ATOM 2163 CB VAL B 56 7.213 11.507 -5.515 1.00 21.31 C ATOM 2164 CG1 VAL B 56 6.977 12.513 -6.672 1.00 12.32 C ATOM 2165 CG2 VAL B 56 7.396 12.227 -4.152 1.00 1.31 C ATOM 0 H VAL B 56 5.378 10.044 -7.376 1.00 13.40 H new ATOM 0 HA VAL B 56 6.360 9.744 -4.624 1.00 41.11 H new ATOM 0 HB VAL B 56 8.147 10.990 -5.735 1.00 21.31 H new ATOM 0 HG11 VAL B 56 7.778 13.252 -6.681 1.00 12.32 H new ATOM 0 HG12 VAL B 56 6.965 11.979 -7.622 1.00 12.32 H new ATOM 0 HG13 VAL B 56 6.021 13.016 -6.527 1.00 12.32 H new ATOM 0 HG21 VAL B 56 8.181 12.978 -4.240 1.00 1.31 H new ATOM 0 HG22 VAL B 56 6.462 12.711 -3.868 1.00 1.31 H new ATOM 0 HG23 VAL B 56 7.674 11.499 -3.390 1.00 1.31 H new ATOM 2175 N THR B 57 4.333 11.066 -3.849 1.00 11.34 N ATOM 2176 CA THR B 57 2.964 11.410 -3.397 1.00 22.05 C ATOM 2177 C THR B 57 2.920 12.808 -2.736 1.00 42.51 C ATOM 2178 O THR B 57 3.897 13.258 -2.124 1.00 53.22 O ATOM 2179 CB THR B 57 2.425 10.330 -2.393 1.00 3.10 C ATOM 2180 OG1 THR B 57 3.312 10.227 -1.264 1.00 44.50 O ATOM 2181 CG2 THR B 57 2.282 8.941 -3.059 1.00 2.23 C ATOM 0 H THR B 57 4.980 10.877 -3.083 1.00 11.34 H new ATOM 0 HA THR B 57 2.325 11.429 -4.280 1.00 22.05 H new ATOM 0 HB THR B 57 1.436 10.651 -2.067 1.00 3.10 H new ATOM 0 HG1 THR B 57 2.970 9.553 -0.640 1.00 44.50 H new ATOM 0 HG21 THR B 57 1.906 8.224 -2.329 1.00 2.23 H new ATOM 0 HG22 THR B 57 1.584 9.008 -3.894 1.00 2.23 H new ATOM 0 HG23 THR B 57 3.254 8.611 -3.424 1.00 2.23 H new ATOM 2189 N SER B 58 1.763 13.473 -2.871 1.00 5.34 N ATOM 2190 CA SER B 58 1.498 14.823 -2.310 1.00 3.21 C ATOM 2191 C SER B 58 0.017 14.948 -1.904 1.00 33.43 C ATOM 2192 O SER B 58 -0.799 14.075 -2.221 1.00 31.14 O ATOM 2193 CB SER B 58 1.850 15.937 -3.334 1.00 32.03 C ATOM 2194 OG SER B 58 3.231 15.948 -3.653 1.00 53.04 O ATOM 0 H SER B 58 0.967 13.089 -3.380 1.00 5.34 H new ATOM 0 HA SER B 58 2.130 14.949 -1.431 1.00 3.21 H new ATOM 0 HB2 SER B 58 1.269 15.789 -4.244 1.00 32.03 H new ATOM 0 HB3 SER B 58 1.564 16.907 -2.927 1.00 32.03 H new ATOM 0 HG SER B 58 3.411 16.661 -4.301 1.00 53.04 H new ATOM 2200 N GLU B 59 -0.322 16.042 -1.203 1.00 71.21 N ATOM 2201 CA GLU B 59 -1.722 16.383 -0.870 1.00 62.15 C ATOM 2202 C GLU B 59 -2.096 17.726 -1.535 1.00 50.25 C ATOM 2203 O GLU B 59 -1.628 18.793 -1.119 1.00 3.04 O ATOM 2204 CB GLU B 59 -1.927 16.449 0.665 1.00 0.30 C ATOM 2205 CG GLU B 59 -3.384 16.722 1.100 1.00 15.51 C ATOM 2206 CD GLU B 59 -3.544 16.785 2.626 1.00 41.12 C ATOM 