USER MOD reduce.3.24.130724 H: found=0, std=0, add=1581, rem=0, adj=80 USER MOD reduce.3.24.130724 removed 1581 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 237 GLN : amide:sc= 0.746 K(o=2.4,f=0.97) USER MOD Set 1.2: B 286 TYR OH : rot -9:sc= 1.67 USER MOD Set 2.1: B 234 ASN :FLIP amide:sc= -0.896 F(o=-3.2,f=-0.0039) USER MOD Set 2.2: B 236 TYR OH : rot 137:sc= 0.892 USER MOD Set 3.1: A 22 THR OG1 : rot 180:sc= 0 USER MOD Set 3.2: A 72 THR OG1 : rot 180:sc= 0 USER MOD Set 4.1: A 38 GLN : amide:sc= -0.013 K(o=0.029,f=-2.2) USER MOD Set 4.2: B 296 TYR OH : rot 180:sc= 0.0425 USER MOD Set 5.1: A 37 GLN : amide:sc= 0.883 K(o=3,f=1.2) USER MOD Set 5.2: A 86 TYR OH : rot -2:sc= 2.14 USER MOD Set 6.1: A 34 ASN :FLIP amide:sc= -1.32 F(o=-3.7,f=-0.29) USER MOD Set 6.2: A 36 TYR OH : rot 133:sc= 1.03 USER MOD Set 7.1: A 6 GLN : amide:sc= -5.67! C(o=-4.5!,f=-4.7!) USER MOD Set 7.2: A 102 THR OG1 : rot -102:sc= 1.16 USER MOD Single : A 1 ASP N :NH3+ -170:sc= 0.331 (180deg=0.2) USER MOD Single : A 3 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 4 MET CE :methyl -125:sc= -1.05 (180deg=-5.19!) USER MOD Single : A 5 THR OG1 : rot 180:sc= 0 USER MOD Single : A 7 SER OG : rot 0:sc= 0.368 USER MOD Single : A 9 SER OG : rot 180:sc= 0 USER MOD Single : A 10 SER OG : rot 180:sc= 0 USER MOD Single : A 12 SER OG : rot 35:sc= 0.0296 USER MOD Single : A 14 SER OG : rot -15:sc= 1.13 USER MOD Single : A 20 THR OG1 : rot 180:sc= 0 USER MOD Single : A 24 GLN :FLIP amide:sc= 0 F(o=-0.87,f=0) USER MOD Single : A 26 SER OG : rot 180:sc= 0 USER MOD Single : A 27 GLN :FLIP amide:sc= -0.0584 F(o=-3.3!,f=-0.058) USER MOD Single : A 30 SER OG : rot 180:sc= 0 USER MOD Single : A 31 ASN : amide:sc= 0.144 K(o=0.14,f=-4.4!) USER MOD Single : A 32 TYR OH : rot 180:sc= 0 USER MOD Single : A 39 LYS NZ :NH3+ 139:sc= 0.96 (180deg=0.139) USER MOD Single : A 42 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 45 LYS NZ :NH3+ 160:sc= -0.102 (180deg=-0.598) USER MOD Single : A 49 TYR OH : rot 180:sc= 0 USER MOD Single : A 52 SER OG : rot 180:sc=0.000637 USER MOD Single : A 53 ASN :FLIP amide:sc= -0.226 F(o=-1.4!,f=-0.23) USER MOD Single : A 56 THR OG1 : rot 180:sc= 0 USER MOD Single : A 60 SER OG : rot 180:sc= 0 USER MOD Single : A 63 SER OG : rot 180:sc= 0 USER MOD Single : A 65 SER OG : rot 180:sc= 0 USER MOD Single : A 67 SER OG : rot 180:sc= 0 USER MOD Single : A 69 THR OG1 : rot 180:sc= 0 USER MOD Single : A 74 THR OG1 : rot 31:sc= 0.00424 USER MOD Single : A 76 SER OG : rot 180:sc= 0 USER MOD Single : A 77 SER OG : rot 180:sc= 0 USER MOD Single : A 79 GLN : amide:sc= -0.189 X(o=-0.19,f=-0.058) USER MOD Single : A 85 THR OG1 : rot 180:sc= 0 USER MOD Single : A 87 HIS : no HE2:sc= 0.875 K(o=0.87,f=-3!) USER MOD Single : A 89 GLN : amide:sc= -2.64! C(o=-2.6!,f=-5.6!) USER MOD Single : A 90 GLN : amide:sc= -1.06! C(o=-1.1!,f=-14!) USER MOD Single : A 91 TYR OH : rot -32:sc= 0.163 USER MOD Single : A 93 ASN : amide:sc= -0.0689 K(o=-0.069,f=-1.3) USER MOD Single : A 96 TYR OH : rot -47:sc= -1.19 USER MOD Single : A 97 THR OG1 : rot 180:sc= 0 USER MOD Single : A 100 GLN :FLIP amide:sc= 0 F(o=-1.1,f=0) USER MOD Single : A 103 LYS NZ :NH3+ -157:sc= 1.26 (180deg=0.752) USER MOD Single : A 107 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 203 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : B 204 MET CE :methyl -136:sc= -0.866 (180deg=-4.64!) USER MOD Single : B 205 THR OG1 : rot 180:sc= 0 USER MOD Single : B 206 GLN : amide:sc= -2.44! C(o=-2.4!,f=-2.9!) USER MOD Single : B 207 SER OG : rot 180:sc= -0.0198 USER MOD Single : B 209 SER OG : rot 180:sc= 0.0416 USER MOD Single : B 210 SER OG : rot 180:sc= 0 USER MOD Single : B 212 SER OG : rot 38:sc= 0.36 USER MOD Single : B 214 SER OG : rot 0:sc= 1.2 USER MOD Single : B 220 THR OG1 : rot 180:sc= 0 USER MOD Single : B 222 THR OG1 : rot 15:sc= 1.24 USER MOD Single : B 224 GLN :FLIP amide:sc= 0 F(o=-1.1,f=0) USER MOD Single : B 226 SER OG : rot 180:sc= 0 USER MOD Single : B 227 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : B 230 SER OG : rot 180:sc= 0 USER MOD Single : B 231 ASN : amide:sc= -0.297 X(o=-0.3,f=0) USER MOD Single : B 232 TYR OH : rot 180:sc= 0 USER MOD Single : B 238 GLN : amide:sc= -0.641 K(o=-0.64,f=-1.4) USER MOD Single : B 239 LYS NZ :NH3+ 168:sc= 1.24 (180deg=1.15) USER MOD Single : B 245 LYS NZ :NH3+ 142:sc= 2.08 (180deg=0.237) USER MOD Single : B 249 TYR OH : rot 180:sc= 0 USER MOD Single : B 252 SER OG : rot 180:sc= 0.0161 USER MOD Single : B 253 ASN :FLIP amide:sc= -0.163 F(o=-1.4!,f=-0.16) USER MOD Single : B 256 THR OG1 : rot 180:sc= 0 USER MOD Single : B 260 SER OG : rot 180:sc= 0 USER MOD Single : B 263 SER OG : rot 180:sc= 0 USER MOD Single : B 265 SER OG : rot 180:sc= -0.0287 USER MOD Single : B 267 SER OG : rot 180:sc= 0 USER MOD Single : B 269 THR OG1 : rot 180:sc= 0 USER MOD Single : B 272 THR OG1 : rot 180:sc= -0.0952 USER MOD Single : B 274 THR OG1 : rot 41:sc= 1.15 USER MOD Single : B 276 SER OG : rot 180:sc= 0 USER MOD Single : B 277 SER OG : rot 180:sc= 0 USER MOD Single : B 279 GLN : amide:sc= -0.222 K(o=-0.22,f=-1.1) USER MOD Single : B 285 THR OG1 : rot 180:sc= 0 USER MOD Single : B 287 HIS : no HE2:sc= -3.91! C(o=-3.9!,f=-5.3!) USER MOD Single : B 289 GLN : amide:sc= -2.51! C(o=-2.5!,f=-3.7!) USER MOD Single : B 290 GLN : amide:sc= -4.26! C(o=-4.3!,f=-14!) USER MOD Single : B 291 TYR OH : rot 55:sc= 0.23 USER MOD Single : B 293 ASN : amide:sc= -0.0383 K(o=-0.038,f=-1.3) USER MOD Single : B 297 THR OG1 : rot -99:sc= 0.719 USER MOD Single : B 300 GLN :FLIP amide:sc= -0.0131 F(o=-1.1,f=-0.013) USER MOD Single : B 302 THR OG1 : rot -103:sc= 0.698 USER MOD Single : B 303 LYS NZ :NH3+ -146:sc= 1.29 (180deg=-0.263) USER MOD Single : B 307 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD ----------------------------------------------------------------- ATOM 1 N ASP A 1 1.347 2.334 15.382 1.00 1.02 N ATOM 2 CA ASP A 1 1.960 1.823 14.163 1.00 5.55 C ATOM 3 C ASP A 1 2.888 0.704 14.533 1.00 31.30 C ATOM 4 O ASP A 1 3.337 0.608 15.681 1.00 22.52 O ATOM 5 CB ASP A 1 2.781 2.923 13.487 1.00 55.33 C ATOM 6 CG ASP A 1 3.988 3.324 14.305 1.00 44.22 C ATOM 7 OD1 ASP A 1 3.799 3.783 15.457 1.00 64.33 O ATOM 8 OD2 ASP A 1 5.136 3.205 13.798 1.00 61.22 O ATOM 0 H1 ASP A 1 0.579 2.991 15.136 1.00 1.02 H new ATOM 0 H2 ASP A 1 0.961 1.542 15.935 1.00 1.02 H new ATOM 0 H3 ASP A 1 2.062 2.835 15.947 1.00 1.02 H new ATOM 0 HA ASP A 1 1.181 1.480 13.482 1.00 5.55 H new ATOM 0 HB2 ASP A 1 3.108 2.578 12.506 1.00 55.33 H new ATOM 0 