2207 OE1 GLU B 59 -3.299 17.861 3.216 1.00 75.40 O ATOM 2208 OE2 GLU B 59 -3.893 15.762 3.247 1.00 64.32 O ATOM 0 H GLU B 59 0.360 16.714 -0.851 1.00 71.21 H new ATOM 0 HA GLU B 59 -2.378 15.602 -1.254 1.00 62.15 H new ATOM 0 HB2 GLU B 59 -1.599 15.507 1.105 1.00 0.30 H new ATOM 0 HB3 GLU B 59 -1.286 17.231 1.072 1.00 0.30 H new ATOM 0 HG2 GLU B 59 -3.719 17.663 0.664 1.00 15.51 H new ATOM 0 HG3 GLU B 59 -4.030 15.939 0.703 1.00 15.51 H new ATOM 2215 N VAL B 60 -2.923 17.655 -2.588 1.00 75.20 N ATOM 2216 CA VAL B 60 -3.381 18.839 -3.352 1.00 43.33 C ATOM 2217 C VAL B 60 -4.907 18.995 -3.197 1.00 30.15 C ATOM 2218 O VAL B 60 -5.671 18.132 -3.634 1.00 63.43 O ATOM 2219 CB VAL B 60 -2.961 18.744 -4.878 1.00 44.24 C ATOM 2220 CG1 VAL B 60 -3.685 19.791 -5.768 1.00 52.14 C ATOM 2221 CG2 VAL B 60 -1.430 18.901 -5.028 1.00 43.20 C ATOM 0 H VAL B 60 -3.298 16.774 -2.940 1.00 75.20 H new ATOM 0 HA VAL B 60 -2.894 19.726 -2.947 1.00 43.33 H new ATOM 0 HB VAL B 60 -3.267 17.757 -5.224 1.00 44.24 H new ATOM 0 HG11 VAL B 60 -3.358 19.678 -6.802 1.00 52.14 H new ATOM 0 HG12 VAL B 60 -4.762 19.636 -5.709 1.00 52.14 H new ATOM 0 HG13 VAL B 60 -3.444 20.795 -5.419 1.00 52.14 H new ATOM 0 HG21 VAL B 60 -1.159 18.833 -6.082 1.00 43.20 H new ATOM 0 HG22 VAL B 60 -1.124 19.871 -4.636 1.00 43.20 H new ATOM 0 HG23 VAL B 60 -0.927 18.110 -4.472 1.00 43.20 H new ATOM 2231 N GLU B 61 -5.320 20.124 -2.571 1.00 35.11 N ATOM 2232 CA GLU B 61 -6.743 20.488 -2.337 1.00 2.33 C ATOM 2233 C GLU B 61 -7.513 19.415 -1.505 1.00 22.11 C ATOM 2234 O GLU B 61 -8.726 19.253 -1.654 1.00 72.22 O ATOM 2235 CB GLU B 61 -7.437 20.776 -3.714 1.00 61.52 C ATOM 2236 CG GLU B 61 -6.635 21.719 -4.652 1.00 51.20 C ATOM 2237 CD GLU B 61 -6.395 23.123 -4.068 1.00 65.44 C ATOM 2238 OE1 GLU B 61 -7.322 23.958 -4.092 1.00 51.34 O ATOM 2239 OE2 GLU B 61 -5.280 23.385 -3.562 1.00 72.11 O ATOM 0 H GLU B 61 -4.667 20.818 -2.209 1.00 35.11 H new ATOM 0 HA GLU B 61 -6.768 21.393 -1.730 1.00 2.33 H new ATOM 0 HB2 GLU B 61 -7.605 19.829 -4.228 1.00 61.52 H new ATOM 0 HB3 GLU B 61 -8.417 21.216 -3.528 1.00 61.52 H new ATOM 0 HG2 GLU B 61 -5.672 21.260 -4.876 1.00 51.20 H new ATOM 0 HG3 GLU B 61 -7.169 21.816 -5.597 1.00 51.20 H new ATOM 2246 N GLY B 62 -6.790 18.723 -0.594 1.00 62.33 N ATOM 2247 CA GLY B 62 -7.363 17.625 0.218 1.00 52.34 C ATOM 2248 C GLY B 62 -7.466 16.272 -0.515 1.00 24.34 C ATOM 2249 O GLY B 62 -8.092 15.336 -0.013 1.00 34.11 O ATOM 0 H GLY B 62 -5.805 18.907 -0.403 1.00 62.33 H new ATOM 0 HA2 GLY B 62 -6.752 17.494 1.111 1.00 52.34 H new ATOM 0 HA3 GLY B 62 -8.358 17.919 0.553 1.00 52.34 H new ATOM 2253 N GLU B 63 -6.872 16.182 -1.712 1.00 73.05 N ATOM 2254 CA GLU B 63 -6.839 14.946 -2.533 1.00 23.32 C ATOM 2255 C GLU B 63 -5.462 14.248 -2.460 1.00 42.32 C ATOM 2256 O GLU B 63 -4.424 14.921 -2.397 1.00 34.32 O ATOM 2257 CB GLU B 63 -7.150 15.317 -4.006 1.00 43.22 C ATOM 2258 CG GLU B 63 -8.593 15.802 -4.274 1.00 33.30 C ATOM 2259 CD GLU B 63 -9.598 14.643 -4.390 1.00 34.41 C ATOM 2260 OE1 GLU B 63 -10.067 14.126 -3.347 1.00 55.40 O ATOM 2261 OE2 GLU B 63 -9.895 14.213 -5.531 1.00 44.42 O ATOM 0 H GLU B 63 -6.393 16.969 -2.150 1.00 73.05 H new ATOM 0 HA GLU B 63 -7.585 14.253 -2.143 1.00 23.32 H new ATOM 0 HB2 GLU B 63 -6.457 16.098 -4.321 1.00 43.22 H new ATOM 0 HB3 GLU B 63 -6.955 14.446 -4.632 1.00 43.22 H new ATOM 0 HG2 GLU B 63 -8.904 16.467 -3.468 1.00 33.30 H new ATOM 0 HG3 GLU B 63 -8.610 16.386 -5.194 1.00 33.30 H new ATOM 2268 N ILE B 64 -5.469 12.899 -2.474 1.00 72.52 N ATOM 2269 CA ILE B 64 -4.237 12.092 -2.618 1.00 71.52 C ATOM 2270 C ILE B 64 -3.709 12.198 -4.073 1.00 32.12 C ATOM 2271 O ILE B 64 -4.235 11.559 -4.992 1.00 71.52 O ATOM 2272 CB ILE B 64 -4.474 10.580 -2.225 1.00 14.03 C ATOM 2273 CG1 ILE B 64 -5.012 10.475 -0.758 1.00 65.20 C ATOM 2274 CG2 ILE B 64 -3.179 9.734 -2.407 1.00 12.51 C ATOM 2275 CD1 ILE B 64 -5.252 9.054 -0.255 1.00 42.25 C ATOM 0 H ILE B 64 -6.319 12.342 -2.387 1.00 72.52 H new ATOM 0 HA ILE B 64 -3.491 12.491 -1.931 1.00 71.52 H new ATOM 0 HB ILE B 64 -5.227 10.171 -2.899 1.00 14.03 H new ATOM 0 HG12 ILE B 64 -4.302 10.964 -0.091 1.00 65.20 H new ATOM 0 HG13 ILE B 64 -5.947 11.030 -0.690 1.00 65.20 H new ATOM 0 HG21 ILE B 64 -3.378 8.699 -2.128 1.00 12.51 H new ATOM 0 HG22 ILE B 64 -2.862 9.774 -3.449 1.00 12.51 H new ATOM 0 HG23 ILE B 64 -2.390 10.136 -1.772 1.00 12.51 H new ATOM 0 HD11 ILE B 64 -5.623 9.088 0.769 1.00 42.25 H new ATOM 0 HD12 ILE B 64 -5.988 8.562 -0.891 1.00 42.25 H new ATOM 0 HD13 ILE B 64 -4.317 8.495 -0.283 1.00 42.25 H new ATOM 2287 N PHE B 65 -2.682 13.037 -4.259 1.00 21.35 N ATOM 2288 CA PHE B 65 -2.119 13.369 -5.581 1.00 31.42 C ATOM 2289 C PHE B 65 -0.784 12.608 -5.805 1.00 51.01 C ATOM 2290 O PHE B 65 0.269 12.990 -5.280 1.00 42.41 O ATOM 2291 CB PHE B 65 -1.930 14.912 -5.655 1.00 64.25 C ATOM 2292 CG PHE B 65 -1.461 15.458 -7.005 1.00 1.45 C ATOM 2293 CD1 PHE B 65 -2.186 15.205 -8.168 1.00 4.22 C ATOM 2294 CD2 PHE B 65 -0.303 16.235 -7.110 1.00 12.42 C ATOM 2295 CE1 PHE B 65 -1.770 15.708 -9.384 1.00 43.22 C ATOM 2296 CE2 PHE B 65 0.110 16.738 -8.330 1.00 43.23 C ATOM 2297 CZ PHE B 65 -0.623 16.473 -9.466 1.00 63.32 C ATOM 0 H PHE B 65 -2.211 13.512 -3.489 1.00 21.35 H new ATOM 0 HA PHE B 65 -2.796 13.057 -6.377 1.00 31.42 H new ATOM 0 HB2 PHE B 65 -2.877 15.388 -5.400 1.00 64.25 H new ATOM 0 HB3 PHE B 65 -1.209 15.208 -4.893 1.00 64.25 H new ATOM 0 HD1 PHE B 65 -3.085 14.608 -8.117 1.00 4.22 H new ATOM 0 HD2 PHE B 65 0.278 16.446 -6.224 1.00 12.42 H new ATOM 0 HE1 PHE B 65 -2.344 15.502 -10.275 1.00 43.22 H new ATOM 0 HE2 PHE B 65 1.006 17.338 -8.392 1.00 43.23 H new ATOM 0 HZ PHE B 65 -0.301 16.863 -10.420 1.00 63.32 H new ATOM 2307 N VAL B 66 -0.846 11.522 -6.588 1.00 62.33 N ATOM 2308 CA VAL B 66 0.324 10.663 -6.900 1.00 63.10 C ATOM 2309 C VAL B 66 0.790 10.907 -8.359 1.00 40.13 C ATOM 2310 O VAL B 66 -0.038 11.070 -9.267 1.00 40.42 O ATOM 2311 CB VAL B 66 -0.015 9.138 -6.642 1.00 63.53 C ATOM 2312 CG1 VAL B 66 -1.258 8.673 -7.446 1.00 42.02 C ATOM 2313 CG2 VAL B 66 1.208 8.220 -6.917 1.00 52.44 C ATOM 0 H VAL B 66 -1.710 11.206 -7.029 1.00 62.33 H new ATOM 0 HA VAL B 66 1.146 10.929 -6.235 1.00 63.10 H new ATOM 0 HB VAL B 66 -0.262 9.048 -5.584 1.00 63.53 H new ATOM 0 HG11 VAL B 66 -1.453 7.621 -7.238 1.00 42.02 H new ATOM 0 HG12 VAL B 66 -2.124 9.267 -7.154 1.00 42.02 H new ATOM 0 HG13 VAL B 66 -1.072 8.804 -8.512 1.00 42.02 H new ATOM 0 HG21 VAL B 66 0.934 7.182 -6.728 1.00 52.44 H new ATOM 0 HG22 VAL B 66 1.519 8.330 -7.956 1.00 52.44 H new ATOM 0 HG23 VAL B 66 2.030 8.503 -6.260 1.00 52.44 H new ATOM 2323 N LYS B 67 2.121 10.967 -8.583 1.00 72.03 N ATOM 2324 CA LYS B 67 2.689 11.333 -9.910 1.00 40.42 C ATOM 2325 C LYS B 67 3.985 10.573 -10.216 1.00 75.31 C ATOM 2326 O LYS B 67 4.749 10.274 -9.304 1.00 22.23 O ATOM 2327 CB LYS B 67 2.935 12.864 -10.016 1.00 50.03 C ATOM 2328 CG LYS B 67 3.607 13.551 -8.798 1.00 45.35 C ATOM 2329 CD LYS B 67 2.594 14.014 -7.725 1.00 73.43 C ATOM 2330 CE LYS B 67 3.197 14.990 -6.700 1.00 52.21 C ATOM 2331 NZ LYS B 67 4.247 14.370 -5.851 1.00 63.31 N ATOM 0 H LYS B 67 2.823 10.769 -7.870 1.00 72.03 H new ATOM 0 HA LYS B 67 1.947 11.042 -10.654 1.00 40.42 H new ATOM 0 HB2 LYS B 67 3.554 13.049 -10.894 1.00 50.03 H new ATOM 0 HB3 LYS B 67 1.976 13.351 -10.194 1.00 50.03 H new ATOM 0 HG2 LYS B 67 4.316 12.859 -8.344 1.00 