HB3 ASP A 1 2.149 3.796 13.324 1.00 55.33 H new ATOM 13 N ILE A 2 3.159 -0.144 13.602 1.00 51.21 N ATOM 14 CA ILE A 2 4.106 -1.190 13.802 1.00 14.24 C ATOM 15 C ILE A 2 5.372 -0.748 13.157 1.00 1.23 C ATOM 16 O ILE A 2 5.369 -0.388 11.984 1.00 20.53 O ATOM 17 CB ILE A 2 3.625 -2.506 13.180 1.00 11.42 C ATOM 18 CG1 ILE A 2 2.293 -2.927 13.805 1.00 64.32 C ATOM 19 CG2 ILE A 2 4.678 -3.609 13.333 1.00 44.33 C ATOM 20 CD1 ILE A 2 1.697 -4.185 13.223 1.00 33.34 C ATOM 0 H ILE A 2 2.730 -0.133 12.677 1.00 51.21 H new ATOM 0 HA ILE A 2 4.245 -1.378 14.867 1.00 14.24 H new ATOM 0 HB ILE A 2 3.473 -2.347 12.113 1.00 11.42 H new ATOM 0 HG12 ILE A 2 2.438 -3.071 14.876 1.00 64.32 H new ATOM 0 HG13 ILE A 2 1.578 -2.113 13.687 1.00 64.32 H new ATOM 0 HG21 ILE A 2 4.308 -4.530 12.882 1.00 44.33 H new ATOM 0 HG22 ILE A 2 5.598 -3.305 12.834 1.00 44.33 H new ATOM 0 HG23 ILE A 2 4.877 -3.777 14.391 1.00 44.33 H new ATOM 0 HD11 ILE A 2 0.756 -4.408 13.725 1.00 33.34 H new ATOM 0 HD12 ILE A 2 1.515 -4.042 12.158 1.00 33.34 H new ATOM 0 HD13 ILE A 2 2.389 -5.015 13.365 1.00 33.34 H new ATOM 32 N GLN A 3 6.437 -0.768 13.898 1.00 64.43 N ATOM 33 CA GLN A 3 7.663 -0.258 13.400 1.00 32.03 C ATOM 34 C GLN A 3 8.300 -1.247 12.465 1.00 14.52 C ATOM 35 O GLN A 3 8.679 -2.350 12.863 1.00 51.11 O ATOM 36 CB GLN A 3 8.608 0.068 14.530 1.00 44.31 C ATOM 37 CG GLN A 3 9.849 0.770 14.061 1.00 23.23 C ATOM 38 CD GLN A 3 10.750 1.164 15.189 1.00 64.20 C ATOM 39 OE1 GLN A 3 11.625 0.405 15.599 1.00 32.40 O ATOM 40 NE2 GLN A 3 10.546 2.339 15.711 1.00 31.41 N ATOM 0 H GLN A 3 6.475 -1.134 14.849 1.00 64.43 H new ATOM 0 HA GLN A 3 7.450 0.660 12.853 1.00 32.03 H new ATOM 0 HB2 GLN A 3 8.094 0.695 15.259 1.00 44.31 H new ATOM 0 HB3 GLN A 3 8.887 -0.853 15.042 1.00 44.31 H new ATOM 0 HG2 GLN A 3 10.393 0.119 13.377 1.00 23.23 H new ATOM 0 HG3 GLN A 3 9.568 1.660 13.498 1.00 23.23 H new ATOM 0 HE21 GLN A 3 9.809 2.940 15.342 1.00 31.41 H new ATOM 0 HE22 GLN A 3 11.123 2.659 16.489 1.00 31.41 H new ATOM 49 N MET A 4 8.373 -0.857 11.231 1.00 55.32 N ATOM 50 CA MET A 4 8.967 -1.651 10.197 1.00 3.43 C ATOM 51 C MET A 4 10.297 -1.031 9.853 1.00 35.15 C ATOM 52 O MET A 4 10.386 0.186 9.676 1.00 21.24 O ATOM 53 CB MET A 4 8.068 -1.691 8.953 1.00 44.34 C ATOM 54 CG MET A 4 6.650 -2.172 9.222 1.00 54.23 C ATOM 55 SD MET A 4 6.561 -3.834 9.934 1.00 11.40 S ATOM 56 CE MET A 4 7.221 -4.838 8.609 1.00 60.44 C ATOM 0 H MET A 4 8.014 0.041 10.906 1.00 55.32 H new ATOM 0 HA MET A 4 9.096 -2.677 10.543 1.00 3.43 H new ATOM 0 HB2 MET A 4 8.024 -0.692 8.518 1.00 44.34 H new ATOM 0 HB3 MET A 4 8.526 -2.343 8.209 1.00 44.34 H new ATOM 0 HG2 MET A 4 6.161 -1.471 9.899 1.00 54.23 H new ATOM 0 HG3 MET A 4 6.089 -2.157 8.288 1.00 54.23 H new ATOM 0 HE1 MET A 4 6.505 -5.619 8.353 1.00 60.44 H new ATOM 0 HE2 MET A 4 7.404 -4.213 7.735 1.00 60.44 H new ATOM 0 HE3 MET A 4 8.157 -5.295 8.930 1.00 60.44 H new ATOM 66 N THR A 5 11.319 -1.822 9.815 1.00 21.41 N ATOM 67 CA THR A 5 12.637 -1.329 9.502 1.00 11.54 C ATOM 68 C THR A 5 13.215 -2.089 8.301 1.00 22.13 C ATOM 69 O THR A 5 13.261 -3.319 8.316 1.00 21.43 O ATOM 70 CB THR A 5 13.570 -1.516 10.722 1.00 4.42 C ATOM 71 OG1 THR A 5 12.966 -0.917 11.891 1.00 45.14 O ATOM 72 CG2 THR A 5 14.932 -0.863 10.473 1.00 22.22 C ATOM 0 H THR A 5 11.274 -2.824 9.998 1.00 21.41 H new ATOM 0 HA THR A 5 12.565 -0.270 9.256 1.00 11.54 H new ATOM 0 HB THR A 5 13.716 -2.585 10.880 1.00 4.42 H new ATOM 0 HG1 THR A 5 13.557 -1.038 12.663 1.00 45.14 H new ATOM 0 HG21 THR A 5 15.570 -1.008 11.345 1.00 22.22 H new ATOM 0 HG22 THR A 5 15.400 -1.319 9.601 1.00 22.22 H new ATOM 0 HG23 THR A 5 14.797 0.204 10.296 1.00 22.22 H new ATOM 80 N GLN A 6 13.652 -1.359 7.286 1.00 20.24 N ATOM 81 CA GLN A 6 14.277 -1.944 6.104 1.00 35.53 C ATOM 82 C GLN A 6 15.765 -1.890 6.230 1.00 42.12 C ATOM 83 O GLN A 6 16.362 -0.817 6.385 1.00 25.25 O ATOM 84 CB GLN A 6 13.839 -1.219 4.838 1.00 33.41 C ATOM 85 CG GLN A 6 12.480 -1.632 4.317 1.00 21.43 C ATOM 86 CD GLN A 6 12.528 -2.893 3.560 1.00 45.41 C ATOM 87 OE1 GLN A 6 12.384 -3.960 4.110 1.00 21.44 O ATOM 88 NE2 GLN A 6 12.733 -2.778 2.275 1.00 11.41 N ATOM 0 H GLN A 6 13.584 -0.342 7.256 1.00 20.24 H new ATOM 0 HA GLN A 6 13.958 -2.984 6.032 1.00 35.53 H new ATOM 0 HB2 GLN A 6 13.829 -0.147 5.034 1.00 33.41 H new ATOM 0 HB3 GLN A 6 14.581 -1.394 4.059 1.00 33.41 H new ATOM 0 HG2 GLN A 6 11.791 -1.740 5.154 1.00 21.43 H new ATOM 0 HG3 GLN A 6 12.084 -0.843 3.678 1.00 21.43 H new ATOM 0 HE21 GLN A 6 12.849 -1.855 1.858 1.00 11.41 H new ATOM 0 HE22 GLN A 6 12.777 -3.612 1.689 1.00 11.41 H new ATOM 97 N SER A 7 16.355 -3.028 6.174 1.00 10.33 N ATOM 98 CA SER A 7 17.763 -3.157 6.302 1.00 12.00 C ATOM 99 C SER A 7 18.290 -4.201 5.326 1.00 73.14 C ATOM 100 O SER A 7 17.893 -5.364 5.381 1.00 73.01 O ATOM 101 CB SER A 7 18.101 -3.507 7.747 1.00 64.32 C ATOM 102 OG SER A 7 17.322 -4.618 8.210 1.00 62.03 O ATOM 0 H SER A 7 15.866 -3.912 6.036 1.00 10.33 H new ATOM 0 HA SER A 7 18.249 -2.213 6.054 1.00 12.00 H new ATOM 0 HB2 SER A 7 19.162 -3.745 7.827 1.00 64.32 H new ATOM 0 HB3 SER A 7 17.920 -2.642 8.385 1.00 64.32 H new ATOM 0 HG SER A 7 16.729 -4.924 7.492 1.00 62.03 H new ATOM 108 N PRO A 8 19.159 -3.812 4.400 1.00 2.52 N ATOM 109 CA PRO A 8 19.632 -2.429 4.258 1.00 61.43 C ATOM 110 C PRO A 8 18.577 -1.498 3.645 1.00 2.21 C ATOM 111 O PRO A 8 17.703 -1.941 2.896 1.00 51.15 O ATOM 112 CB PRO A 8 20.818 -2.570 3.316 1.00 44.34 C ATOM 113 CG PRO A 8 20.513 -3.768 2.501 1.00 23.33 C ATOM 114 CD PRO A 8 19.774 -4.705 3.404 1.00 31.25 C ATOM 0 HA PRO A 8 19.872 -1.981 5.222 1.00 61.43 H new ATOM 0 HB2 PRO A 8 20.934 -1.685 2.690 1.00 44.34 H new ATOM 0 HB3 PRO A 8 21.749 -2.694 3.868 1.00 44.34 H new ATOM 0 HG2 PRO A 8 19.909 -3.505 1.633 1.00 23.33 H new ATOM 0 HG3 PRO A 8 21.427 -4.228 2.126 1.00 23.33 H new ATOM 0 HD2 PRO A 8 19.022 -5.277 2.860 1.00 31.25 H new ATOM 0 HD3 PRO A 8 20.446 -5.425 3.871 1.00 31.25 H new ATOM 122 N SER A 9 18.650 -0.226 3.984 1.00 12.12 N ATOM 123 CA SER A 9 17.735 0.765 3.449 1.00 73.51 C ATOM 124 C SER A 9 18.259 1.325 2.117 1.00 32.14 C ATOM 125 O SER A 9 17.662 2.209 1.510 1.00 31.13 O ATOM 126 CB SER A 9 17.474 1.874 4.475 1.00 64.44 C ATOM 127 OG SER A 9 18.690 2.463 4.929 1.00 0.34 O ATOM 0 H SER A 9 19.341 0.149 4.634 1.00 12.12 H new ATOM 0 HA SER A 9 16.779 0.282 3.245 1.00 73.51 H new ATOM 0 HB2 SER A 9 16.841 2.641 4.030 1.00 64.44 H new ATOM 0 HB3 SER A 9 16.928 1.464 5.324 1.00 64.44 H new ATOM 0 HG SER A 9 18.489 3.167 5.580 1.00 0.34 H new ATOM 133 N SER A 10 19.370 0.796 1.681 1.00 44.10 N ATOM 134 CA SER A 10 19.923 1.101 0.390 1.00 45.41 C ATOM 135 C SER A 10 20.852 -0.037 -0.013 1.00 51.31 C ATOM 136 O SER A 10 21.585 -0.557 0.832 1.00 45.32 O ATOM 137 CB SER A 10 20.645 2.465 0.418 1.00 51.03 C ATOM 138 OG SER A 10 21.593 2.534 1.489 1.00 44.12 O ATOM 0 H SER A 10 19.924 0.131 2.221 1.00 44.10 H new ATOM 0 HA SER A 10 19.132 1.187 -0.355 1.00 45.41 H new ATOM 0 HB2 SER A 10 21.155 2.628 -0.532 1.00 51.03 H new ATOM 0 HB3 SER A 10 19.912 3.264 0.527 1.00 51.03 H new ATOM 0 HG SER A 10 22.035 3.409 1.479 1.00 44.12 H new ATOM 144 N LEU A 11 20.815 -0.441 -1.264 1.00 74.04 N ATOM 145 CA LEU A 11 21.619 -1.558 -1.703 1.00 35.33 C ATOM 146 C LEU A 11 21.860 -1.470 -3.198 1.00 2.31 C ATOM 147 O LEU A 11 20.917 -1.328 -3.986 1.00 34.22 O ATOM 148 CB LEU A 11 20.903 -2.894 -1.298 1.00 71.43 C ATOM 149 CG LEU A 11 21.647 -4.244 -1.511 1.00 32.11 C ATOM 150 CD1 LEU A 11 20.904 -5.349 -0.791 1.00 4.23 C ATOM 151 CD2 LEU A 11 21.752 -4.622 -2.984 1.00 63.24 C ATOM 0 H LEU A 11 20.240 -0.015 -1.991 1.00 74.04 H new ATOM 0 HA LEU A 11 22.595 -1.535 -1.219 1.00 35.33 H new ATOM 0 HB2 LEU A 11 20.647 -2.823 -0.241 1.00 71.43 H new ATOM 0 HB3 LEU A 11 19.965 -2.945 -1.850 1.00 71.43 H new ATOM 0 HG LEU A 11 22.655 -4.120 -1.115 1.00 32.11 H new ATOM 0 HD11 LEU A 11 21.425 -6.295 -0.940 1.00 4.23 H new ATOM 0 HD12 LEU A 11 20.859 -5.123 0.274 1.00 4.23 H new ATOM 0 HD13 LEU A 11 19.892 -5.426 -1.188 1.00 4.23 H new ATOM 0 HD21 LEU A 11 22.279 -5.571 -3.079 1.00 63.24 H new ATOM 0 HD22 LEU A 11 20.752 -4.718 -3.407 1.00 63.24 H new ATOM 0 HD23 LEU A 11 22.300 -3.847 -3.520 1.00 63.24 H new ATOM 163 N SER A 12 23.105 -1.531 -3.575 1.00 71.32 N ATOM 164 CA SER A 12 23.488 -1.542 -4.949 1.00 24.32 C ATOM 165 C SER A 12 24.020 -2.925 -5.335 1.00 13.40 C ATOM 166 O SER A 12 24.930 -3.466 -4.683 1.00 61.00 O ATOM 167 CB SER A 12 24.516 -0.443 -5.209 1.00 62.23 C ATOM 168 OG SER A 12 25.598 -0.529 -4.287 1.00 24.53 O ATOM 0 H SER A 12 23.889 -1.575 -2.925 1.00 71.32 H new ATOM 0 HA SER A 12 22.619 -1.339 -5.574 1.00 24.32 H new ATOM 0 HB2 SER A 12 24.894 -0.527 -6.228 1.00 62.23 H new ATOM 0 HB3 SER A 12 24.039 0.534 -5.126 1.00 62.23 H new ATOM 0 HG SER A 12 25.777 -1.470 -4.079 1.00 24.53 H new ATOM 174 N ALA A 13 23.438 -3.504 -6.354 1.00 51.14 N ATOM 175 CA ALA A 13 23.817 -4.826 -6.826 1.00 14.14 C ATOM 176 C ALA A 13 23.869 -4.815 -8.343 1.00 52.23 C ATOM 177 O ALA A 13 23.224 -4.002 -8.946 1.00 44.13 O ATOM 178 CB ALA A 13 22.831 -5.862 -6.318 1.00 64.22 C ATOM 0 H ALA A 13 22.682 -3.075 -6.888 1.00 51.14 H new ATOM 0 HA ALA A 13 24.803 -5.089 -6.443 1.00 14.14 H new ATOM 0 HB1 ALA A 13 23.123 -6.849 -6.677 1.00 64.22 H new ATOM 0 HB2 ALA A 13 22.828 -5.858 -5.228 1.00 64.22 H new ATOM 0 HB3 ALA A 13 21.832 -5.624 -6.684 1.00 64.22 H new ATOM 184 N SER A 14 24.654 -5.673 -8.950 1.00 22.43 N ATOM 185 CA SER A 14 24.773 -5.669 -10.399 1.00 71.14 C ATOM 186 C SER A 14 23.669 -6.530 -10.995 1.00 54.30 C ATOM 187 O SER A 14 23.022 -7.299 -10.261 1.00 3.25 O ATOM 188 CB SER A 14 26.180 -6.137 -10.860 1.00 31.22 C ATOM 189 OG SER A 14 26.488 -7.461 -10.439 1.00 71.32 O ATOM 0 H SER A 14 25.217 -6.378 -8.474 1.00 22.43 H new ATOM 0 HA SER A 14 24.657 -4.647 -10.761 1.00 71.14 H new ATOM 0 HB2 SER A 14 26.237 -6.084 -11.947 1.00 31.22 H new ATOM 0 HB3 SER A 14 26.932 -5.452 -10.468 1.00 31.22 H new ATOM 0 HG SER A 14 25.855 -7.739 -9.745 1.00 71.32 H new ATOM 195 N VAL A 15 23.418 -6.393 -12.288 1.00 31.23 N ATOM 196 CA VAL A 15 22.393 -7.186 -12.941 1.00 15.44 C ATOM 197 C VAL A 15 22.710 -8.656 -12.779 1.00 60.52 C ATOM 198 O VAL A 15 23.780 -9.129 -13.174 1.00 3.34 O ATOM 199 CB VAL A 15 22.250 -6.848 -14.451 1.00 55.43 C ATOM 200 CG1 VAL A 15 21.202 -7.738 -15.110 1.00 21.31 C ATOM 201 CG2 VAL A 15 21.868 -5.404 -14.623 1.00 24.14 C ATOM 0 H VAL A 15 23.909 -5.743 -12.902 1.00 31.23 H new ATOM 0 HA VAL A 15 21.443 -6.946 -12.463 1.00 15.44 H new ATOM 0 HB VAL A 15 23.211 -7.028 -14.932 1.00 55.43 H new ATOM 0 HG11 VAL A 15 21.120 -7.482 -16.166 1.00 21.31 H new ATOM 0 HG12 VAL A 15 21.498 -8.783 -15.011 1.00 21.31 H new ATOM 0 HG13 VAL A 15 20.238 -7.586 -14.624 1.00 21.31 H new ATOM 0 HG21 VAL A 15 21.770 -5.177 -15.685 1.00 24.14 H new ATOM 0 HG22 VAL A 15 20.918 -5.217 -14.123 1.00 24.14 H new ATOM 0 HG23 VAL A 15 22.639 -4.769 -14.186 1.00 24.14 H new ATOM 211 N GLY A 16 21.797 -9.350 -12.178 1.00 64.24 N ATOM 212 CA GLY A 16 21.973 -10.757 -11.950 1.00 23.41 C ATOM 213 C GLY A 16 22.290 -11.088 -10.507 1.00 21.22 C ATOM 214 O GLY A 16 22.305 -12.262 -10.130 1.00 74.24 O ATOM 0 H GLY A 16 20.917 -8.967 -11.833 1.00 64.24 H new ATOM 0 HA2 GLY A 16 21.066 -11.284 -12.247 1.00 23.41 H new ATOM 0 HA3 GLY A 16 22.778 -11.125 -12.586 1.00 23.41 H new ATOM 218 N ASP A 17 22.576 -10.075 -9.699 1.00 71.32 N ATOM 219 CA ASP A 17 22.801 -10.294 -8.262 1.00 24.30 C ATOM 220 C ASP A 17 21.519 -10.583 -7.555 1.00 0.02 C ATOM 221 O ASP A 17 20.429 -10.233 -8.040 1.00 64.55 O ATOM 222 CB ASP A 17 23.487 -9.116 -7.544 1.00 51.01 C ATOM 223 CG ASP A 17 24.994 -9.086 -7.632 1.00 62.01 C ATOM 224 OD1 ASP A 17 25.648 -9.992 -7.066 1.00 43.32 O ATOM 225 OD2 ASP A 17 25.555 -8.123 -8.174 1.00 42.11 O ATOM 0 H ASP A 17 22.659 -9.104 -10.001 1.00 71.32 H new ATOM 0 HA ASP A 17 23.475 -11.150 -8.218 1.00 24.30 H new ATOM 0 HB2 ASP A 17 23.098 -8.186 -7.958 1.00 51.01 H new ATOM 0 HB3 ASP A 17 23.203 -9.140 -6.492 1.00 51.01 H new ATOM 230 N ARG A 18 21.635 -11.223 -6.425 1.00 74.12 N ATOM 231 CA ARG A 18 20.513 -11.508 -5.607 1.00 4.14 C ATOM 232 C ARG A 18 20.453 -10.465 -4.503 1.00 15.31 C ATOM 233 O ARG A 18 21.380 -10.339 -3.699 1.00 0.44 O ATOM 234 CB ARG A 18 20.602 -12.917 -5.019 1.00 43.20 C ATOM 235 CG ARG A 18 19.370 -13.308 -4.228 1.00 40.31 C ATOM 236 CD ARG A 18 19.454 -14.719 -3.677 1.00 1.12 C ATOM 237 NE ARG A 18 20.540 -14.897 -2.704 1.00 42.25 N ATOM 238 CZ ARG A 18 20.836 -16.063 -2.109 1.00 54.30 C ATOM 239 NH1 ARG A 18 20.138 -17.161 -2.413 1.00 22.23 N ATOM 240 NH2 ARG A 18 21.820 -16.129 -1.210 1.00 43.30 N ATOM 0 H ARG A 18 22.523 -11.560 -6.052 1.00 74.12 H new ATOM 0 HA ARG A 18 19.603 -11.470 -6.206 1.00 4.14 H new ATOM 0 HB2 ARG A 18 20.750 -13.633 -5.827 1.00 43.20 H new ATOM 0 HB3 ARG A 18 21.477 -12.980 -4.372 1.00 43.20 H new ATOM 0 HG2 ARG A 18 19.234 -12.608 -3.404 1.00 40.31 H new ATOM 0 HG3 ARG A 18 18.491 -13.223 -4.866 1.00 40.31 H new ATOM 0 HD2 ARG A 18 18.506 -14.974 -3.204 1.00 1.12 H new ATOM 0 HD3 ARG A 18 19.597 -15.416 -4.502 1.00 