45.35 H new ATOM 0 HG3 LYS B 67 4.179 14.412 -9.144 1.00 45.35 H new ATOM 0 HD2 LYS B 67 1.747 14.492 -8.217 1.00 73.43 H new ATOM 0 HD3 LYS B 67 2.206 13.141 -7.200 1.00 73.43 H new ATOM 0 HE2 LYS B 67 3.622 15.844 -7.227 1.00 52.21 H new ATOM 0 HE3 LYS B 67 2.401 15.374 -6.061 1.00 52.21 H new ATOM 0 HZ1 LYS B 67 4.147 14.708 -4.873 1.00 63.31 H new ATOM 0 HZ2 LYS B 67 4.144 13.335 -5.872 1.00 63.31 H new ATOM 0 HZ3 LYS B 67 5.186 14.632 -6.213 1.00 63.31 H new ATOM 2345 N LEU B 68 4.236 10.313 -11.523 1.00 44.02 N ATOM 2346 CA LEU B 68 5.388 9.502 -11.992 1.00 23.33 C ATOM 2347 C LEU B 68 6.745 10.246 -11.813 1.00 55.31 C ATOM 2348 O LEU B 68 7.295 10.778 -12.784 1.00 53.21 O ATOM 2349 CB LEU B 68 5.203 9.070 -13.479 1.00 10.42 C ATOM 2350 CG LEU B 68 3.883 8.323 -13.841 1.00 72.15 C ATOM 2351 CD1 LEU B 68 3.908 7.832 -15.303 1.00 30.41 C ATOM 2352 CD2 LEU B 68 3.596 7.167 -12.861 1.00 23.24 C ATOM 0 H LEU B 68 3.647 10.659 -12.281 1.00 44.02 H new ATOM 0 HA LEU B 68 5.416 8.609 -11.367 1.00 23.33 H new ATOM 0 HB2 LEU B 68 5.269 9.962 -14.102 1.00 10.42 H new ATOM 0 HB3 LEU B 68 6.041 8.429 -13.752 1.00 10.42 H new ATOM 0 HG LEU B 68 3.064 9.036 -13.744 1.00 72.15 H new ATOM 0 HD11 LEU B 68 2.976 7.315 -15.529 1.00 30.41 H new ATOM 0 HD12 LEU B 68 4.021 8.685 -15.972 1.00 30.41 H new ATOM 0 HD13 LEU B 68 4.745 7.148 -15.443 1.00 30.41 H new ATOM 0 HD21 LEU B 68 2.668 6.670 -13.146 1.00 23.24 H new ATOM 0 HD22 LEU B 68 4.416 6.450 -12.894 1.00 23.24 H new ATOM 0 HD23 LEU B 68 3.500 7.563 -11.850 1.00 23.24 H new ATOM 2364 N VAL B 69 7.246 10.250 -10.543 1.00 65.25 N ATOM 2365 CA VAL B 69 8.498 10.930 -10.083 1.00 31.45 C ATOM 2366 C VAL B 69 8.853 12.199 -10.921 1.00 33.22 C ATOM 2367 O VAL B 69 9.877 12.278 -11.614 1.00 24.14 O ATOM 2368 CB VAL B 69 9.693 9.895 -9.937 1.00 30.31 C ATOM 2369 CG1 VAL B 69 10.086 9.228 -11.283 1.00 4.40 C ATOM 2370 CG2 VAL B 69 10.915 10.537 -9.233 1.00 41.40 C ATOM 0 H VAL B 69 6.773 9.762 -9.783 1.00 65.25 H new ATOM 0 HA VAL B 69 8.307 11.320 -9.083 1.00 31.45 H new ATOM 0 HB VAL B 69 9.328 9.090 -9.299 1.00 30.31 H new ATOM 0 HG11 VAL B 69 10.908 8.531 -11.118 1.00 4.40 H new ATOM 0 HG12 VAL B 69 9.229 8.689 -11.686 1.00 4.40 H new ATOM 0 HG13 VAL B 69 10.398 9.995 -11.992 1.00 4.40 H new ATOM 0 HG21 VAL B 69 11.715 9.801 -9.149 1.00 41.40 H new ATOM 0 HG22 VAL B 69 11.265 11.389 -9.816 1.00 41.40 H new ATOM 0 HG23 VAL B 69 10.626 10.873 -8.237 1.00 41.40 H new