1.12 H new ATOM 0 HE ARG A 18 21.105 -14.082 -2.465 1.00 42.25 H new ATOM 0 HH11 ARG A 18 19.382 -17.112 -3.096 1.00 22.23 H new ATOM 0 HH12 ARG A 18 20.361 -18.048 -1.962 1.00 22.23 H new ATOM 0 HH21 ARG A 18 22.351 -15.291 -0.972 1.00 43.30 H new ATOM 0 HH22 ARG A 18 22.041 -17.017 -0.760 1.00 43.30 H new ATOM 254 N VAL A 19 19.392 -9.718 -4.484 1.00 52.21 N ATOM 255 CA VAL A 19 19.207 -8.650 -3.524 1.00 44.21 C ATOM 256 C VAL A 19 18.640 -9.198 -2.232 1.00 52.10 C ATOM 257 O VAL A 19 17.649 -9.913 -2.251 1.00 63.42 O ATOM 258 CB VAL A 19 18.238 -7.580 -4.079 1.00 0.32 C ATOM 259 CG1 VAL A 19 18.026 -6.455 -3.081 1.00 42.43 C ATOM 260 CG2 VAL A 19 18.750 -7.040 -5.399 1.00 63.13 C ATOM 0 H VAL A 19 18.616 -9.826 -5.138 1.00 52.21 H new ATOM 0 HA VAL A 19 20.180 -8.196 -3.337 1.00 44.21 H new ATOM 0 HB VAL A 19 17.272 -8.055 -4.249 1.00 0.32 H new ATOM 0 HG11 VAL A 19 17.340 -5.720 -3.502 1.00 42.43 H new ATOM 0 HG12 VAL A 19 17.604 -6.860 -2.161 1.00 42.43 H new ATOM 0 HG13 VAL A 19 18.981 -5.977 -2.863 1.00 42.43 H new ATOM 0 HG21 VAL A 19 18.058 -6.288 -5.778 1.00 63.13 H new ATOM 0 HG22 VAL A 19 19.731 -6.589 -5.251 1.00 63.13 H new ATOM 0 HG23 VAL A 19 18.830 -7.855 -6.119 1.00 63.13 H new ATOM 270 N THR A 20 19.263 -8.875 -1.129 1.00 23.50 N ATOM 271 CA THR A 20 18.787 -9.306 0.149 1.00 60.24 C ATOM 272 C THR A 20 18.322 -8.099 0.969 1.00 2.14 C ATOM 273 O THR A 20 19.105 -7.206 1.271 1.00 1.02 O ATOM 274 CB THR A 20 19.906 -10.033 0.904 1.00 72.42 C ATOM 275 OG1 THR A 20 20.402 -11.093 0.082 1.00 52.13 O ATOM 276 CG2 THR A 20 19.384 -10.617 2.208 1.00 32.54 C ATOM 0 H THR A 20 20.110 -8.308 -1.096 1.00 23.50 H new ATOM 0 HA THR A 20 17.948 -9.986 0.001 1.00 60.24 H new ATOM 0 HB THR A 20 20.699 -9.322 1.133 1.00 72.42 H new ATOM 0 HG1 THR A 20 21.120 -11.564 0.554 1.00 52.13 H new ATOM 0 HG21 THR A 20 20.194 -11.128 2.728 1.00 32.54 H new ATOM 0 HG22 THR A 20 18.998 -9.815 2.837 1.00 32.54 H new ATOM 0 HG23 THR A 20 18.585 -11.327 1.995 1.00 32.54 H new ATOM 284 N ILE A 21 17.056 -8.075 1.306 1.00 11.31 N ATOM 285 CA ILE A 21 16.496 -7.018 2.117 1.00 21.43 C ATOM 286 C ILE A 21 15.795 -7.638 3.323 1.00 63.24 C ATOM 287 O ILE A 21 14.959 -8.505 3.165 1.00 64.31 O ATOM 288 CB ILE A 21 15.459 -6.169 1.318 1.00 45.22 C ATOM 289 CG1 ILE A 21 16.107 -5.496 0.097 1.00 12.24 C ATOM 290 CG2 ILE A 21 14.869 -5.118 2.223 1.00 72.32 C ATOM 291 CD1 ILE A 21 15.137 -4.759 -0.826 1.00 0.44 C ATOM 0 H ILE A 21 16.382 -8.788 1.026 1.00 11.31 H new ATOM 0 HA ILE A 21 17.309 -6.363 2.430 1.00 21.43 H new ATOM 0 HB ILE A 21 14.675 -6.836 0.959 1.00 45.22 H new ATOM 0 HG12 ILE A 21 16.859 -4.789 0.447 1.00 12.24 H new ATOM 0 HG13 ILE A 21 16.630 -6.256 -0.483 1.00 12.24 H new ATOM 0 HG21 ILE A 21 14.144 -4.524 1.666 1.00 72.32 H new ATOM 0 HG22 ILE A 21 14.373 -5.600 3.065 1.00 72.32 H new ATOM 0 HG23 ILE A 21 15.663 -4.469 2.593 1.00 72.32 H new ATOM 0 HD11 ILE A 21 15.689 -4.319 -1.657 1.00 0.44 H new ATOM 0 HD12 ILE A 21 14.398 -5.461 -1.213 1.00 0.44 H new ATOM 0 HD13 ILE A 21 14.631 -3.971 -0.268 1.00 0.44 H new ATOM 303 N THR A 22 16.140 -7.221 4.502 1.00 13.44 N ATOM 304 CA THR A 22 15.502 -7.731 5.684 1.00 54.22 C ATOM 305 C THR A 22 14.654 -6.631 6.299 1.00 73.24 C ATOM 306 O THR A 22 15.109 -5.492 6.439 1.00 72.24 O ATOM 307 CB THR A 22 16.550 -8.169 6.716 1.00 33.43 C ATOM 308 OG1 THR A 22 17.542 -8.975 6.058 1.00 64.44 O ATOM 309 CG2 THR A 22 15.908 -9.004 7.821 1.00 33.50 C ATOM 0 H THR A 22 16.864 -6.524 4.675 1.00 13.44 H new ATOM 0 HA THR A 22 14.888 -8.588 5.409 1.00 54.22 H new ATOM 0 HB THR A 22 16.998 -7.278 7.156 1.00 33.43 H new ATOM 0 HG1 THR A 22 18.217 -9.259 6.709 1.00 64.44 H new ATOM 0 HG21 THR A 22 16.670 -9.303 8.541 1.00 33.50 H new ATOM 0 HG22 THR A 22 15.144 -8.413 8.326 1.00 33.50 H new ATOM 0 HG23 THR A 22 15.451 -9.893 7.386 1.00 33.50 H new ATOM 317 N CYS A 23 13.460 -6.955 6.656 1.00 63.01 N ATOM 318 CA CYS A 23 12.598 -6.021 7.287 1.00 73.32 C ATOM 319 C CYS A 23 12.208 -6.574 8.621 1.00 74.20 C ATOM 320 O CYS A 23 11.921 -7.769 8.747 1.00 34.31 O ATOM 321 CB CYS A 23 11.355 -5.738 6.434 1.00 62.10 C ATOM 322 SG CYS A 23 10.183 -4.562 7.199 1.00 41.43 S ATOM 0 H CYS A 23 13.053 -7.880 6.517 1.00 63.01 H new ATOM 0 HA CYS A 23 13.120 -5.072 7.410 1.00 73.32 H new ATOM 0 HB2 CYS A 23 11.671 -5.344 5.468 1.00 62.10 H new ATOM 0 HB3 CYS A 23 10.837 -6.678 6.241 1.00 62.10 H new ATOM 327 N GLN A 24 12.238 -5.740 9.611 1.00 50.14 N ATOM 328 CA GLN A 24 11.880 -6.144 10.945 1.00 62.13 C ATOM 329 C GLN A 24 10.656 -5.402 11.415 1.00 44.33 C ATOM 330 O GLN A 24 10.545 -4.186 11.224 1.00 53.22 O ATOM 331 CB GLN A 24 13.039 -5.927 11.913 1.00 44.31 C ATOM 332 CG GLN A 24 14.282 -6.720 11.550 1.00 62.51 C ATOM 333 CD GLN A 24 15.440 -6.501 12.501 1.00 12.31 C ATOM 334 OE1 GLN A 24 15.153 -6.237 13.752 1.00 72.45 O flip ATOM 335 NE2 GLN A 24 16.603 -6.584 12.096 1.00 31.44 N flip ATOM 0 H GLN A 24 12.510 -4.761 9.524 1.00 50.14 H new ATOM 0 HA GLN A 24 11.652 -7.210 10.922 1.00 62.13 H new ATOM 0 HB2 GLN A 24 13.288 -4.866 11.939 1.00 44.31 H new ATOM 0 HB3 GLN A 24 12.721 -6.204 12.918 1.00 44.31 H new ATOM 0 HG2 GLN A 24 14.033 -7.781 11.532 1.00 62.51 H new ATOM 0 HG3 GLN A 24 14.594 -6.448 10.542 1.00 62.51 H new ATOM 0 HE21 GLN A 24 16.788 -6.791 11.114 1.00 31.44 H new ATOM 0 HE22 GLN A 24 17.379 -6.445 12.743 1.00 31.44 H new ATOM 344 N ALA A 25 9.749 -6.134 11.999 1.00 42.33 N ATOM 345 CA ALA A 25 8.535 -5.600 12.553 1.00 64.34 C ATOM 346 C ALA A 25 8.642 -5.610 14.067 1.00 15.14 C ATOM 347 O ALA A 25 8.939 -6.642 14.653 1.00 1.24 O ATOM 348 CB ALA A 25 7.332 -6.437 12.104 1.00 31.03 C ATOM 0 H ALA A 25 9.835 -7.145 12.106 1.00 42.33 H new ATOM 0 HA ALA A 25 8.391 -4.579 12.200 1.00 64.34 H new ATOM 0 HB1 ALA A 25 6.420 -6.021 12.531 1.00 31.03 H new ATOM 0 HB2 ALA A 25 7.263 -6.421 11.016 1.00 31.03 H new ATOM 0 HB3 ALA A 25 7.456 -7.465 12.445 1.00 31.03 H new ATOM 354 N SER A 26 8.427 -4.464 14.686 1.00 60.01 N ATOM 355 CA SER A 26 8.487 -4.342 16.140 1.00 75.21 C ATOM 356 C SER A 26 7.426 -5.233 16.819 1.00 45.05 C ATOM 357 O SER A 26 7.669 -5.827 17.883 1.00 65.31 O ATOM 358 CB SER A 26 8.321 -2.874 16.547 1.00 31.04 C ATOM 359 OG SER A 26 8.396 -2.700 17.945 1.00 34.35 O ATOM 0 H SER A 26 8.207 -3.593 14.203 1.00 60.01 H new ATOM 0 HA SER A 26 9.464 -4.688 16.478 1.00 75.21 H new ATOM 0 HB2 SER A 26 9.094 -2.275 16.065 1.00 31.04 H new ATOM 0 HB3 SER A 26 7.361 -2.505 16.187 1.00 31.04 H new ATOM 0 HG SER A 26 8.287 -1.751 18.163 1.00 34.35 H new ATOM 365 N GLN A 27 6.280 -5.345 16.186 1.00 65.33 N ATOM 366 CA GLN A 27 5.201 -6.160 16.677 1.00 2.13 C ATOM 367 C GLN A 27 4.949 -7.241 15.659 1.00 50.33 C ATOM 368 O GLN A 27 4.978 -6.967 14.460 1.00 64.24 O ATOM 369 CB GLN A 27 3.950 -5.296 16.905 1.00 63.53 C ATOM 370 CG GLN A 27 2.702 -6.051 17.369 1.00 73.04 C ATOM 371 CD GLN A 27 1.513 -5.130 17.645 1.00 4.23 C ATOM 372 OE1 GLN A 27 1.447 -4.022 16.952 1.00 40.01 O flip ATOM 373 NE2 GLN A 27 0.661 -5.422 18.486 1.00 65.53 N flip ATOM 0 H GLN A 27 6.073 -4.867 15.309 1.00 65.33 H new ATOM 0 HA GLN A 27 5.456 -6.613 17.635 1.00 2.13 H new ATOM 0 HB2 GLN A 27 4.187 -4.532 17.646 1.00 63.53 H new ATOM 0 HB3 GLN A 27 3.714 -4.777 15.976 1.00 63.53 H new ATOM 0 HG2 GLN A 27 2.421 -6.779 16.608 1.00 73.04 H new ATOM 0 HG3 GLN A 27 2.938 -6.611 18.274 1.00 73.04 H new ATOM 0 HE21 GLN A 27 0.740 -6.293 19.011 1.00 65.53 H new ATOM 0 HE22 GLN A 27 -0.123 -4.792 18.658 1.00 65.53 H new ATOM 382 N ASP A 28 4.721 -8.457 16.124 1.00 24.24 N ATOM 383 CA ASP A 28 4.537 -9.591 15.235 1.00 34.41 C ATOM 384 C ASP A 28 3.328 -9.425 14.342 1.00 24.25 C ATOM 385 O ASP A 28 2.244 -9.029 14.788 1.00 5.35 O ATOM 386 CB ASP A 28 4.488 -10.933 15.988 1.00 34.23 C ATOM 387 CG ASP A 28 3.344 -11.061 16.976 1.00 32.43 C ATOM 388 OD1 ASP A 28 2.226 -11.443 16.576 1.00 2.20 O ATOM 389 OD2 ASP A 28 3.566 -10.810 18.177 1.00 75.23 O ATOM 0 H ASP A 28 4.659 -8.685 17.116 1.00 24.24 H new ATOM 0 HA ASP A 28 5.419 -9.615 14.596 1.00 34.41 H new ATOM 0 HB2 ASP A 28 4.414 -11.741 15.260 1.00 34.23 H new ATOM 0 HB3 ASP A 28 5.429 -11.070 16.521 1.00 34.23 H new ATOM 394 N ILE A 29 3.540 -9.685 13.074 1.00 44.45 N ATOM 395 CA ILE A 29 2.496 -9.590 12.064 1.00 63.12 C ATOM 396 C ILE A 29 2.346 -10.941 11.368 1.00 43.42 C ATOM 397 O ILE A 29 1.635 -11.081 10.371 1.00 53.44 O ATOM 398 CB ILE A 29 2.854 -8.503 11.017 1.00 70.04 C ATOM 399 CG1 ILE A 29 4.170 -8.855 10.304 1.00 4.55 C ATOM 400 CG2 ILE A 29 2.958 -7.146 11.700 1.00 31.51 C ATOM 401 CD1 ILE A 29 4.591 -7.861 9.246 1.00 75.22 C ATOM 0 H ILE A 29 4.447 -9.971 12.704 1.00 44.45 H new ATOM 0 HA ILE A 29 1.558 -9.315 12.546 1.00 63.12 H new ATOM 0 HB ILE A 29 2.065 -8.459 10.266 1.00 70.04 H new ATOM 0 HG12 ILE A 29 4.963 -8.933 11.048 1.00 4.55 H new ATOM 0 HG13 ILE A 29 4.068 -9.837 9.843 1.00 4.55 H new ATOM 0 HG21 ILE A 29 3.210 -6.385 10.961 1.00 31.51 H new ATOM 0 HG22 ILE A 29 2.004 -6.899 12.165 1.00 31.51 H new ATOM 0 HG23 ILE A 29 3.735 -7.182 12.463 1.00 31.51 H new ATOM 0 HD11 ILE A 29 5.528 -8.186 8.794 1.00 75.22 H new ATOM 0 HD12 ILE A 29 3.820 -7.799 8.478 1.00 75.22 H new ATOM 0 HD13 ILE A 29 4.729 -6.881 9.702 1.00 75.22 H new ATOM 413 N SER A 30 3.023 -11.915 11.932 1.00 11.32 N ATOM 414 CA SER A 30 3.079 -13.290 11.433 1.00 31.44 C ATOM 415 C SER A 30 3.540 -13.395 9.968 1.00 52.44 C ATOM 416 O SER A 30 4.734 -13.372 9.699 1.00 41.30 O ATOM 417 CB SER A 30 1.788 -14.072 11.713 1.00 13.43 C ATOM 418 OG SER A 30 1.528 -14.123 13.115 1.00 63.45 O ATOM 0 H SER A 30 3.572 -11.778 12.780 1.00 11.32 H new ATOM 0 HA SER A 30 3.863 -13.779 12.012 1.00 31.44 H new ATOM 0 HB2 SER A 30 0.951 -13.599 11.199 1.00 13.43 H new ATOM 0 HB3 SER A 30 1.875 -15.084 11.316 1.00 13.43 H new ATOM 0 HG SER A 30 0.701 -14.623 13.276 1.00 63.45 H new ATOM 424 N ASN A 31 2.612 -13.516 9.046 1.00 64.42 N ATOM 425 CA ASN A 31 2.939 -13.576 7.624 1.00 63.45 C ATOM 426 C ASN A 31 2.281 -12.444 6.860 1.00 34.44 C ATOM 427 O ASN A 31 2.406 -12.344 5.634 1.00 22.33 O ATOM 428 CB ASN A 31 2.547 -14.930 7.005 1.00 4.14 C ATOM 429 CG ASN A 31 1.060 -15.249 7.109 1.00 53.25 C ATOM 430 OD1 ASN A 31 0.376 -14.866 8.075 1.00 24.31 O ATOM 431 ND2 ASN A 31 0.542 -15.919 6.118 1.00 41.02 N ATOM 0 H ASN A 31 1.614 -13.576 9.250 1.00 64.42 H new ATOM 0 HA ASN A 31 4.021 -13.467 7.544 1.00 63.45 H new ATOM 0 HB2 ASN A 31 2.837 -14.936 5.954 1.00 4.14 H new ATOM 0 HB3 ASN A 31 3.114 -15.721 7.497 1.00 4.14 H new ATOM 0 HD21 ASN A 31 -0.453 -16.144 6.119 1.00 41.02 H new ATOM 0 HD22 ASN A 31 1.132 -16.218 5.341 1.00 41.02 H new ATOM 438 N TYR A 32 1.595 -11.576 7.576 1.00 13.32 N ATOM 439 CA TYR A 32 0.859 -10.507 6.947 1.00 71.31 C ATOM 440 C TYR A 32 1.778 -9.342 6.604 1.00 44.50 C ATOM 441 O TYR A 32 1.917 -8.386 7.372 1.00 3.41 O ATOM 442 CB TYR A 32 -0.325 -10.055 7.815 1.00 62.42 C ATOM 443 CG TYR A 32 -1.307 -11.170 8.142 1.00 61.01 C ATOM 444 CD1 TYR A 32 -2.293 -11.543 7.242 1.00 3.15 C ATOM 445 CD2 TYR A 32 -1.237 -11.851 9.345 1.00 41.34 C ATOM 446 CE1 TYR A 32 -3.185 -12.557 7.533 1.00 2.21 C ATOM 447 CE2 TYR A 32 -2.123 -12.866 9.644 1.00 34.25 C ATOM 448 CZ TYR A 32 -3.091 -13.214 8.739 1.00 50.04 C ATOM 449 OH TYR A 32 -3.977 -14.231 9.043 1.00 2.24 O ATOM 0 H TYR A 32 1.534 -11.593 8.594 1.00 13.32 H new ATOM 0 HA TYR A 32 0.446 -10.890 6.013 1.00 71.31 H new ATOM 0 HB2 TYR A 32 0.058 -9.636 8.746 1.00 62.42 H new ATOM 0 HB3 TYR A 32 -0.856 -9.255 7.300 1.00 62.42 H new ATOM 0 HD1 TYR A 32 -2.365 -11.031 6.294 1.00 3.15 H new ATOM 0 HD2 TYR A 32 -0.475 -11.583 10.062 1.00 41.34 H new ATOM 0 HE1 TYR A 32 -3.949 -12.832 6.821 1.00 2.21 H new ATOM 0 HE2 TYR A 32 -2.053 -13.385 10.589 1.00 34.25 H new ATOM 0 HH TYR A 32 -3.771 -14.589 9.932 1.00 2.24 H new ATOM 459 N LEU A 33 2.412 -9.451 5.460 1.00 2.33 N ATOM 460 CA LEU A 33 3.390 -8.490 5.008 1.00 52.13 C ATOM 461 C LEU A 33 3.252 -8.255 3.507 1.00 61.55 C ATOM 462 O LEU A 33 3.148 -9.217 2.738 1.00 51.44 O ATOM 463 CB LEU A 33 4.779 -9.071 5.263 1.00 0.22 C ATOM 464 CG LEU A 33 5.959 -8.225 4.823 1.00 14.21 C ATOM 465 CD1 LEU A 33 6.099 -6.996 5.678 1.00 75.43 C ATOM 466 CD2 LEU A 33 7.224 -9.029 4.820 1.00 40.22 C ATOM 0 H LEU A 33 2.261 -10.221 4.808 1.00 2.33 H new ATOM 0 HA LEU A 33 3.241 -7.550 5.539 1.00 52.13 H new ATOM 0 HB2 LEU A 33 4.877 -9.264 6.331 1.00 0.22 H new ATOM 0 HB3 LEU A 33 4.843 -10.035 4.758 1.00 0.22 H new ATOM 0 HG LEU A 33 5.769 -7.895 3.802 1.00 14.21 H new ATOM 0 HD11 LEU A 33 6.953 -6.411 5.337 1.00 75.43 H new ATOM 0 HD12 LEU A 33 5.193 -6.394 5.601 1.00 75.43 H new ATOM 0 HD13 LEU A 33 6.252 -7.291 6.716 1.00 75.43 H new ATOM 0 HD21 LEU A 33 8.055 -8.399 4.501 1.00 40.22 H new ATOM 0 HD22 LEU A 33 7.419 -9.405 5.824 1.00 40.22 H new ATOM 0 HD23 LEU A 33 7.120 -9.868 4.132 1.00 40.22 H new ATOM 478 N ASN A 34 3.238 -7.000 3.096 1.00 13.21 N ATOM 479 CA ASN A 34 3.235 -6.646 1.670 1.00 2.52 C ATOM 480 C ASN A 34 4.536 -5.968 1.286 1.00 25.04 C ATOM 481 O ASN A 34 5.142 -5.253 2.100 1.00 61.00 O ATOM 482 CB ASN A 34 2.057 -5.721 1.273 1.00 64.31 C ATOM 483 CG ASN A 34 0.699 -6.388 1.159 1.00 43.34 C ATOM 484 OD1 ASN A 34 0.481 -7.400 1.906 1.00 32.23 O flip ATOM 485 ND2 ASN A 34 -0.147 -5.969 0.378 1.00 20.30 N flip ATOM 0 H ASN A 34 3.228 -6.198 3.726 1.00 13.21 H new ATOM 0 HA ASN A 34 3.118 -7.586 1.130 1.00 2.52 H new ATOM 0 HB2 ASN A 34 1.986 -4.920 2.009 1.00 64.31 H new ATOM 0 HB3 ASN A 34 2.293 -5.255 0.316 1.00 64.31 H new ATOM 0 HD21 ASN A 34 0.056 -5.158 -0.207 1.00 20.30 H new ATOM 0 HD22 ASN A 34 -1.054 -6.431 0.312 1.00 20.30 H new ATOM 492 N TRP A 35 4.979 -6.206 0.066 1.00 74.40 N ATOM 493 CA TRP A 35 6.158 -5.550 -0.457 1.00 60.23 C ATOM 494 C TRP A 35 5.795 -4.649 -1.630 1.00 24.34 C ATOM 495 O TRP A 35 5.150 -5.087 -2.577 1.00 24.24 O ATOM 496 CB TRP A 35 7.219 -6.583 -0.893 1.00 0.42 C ATOM 497 CG TRP A 35 7.884 -7.286 0.253 1.00 63.25 C ATOM 498 CD1 TRP A 35 7.585 -8.518 0.793 1.00 34.20 C ATOM 499 CD2 TRP A 35 8.977 -6.772 1.005 1.00 31.23 C ATOM 500 NE1 TRP A 35 8.432 -8.775 1.844 1.00 71.23 N ATOM 501 CE2 TRP A 35 9.298 -7.715 1.994 1.00 33.32 C ATOM 502 CE3 TRP A 35 9.714 -5.592 0.928 1.00 1.32 C ATOM 503 CZ2 TRP A 35 10.335 -7.504 2.915 1.00 61.41 C ATOM 504 CZ3 TRP A 35 10.730 -5.382 1.821 1.00 54.51 C ATOM 505 CH2 TRP A 35 11.042 -6.323 2.803 1.00 33.02 C ATOM 0 H TRP A 35 4.535 -6.854 -0.584 1.00 74.40 H new ATOM 0 HA TRP A 35 6.580 -4.938 0.340 1.00 60.23 H new ATOM 0 HB2 TRP A 35 6.748 -7.324 -1.538 1.00 0.42 H new ATOM 0 HB3 TRP A 35 7.980 -6.079 -1.489 1.00 0.42 H new ATOM 0 HD1 TRP A 35 6.806 -9.179 0.444 1.00 34.20 H new ATOM 0 HE1 TRP A 35 8.421 -9.616 2.421 1.00 71.23 H new ATOM 0 HE3 TRP A 35 9.487 -4.853 0.174 1.00 1.32 H new ATOM 0 HZ2 TRP A 35 10.570 -8.232 3.677 1.00 61.41 H new ATOM 0 HZ3 TRP A 35 11.303 -4.468 1.764 1.00 54.51 H new ATOM 0 HH2 TRP A 35 11.852 -6.124 3.489 1.00 33.02 H new ATOM 516 N TYR A 36 6.239 -3.409 -1.566 1.00 51.23 N ATOM 517 CA TYR A 36 6.005 -2.424 -2.614 1.00 10.42 C ATOM 518 C TYR A 36 7.308 -1.868 -3.181 1.00 53.11 C ATOM 519 O TYR A 36 8.282 -1.617 -2.441 1.00 35.14 O ATOM 520 CB TYR A 36 5.141 -1.253 -2.110 1.00 23.24 C ATOM 521 CG TYR A 36 3.715 -1.602 -1.758 1.00 62.22 C ATOM 522 CD1 TYR A 36 3.399 -2.197 -0.549 1.00 74.42 C ATOM 523 CD2 TYR A 36 2.678 -1.325 -2.639 1.00 52.21 C ATOM 524 CE1 TYR A 36 2.101 -2.508 -0.228 1.00 14.43 C ATOM 525 CE2 TYR A 36 1.372 -1.631 -2.318 1.00 33.31 C ATOM 526 CZ TYR A 36 1.093 -2.226 -1.108 1.00 31.23 C ATOM 527 OH TYR A 36 -0.200 -2.535 -0.776 1.00 33.21 O ATOM 0 H TYR A 36 6.778 -3.049 -0.779 1.00 51.23 H new ATOM 0 HA TYR A 36 5.473 -2.951 -3.406 1.00 10.42 H new ATOM 0 HB2 TYR A 36 5.620 -0.824 -1.230 1.00 23.24 H new ATOM 0 HB3 TYR A 36 5.128 -0.478 -2.876 1.00 23.24 H new ATOM 0 HD1 TYR A 36 4.188 -2.421 0.154 1.00 74.42 H new ATOM 0 HD2 TYR A 36 2.897 -0.863 -3.590 1.00 52.21 H new ATOM 0 HE1 TYR A 36 1.876 -2.975 0.719 1.00 14.43 H new ATOM 0 HE2 TYR A 36 0.574 -1.406 -3.010 1.00 33.31 H new ATOM 0 HH TYR A 36 -0.780 -1.771 -0.975 1.00 33.21 H new ATOM 537 N GLN A 37 7.286 -1.672 -4.474 1.00 75.45 N ATOM 538 CA GLN A 37 8.354 -1.120 -5.286 1.00 14.01 C ATOM 539 C GLN A 37 7.875 0.191 -5.873 1.00 75.30 C ATOM 540 O GLN A 37 6.886 0.211 -6.589 1.00 64.11 O ATOM 541 CB GLN A 37 8.604 -2.079 -6.465 1.00 24.23 C ATOM 542 CG GLN A 37 9.501 -1.554 -7.562 1.00 51.53 C ATOM 543 CD GLN A 37 9.407 -2.386 -8.831 1.00 75.41 C ATOM 544 OE1 GLN A 37 8.572 -2.117 -9.689 1.00 34.01 O ATOM 545 NE2 GLN A 37 10.255 -3.362 -8.978 1.00 55.54 N ATOM 0 H GLN A 37 6.466 -1.909 -5.032 1.00 75.45 H new ATOM 0 HA GLN A 37 9.254 -0.981 -4.686 1.00 14.01 H new ATOM 0 HB2 GLN A 37 9.040 -2.999 -6.074 1.00 24.23 H new ATOM 0 HB3 GLN A 37 7.642 -2.343 -6.904 1.00 24.23 H new ATOM 0 HG2 GLN A 37 9.232 -0.522 -7.786 1.00 51.53 H new ATOM 0 HG3 GLN A 37 10.533 -1.545 -7.211 1.00 51.53 H new ATOM 0 HE21 GLN A 37 10.937 -3.560 -8.246 1.00 55.54 H new ATOM 0 HE22 GLN A 37 10.238 -3.929 -9.826 1.00 55.54 H new ATOM 554 N GLN A 38 8.521 1.271 -5.571 1.00 55.40 N ATOM 555 CA GLN A 38 8.147 2.497 -6.227 1.00 54.45 C ATOM 556 C GLN A 38 9.275 2.943 -7.100 1.00 15.32 C ATOM 557 O GLN A 38 10.355 3.290 -6.612 1.00 43.03 O ATOM 558 CB GLN A 38 7.713 3.598 -5.264 1.00 72.04 C ATOM 559 CG GLN A 38 7.175 4.833 -5.993 1.00 73.12 C ATOM 560 CD GLN A 38 6.604 5.872 -5.065 1.00 61.44 C ATOM 561 OE1 GLN A 38 6.102 5.550 -3.994 1.00 35.45 O ATOM 562 NE2 GLN A 38 6.658 7.117 -5.462 1.00 72.11 N ATOM 0 H GLN A 38 9.285 1.339 -4.899 1.00 55.40 H new ATOM 0 HA GLN A 38 7.265 2.293 -6.834 1.00 54.45 H new ATOM 0 HB2 GLN A 38 6.944 3.210 -4.596 1.00 72.04 H new ATOM 0 HB3 GLN A 38 8.560 3.887 -4.642 1.00 72.04 H new ATOM 0 HG2 GLN A 38 7.979 5.280 -6.577 1.00 73.12 H new ATOM 0 HG3 GLN A 38 6.404 4.523 -6.698 1.00 73.12 H new ATOM 0 HE21 GLN A 38 7.083 7.348 -6.360 1.00 72.11 H new ATOM 0 HE22 GLN A 38 6.275 7.857 -4.874 1.00 72.11 H new ATOM 571 N LYS A 39 9.042 2.895 -8.375 1.00 61.22 N ATOM 572 CA LYS A 39 10.028 3.241 -9.353 1.00 73.33 C ATOM 573 C LYS A 39 9.804 4.643 -9.863 1.00 12.03 C ATOM 574 O LYS A 39 8.662 5.122 -9.885 1.00 33.43 O ATOM 575 CB LYS A 39 10.056 2.249 -10.508 1.00 74.02 C ATOM 576 CG LYS A 39 8.780 2.164 -11.290 1.00 61.35 C ATOM 577 CD LYS A 39 8.976 1.337 -12.526 1.00 61.52 C ATOM 578 CE LYS A 39 9.462 -0.077 -12.179 1.00 60.32 C ATOM 579 NZ LYS A 39 9.636 -0.940 -13.369 1.00 23.23 N ATOM 0 H LYS A 39 8.147 2.610 -8.772 1.00 61.22 H new ATOM 0 HA LYS A 39 11.000 3.198 -8.862 1.00 73.33 H new ATOM 0 HB2 LYS A 39 10.864 2.524 -11.186 1.00 74.02 H new ATOM 0 HB3 LYS A 39 10.292 1.260 -10.115 1.00 74.02 H new ATOM 0 HG2 LYS A 39 7.996 1.725 -10.672 1.00 61.35 H new ATOM 0 HG3 LYS A 39 8.447 3.165 -11.564 1.00 61.35 H new ATOM 0 HD2 LYS A 39 8.038 1.276 -13.078 1.00 61.52 H new ATOM 0 HD3 LYS A 39 9.700 1.823 -13.180 1.00 61.52 H new ATOM 0 HE2 LYS A 39 10.410 -0.008 -11.646 1.00 60.32 H new ATOM 0 HE3 LYS A 39 8.748 -0.544 -11.500 1.00 60.32 H new ATOM 0 HZ1 LYS A 39 10.504 -1.503 -13.266 1.00 23.23 H new ATOM 0 HZ2 LYS A 39 8.819 -1.577 -13.458 1.00 23.23 H new ATOM 0 HZ3 LYS A 39 9.707 -0.347 -14.220 1.00 23.23 H new ATOM 593 N PRO A 40 10.881 5.323 -10.258 1.00 71.21 N ATOM 594 CA PRO A 40 10.817 6.700 -10.721 1.00 24.24 C ATOM 595 C PRO A 40 9.851 6.871 -11.898 1.00 14.24 C ATOM 596 O PRO A 40 10.004 6.233 -12.958 1.00 24.50 O ATOM 597 CB PRO A 40 12.251 7.024 -11.145 1.00 62.00 C ATOM 598 CG PRO A 40 12.933 5.705 -11.276 1.00 51.21 C ATOM 599 CD PRO A 40 12.242 4.780 -10.326 1.00 13.05 C ATOM 0 HA PRO A 40 10.442 7.366 -9.944 1.00 24.24 H new ATOM 0 HB2 PRO A 40 12.268 7.570 -12.088 1.00 62.00 H new ATOM 0 HB3 PRO A 40 12.747 7.651 -10.404 1.00 62.00 H new ATOM 0 HG2 PRO A 40 12.867 5.333 -12.298 1.00 51.21 H new ATOM 0 HG3 PRO A 40 13.993 5.789 -11.035 1.00 51.21 H new ATOM 0 HD2 PRO A 40 12.248 3.752 -10.689 1.00 13.05 H new ATOM 0 HD3 PRO A 40 12.723 4.775 -9.348 1.00 13.05 H new ATOM 607 N GLY A 41 8.865 7.708 -11.700 1.00 64.00 N ATOM 608 CA GLY A 41 7.872 7.964 -12.714 1.00 33.41 C ATOM 609 C GLY A 41 6.628 7.108 -12.562 1.00 11.30 C ATOM 610 O GLY A 41 5.648 7.286 -13.306 1.00 24.42 O ATOM 0 H GLY A 41 8.727 8.230 -10.835 1.00 64.00 H new ATOM 0 HA2 GLY A 41 7.588 9.016 -12.678 1.00 33.41 H new ATOM 0 HA3 GLY A 41 8.310 7.786 -13.696 1.00 33.41 H new ATOM 614 N LYS A 42 6.640 6.185 -11.614 1.00 32.40 N ATOM 615 CA LYS A 42 5.488 5.354 -11.352 1.00 2.42 C ATOM 616 C LYS A 42 5.059 5.363 -9.902 1.00 32.03 C ATOM 617 O LYS A 42 5.745 5.931 -9.039 1.00 53.22 O ATOM 618 CB LYS A 42 5.624 3.945 -11.895 1.00 51.43 C ATOM 619 CG LYS A 42 5.621 3.921 -13.409 1.00 72.34 C ATOM 620 CD LYS A 42 5.487 2.531 -13.929 1.00 34.34 C ATOM 621 CE LYS A 42 5.532 2.511 -15.445 1.00 51.10 C ATOM 622 NZ LYS A 42 5.321 1.157 -15.985 1.00 51.13 N ATOM 0 H LYS A 42 7.442 5.996 -11.013 1.00 32.40 H new ATOM 0 HA LYS A 42 4.679 5.821 -11.914 1.00 2.42 H new ATOM 0 HB2 LYS A 42 6.549 3.502 -11.527 1.00 51.43 H new ATOM 0 HB3 LYS A 42 4.805 3.331 -11.520 1.00 51.43 H new ATOM 0 HG2 LYS A 42 4.799 4.532 -13.783 1.00 72.34 H new ATOM 0 HG3 LYS A 42 6.544 4.364 -13.784 1.00 72.34 H new ATOM 0 HD2 LYS A 42 6.289 1.911 -13.530 1.00 34.34 H new ATOM 0 HD3 LYS A 42 4.548 2.099 -13.584 1.00 34.34 H new ATOM 0 HE2 LYS A 42 4.769 3.182 -15.839 1.00 51.10 H new ATOM 0 HE3 LYS A 42 6.496 2.891 -15.784 1.00 51.10 H new ATOM 0 HZ1 LYS A 42 5.359 1.188 -17.024 1.00 51.13 H new ATOM 0 HZ2 LYS A 42 6.064 0.522 -15.630 1.00 51.13 H new ATOM 0 HZ3 LYS A 42 4.390 0.804 -15.683 1.00 51.13 H new ATOM 636 N ALA A 43 3.911 4.779 -9.647 1.00 33.32 N ATOM 637 CA ALA A 43 3.352 4.687 -8.309 1.00 0.22 C ATOM 638 C ALA A 43 3.942 3.451 -7.600 1.00 23.22 C ATOM 639 O ALA A 43 4.545 2.600 -8.264 1.00 13.53 O ATOM 640 CB ALA A 43 1.822 4.590 -8.412 1.00 63.44 C ATOM 0 H ALA A 43 3.330 4.349 -10.366 1.00 33.32 H new ATOM 0 HA ALA A 43 3.604 5.572 -7.725 1.00 0.22 H new ATOM 0 HB1 ALA A 43 1.394 4.521 -7.412 1.00 63.44 H new ATOM 0 HB2 ALA A 43 1.434 5.477 -8.912 1.00 63.44 H new ATOM 0 HB3 ALA A 43 1.551 3.703 -8.985 1.00 63.44 H new ATOM 646 N PRO A 44 3.818 3.332 -6.247 1.00 34.51 N ATOM 647 CA PRO A 44 4.335 2.167 -5.539 1.00 55.50 C ATOM 648 C PRO A 44 3.536 0.907 -5.905 1.00 12.32 C ATOM 649 O PRO A 44 2.339 0.803 -5.639 1.00 2.11 O ATOM 650 CB PRO A 44 4.170 2.547 -4.044 1.00 0.41 C ATOM 651 CG PRO A 44 3.061 3.535 -4.038 1.00 34.12 C ATOM 652 CD PRO A 44 3.187 4.303 -5.325 1.00 23.05 C ATOM 0 HA PRO A 44 5.369 1.931 -5.792 1.00 55.50 H new ATOM 0 HB2 PRO A 44 3.929 1.675 -3.436 1.00 0.41 H new ATOM 0 HB3 PRO A 44 5.087 2.975 -3.639 1.00 0.41 H new ATOM 0 HG2 PRO A 44 2.094 3.036 -3.974 1.00 34.12 H new ATOM 0 HG3 PRO A 44 3.135 4.200 -3.177 1.00 34.12 H new ATOM 0 HD2 PRO A 44 2.215 4.632 -5.693 1.00 23.05 H new ATOM 0 HD3 PRO A 44 3.800 5.196 -5.201 1.00 23.05 H new ATOM 660 N LYS A 45 4.210 -0.029 -6.515 1.00 53.03 N ATOM 661 CA LYS A 45 3.598 -1.232 -6.993 1.00 52.21 C ATOM 662 C LYS A 45 3.933 -2.401 -6.092 1.00 43.31 C ATOM 663 O LYS A 45 5.066 -2.567 -5.674 1.00 71.01 O ATOM 664 CB LYS A 45 4.024 -1.507 -8.439 1.00 23.50 C ATOM 665 CG LYS A 45 3.385 -2.743 -9.032 1.00 14.04 C ATOM 666 CD LYS A 45 3.742 -2.921 -10.490 1.00 13.21 C ATOM 667 CE LYS A 45 3.052 -4.141 -11.063 1.00 53.00 C ATOM 668 NZ LYS A 45 1.583 -4.056 -10.907 1.00 4.14 N ATOM 0 H LYS A 45 5.213 0.026 -6.695 1.00 53.03 H new ATOM 0 HA LYS A 45 2.516 -1.102 -6.976 1.00 52.21 H new ATOM 0 HB2 LYS A 45 3.769 -0.645 -9.055 1.00 23.50 H new ATOM 0 HB3 LYS A 45 5.108 -1.615 -8.476 1.00 23.50 H new ATOM 0 HG2 LYS A 45 3.704 -3.621 -8.471 1.00 14.04 H new ATOM 0 HG3 LYS A 45 2.302 -2.676 -8.930 1.00 14.04 H new ATOM 0 HD2 LYS A 45 3.450 -2.034 -11.052 1.00 13.21 H new ATOM 0 HD3 LYS A 45 4.822 -3.024 -10.595 1.00 13.21 H new ATOM 0 HE2 LYS A 45 3.302 -4.239 -12.119 1.00 53.00 H new ATOM 0 HE3 LYS A 45 3.421 -5.037 -10.564 1.00 53.00 H new ATOM 0 HZ1 LYS A 45 1.124 -4.702 -11.581 1.00 4.14 H new ATOM 0 HZ2 LYS A 45 1.321 -4.324 -9.937 1.00 4.14 H new ATOM 0 HZ3 LYS A 45 1.270 -3.082 -11.093 1.00 4.14 H new ATOM 682 N LEU A 46 2.942 -3.180 -5.793 1.00 15.20 N ATOM 683 CA LEU A 46 3.052 -4.312 -4.920 1.00 31.31 C ATOM 684 C LEU A 46 3.559 -5.542 -5.640 1.00 72.15 C ATOM 685 O LEU A 46 3.104 -5.879 -6.734 1.00 54.02 O ATOM 686 CB LEU A 46 1.694 -4.540 -4.308 1.00 14.32 C ATOM 687 CG LEU A 46 1.445 -5.751 -3.475 1.00 71.34 C ATOM 688 CD1 LEU A 46 2.132 -5.582 -2.176 1.00 52.21 C ATOM 689 CD2 LEU A 46 -0.043 -5.957 -3.282 1.00 31.52 C ATOM 0 H LEU A 46 2.001 -3.043 -6.161 1.00 15.20 H new ATOM 0 HA LEU A 46 3.789 -4.112 -4.142 1.00 31.31 H new ATOM 0 HB2 LEU A 46 1.466 -3.670 -3.692 1.00 14.32 H new ATOM 0 HB3 LEU A 46 0.970 -4.552 -5.122 1.00 14.32 H new ATOM 0 HG LEU A 46 1.838 -6.636 -3.975 1.00 71.34 H new ATOM 0 HD11 LEU A 46 1.958 -6.461 -1.556 1.00 52.21 H new ATOM 0 HD12 LEU A 46 3.202 -5.462 -2.343 1.00 52.21 H new ATOM 0 HD13 LEU A 46 1.742 -4.698 -1.670 1.00 52.21 H new ATOM 0 HD21 LEU A 46 -0.211 -6.845 -2.672 1.00 31.52 H new ATOM 0 HD22 LEU A 46 -0.469 -5.087 -2.782 1.00 31.52 H new ATOM 0 HD23 LEU A 46 -0.521 -6.088 -4.253 1.00 31.52 H new ATOM 701 N LEU A 47 4.508 -6.188 -5.015 1.00 50.23 N ATOM 702 CA LEU A 47 5.113 -7.388 -5.535 1.00 22.01 C ATOM 703 C LEU A 47 4.591 -8.571 -4.786 1.00 53.02 C ATOM 704 O LEU A 47 4.322 -9.611 -5.358 1.00 40.42 O ATOM 705 CB LEU A 47 6.653 -7.375 -5.357 1.00 3.13 C ATOM 706 CG LEU A 47 7.444 -6.219 -5.965 1.00 32.44 C ATOM 707 CD1 LEU A 47 7.145 -6.020 -7.439 1.00 40.32 C ATOM 708 CD2 LEU A 47 7.271 -4.959 -5.174 1.00 55.50 C ATOM 0 H LEU A 47 4.889 -5.891 -4.116 1.00 50.23 H new ATOM 0 HA LEU A 47 4.870 -7.442 -6.596 1.00 22.01 H new ATOM 0 HB2 LEU A 47 6.864 -7.396 -4.288 1.00 3.13 H new ATOM 0 HB3 LEU A 47 7.044 -8.302 -5.777 1.00 3.13 H new ATOM 0 HG LEU A 47 8.498 -6.492 -5.908 1.00 32.44 H new ATOM 0 HD11 LEU A 47 7.734 -5.186 -7.820 1.00 40.32 H new ATOM 0 HD12 LEU A 47 7.401 -6.926 -7.988 1.00 40.32 H new ATOM 0 HD13 LEU A 47 6.084 -5.805 -7.569 1.00 40.32 H new ATOM 0 HD21 LEU A 47 7.848 -4.158 -5.636 1.00 55.50 H new ATOM 0 HD22 LEU A 47 6.217 -4.683 -5.155 1.00 55.50 H new ATOM 0 HD23 LEU A 47 7.622 -5.118 -4.155 1.00 55.50 H new ATOM 720 N ILE A 48 4.438 -8.404 -3.490 1.00 21.03 N ATOM 721 CA ILE A 48 4.100 -9.518 -2.623 1.00 62.23 C ATOM 722 C ILE A 48 3.068 -9.075 -1.622 1.00 61.05 C ATOM 723 O ILE A 48 3.203 -8.022 -1.063 1.00 1.54 O ATOM 724 CB ILE A 48 5.374 -9.992 -1.860 1.00 64.13 C ATOM 725 CG1 ILE A 48 6.464 -10.441 -2.850 1.00 43.02 C ATOM 726 CG2 ILE A 48 5.050 -11.094 -0.871 1.00 72.55 C ATOM 727 CD1 ILE A 48 7.738 -10.915 -2.211 1.00 63.14 C ATOM 0 H ILE A 48 4.542 -7.509 -3.011 1.00 21.03 H new ATOM 0 HA ILE A 48 3.707 -10.337 -3.225 1.00 62.23 H new ATOM 0 HB ILE A 48 5.757 -9.145 -1.291 1.00 64.13 H new ATOM 0 HG12 ILE A 48 6.064 -11.244 -3.470 1.00 43.02 H new ATOM 0 HG13 ILE A 48 6.695 -9.610 -3.516 1.00 43.02 H new ATOM 0 HG21 ILE A 48 5.961 -11.401 -0.357 1.00 72.55 H new ATOM 0 HG22 ILE A 48 4.327 -10.728 -0.142 1.00 72.55 H new ATOM 0 HG23 ILE A 48 4.628 -11.947 -1.402 1.00 72.55 H new ATOM 0 HD11 ILE A 48 8.446 -11.210 -2.986 1.00 63.14 H new ATOM 0 HD12 ILE A 48 8.168 -10.110 -1.615 1.00 63.14 H new ATOM 0 HD13 ILE A 48 7.527 -11.769 -1.568 1.00 63.14 H new ATOM 739 N TYR A 49 2.091 -9.905 -1.345 1.00 32.33 N ATOM 740 CA TYR A 49 1.013 -9.513 -0.434 1.00 3.30 C ATOM 741 C TYR A 49 0.894 -10.422 0.780 1.00 10.33 C ATOM 742 O TYR A 49 0.088 -10.176 1.664 1.00 12.43 O ATOM 743 CB TYR A 49 -0.332 -9.413 -1.166 1.00 62.40 C ATOM 744 CG TYR A 49 -0.730 -10.668 -1.896 1.00 24.24 C ATOM 745 CD1 TYR A 49 -1.179 -11.783 -1.210 1.00 63.13 C ATOM 746 CD2 TYR A 49 -0.640 -10.739 -3.268 1.00 3.04 C ATOM 747 CE1 TYR A 49 -1.527 -12.925 -1.868 1.00 22.41 C ATOM 748 CE2 TYR A 49 -0.988 -11.878 -3.938 1.00 62.21 C ATOM 749 CZ TYR A 49 -1.430 -12.975 -3.233 1.00 74.32 C ATOM 750 OH TYR A 49 -1.785 -14.125 -3.896 1.00 33.02 O ATOM 0 H TYR A 49 2.009 -10.848 -1.726 1.00 32.33 H new ATOM 0 HA TYR A 49 1.283 -8.525 -0.062 1.00 3.30 H new ATOM 0 HB2 TYR A 49 -1.109 -9.164 -0.443 1.00 62.40 H new ATOM 0 HB3 TYR A 49 -0.285 -8.590 -1.879 1.00 62.40 H new ATOM 0 HD1 TYR A 49 -1.255 -11.748 -0.133 1.00 63.13 H new ATOM 0 HD2 TYR A 49 -0.289 -9.882 -3.823 1.00 3.04 H new ATOM 0 HE1 TYR A 49 -1.877 -13.785 -1.316 1.00 22.41 H new ATOM 0 HE2 TYR A 49 -0.917 -11.918 -5.015 1.00 62.21 H new ATOM 0 HH TYR A 49 -1.660 -13.999 -4.860 1.00 33.02 H new ATOM 760 N ASP A 50 1.657 -11.469 0.819 1.00 2.32 N ATOM 761 CA ASP A 50 1.619 -12.350 1.972 1.00 44.53 C ATOM 762 C ASP A 50 2.965 -12.951 2.164 1.00 73.55 C ATOM 763 O ASP A 50 3.192 -14.098 1.767 1.00 32.30 O ATOM 764 CB ASP A 50 0.553 -13.458 1.832 1.00 20.54 C ATOM 765 CG ASP A 50 0.379 -14.306 3.088 1.00 3.03 C ATOM 766 OD1 ASP A 50 1.125 -15.307 3.260 1.00 15.04 O ATOM 767 OD2 ASP A 50 -0.525 -13.998 3.890 1.00 21.13 O ATOM 0 H ASP A 50 2.309 -11.743 0.084 1.00 2.32 H new ATOM 0 HA ASP A 50 1.341 -11.757 2.843 1.00 44.53 H new ATOM 0 HB2 ASP A 50 -0.403 -13.000 1.579 1.00 20.54 H new ATOM 0 HB3 ASP A 50 0.825 -14.108 1.001 1.00 20.54 H new ATOM 772 N ALA A 51 3.892 -12.106 2.643 1.00 44.34 N ATOM 773 CA ALA A 51 5.300 -12.454 2.963 1.00 20.14 C ATOM 774 C ALA A 51 6.108 -12.947 1.749 1.00 44.10 C ATOM 775 O ALA A 51 7.111 -12.350 1.375 1.00 52.54 O ATOM 776 CB ALA A 51 5.377 -13.450 4.113 1.00 71.24 C ATOM 0 H ALA A 51 3.682 -11.125 2.827 1.00 44.34 H new ATOM 0 HA ALA A 51 5.769 -11.522 3.277 1.00 20.14 H new ATOM 0 HB1 ALA A 51 6.421 -13.684 4.322 1.00 71.24 H new ATOM 0 HB2 ALA A 51 4.917 -13.017 5.001 1.00 71.24 H new ATOM 0 HB3 ALA A 51 4.848 -14.363 3.840 1.00 71.24 H new ATOM 782 N SER A 52 5.659 -14.021 1.167 1.00 70.01 N ATOM 783 CA SER A 52 6.300 -14.658 0.058 1.00 53.02 C ATOM 784 C SER A 52 5.390 -14.717 -1.190 1.00 13.51 C ATOM 785 O SER A 52 5.876 -14.901 -2.299 1.00 63.03 O ATOM 786 CB SER A 52 6.646 -16.054 0.489 1.00 51.22 C ATOM 787 OG SER A 52 5.484 -16.712 0.975 1.00 41.23 O ATOM 0 H SER A 52 4.805 -14.493 1.464 1.00 70.01 H new ATOM 0 HA SER A 52 7.184 -14.085 -0.221 1.00 53.02 H new ATOM 0 HB2 SER A 52 7.065 -16.610 -0.350 1.00 51.22 H new ATOM 0 HB3 SER A 52 7.410 -16.025 1.266 1.00 51.22 H new ATOM 0 HG SER A 52 5.716 -17.623 1.253 1.00 41.23 H new ATOM 793 N ASN A 53 4.077 -14.572 -0.998 1.00 1.10 N ATOM 794 CA ASN A 53 3.119 -14.713 -2.108 1.00 62.32 C ATOM 795 C ASN A 53 3.092 -13.490 -2.996 1.00 11.24 C ATOM 796 O ASN A 53 2.733 -12.390 -2.548 1.00 70.33 O ATOM 797 CB ASN A 53 1.702 -15.019 -1.604 1.00 3.43 C ATOM 798 CG ASN A 53 1.592 -16.330 -0.842 1.00 62.32 C ATOM 799 OD1 ASN A 53 1.726 -16.278 0.457 1.00 5.31 O flip ATOM 800 ND2 ASN A 53 1.365 -17.389 -1.429 1.00 22.04 N flip ATOM 0 H ASN A 53 3.651 -14.359 -0.096 1.00 1.10 H new ATOM 0 HA ASN A 53 3.468 -15.559 -2.701 1.00 62.32 H new ATOM 0 HB2 ASN A 53 1.372 -14.205 -0.958 1.00 3.43 H new ATOM 0 HB3 ASN A 53 1.022 -15.046 -2.455 1.00 3.43 H new ATOM 0 HD21 ASN A 53 1.265 -17.398 -2.444 1.00 22.04 H new ATOM 0 HD22 ASN A 53 1.277 -18.257 -0.900 1.00 22.04 H new ATOM 807 N LEU A 54 3.445 -13.687 -4.253 1.00 45.41 N ATOM 808 CA LEU A 54 3.510 -12.616 -5.240 1.00 3.21 C ATOM 809 C LEU A 54 2.155 -12.211 -5.760 1.00 73.11 C ATOM 810 O LEU A 54 1.223 -13.013 -5.831 1.00 1.41 O ATOM 811 CB LEU A 54 4.431 -12.926 -6.436 1.00 61.14 C ATOM 812 CG LEU A 54 5.937 -12.977 -6.194 1.00 51.34 C ATOM 813 CD1 LEU A 54 6.357 -14.153 -5.341 1.00 34.43 C ATOM 814 CD2 LEU A 54 6.672 -12.971 -7.510 1.00 61.30 C ATOM 0 H LEU A 54 3.698 -14.603 -4.625 1.00 45.41 H new ATOM 0 HA LEU A 54 3.942 -11.783 -4.685 1.00 3.21 H new ATOM 0 HB2 LEU A 54 4.128 -13.888 -6.849 1.00 61.14 H new ATOM 0 HB3 LEU A 54 4.243 -12.176 -7.204 1.00 61.14 H new ATOM 0 HG LEU A 54 6.204 -12.084 -5.630 1.00 51.34 H new ATOM 0 HD11 LEU A 54 7.438 -14.135 -5.204 1.00 34.43 H new ATOM 0 HD12 LEU A 54 5.867 -14.091 -4.369 1.00 34.43 H new ATOM 0 HD13 LEU A 54 6.069 -15.081 -5.834 1.00 34.43 H new ATOM 0 HD21 LEU A 54 7.746 -13.008 -7.327 1.00 61.30 H new ATOM 0 HD22 LEU A 54 6.374 -13.840 -8.097 1.00 61.30 H new ATOM 0 HD23 LEU A 54 6.428 -12.061 -8.059 1.00 61.30 H new ATOM 826 N GLU A 55 2.062 -10.954 -6.106 1.00 13.51 N ATOM 827 CA GLU A 55 0.871 -10.354 -6.667 1.00 14.30 C ATOM 828 C GLU A 55 0.820 -10.755 -8.175 1.00 43.13 C ATOM 829 O GLU A 55 1.854 -11.149 -8.756 1.00 41.32 O ATOM 830 CB GLU A 55 0.988 -8.822 -6.451 1.00 54.52 C ATOM 831 CG GLU A 55 -0.320 -8.014 -6.339 1.00 33.33 C ATOM 832 CD GLU A 55 -1.136 -7.921 -7.591 1.00 31.31 C ATOM 833 OE1 GLU A 55 -1.993 -8.804 -7.820 1.00 34.53 O ATOM 834 OE2 GLU A 55 -0.954 -6.944 -8.348 1.00 21.40 O ATOM 0 H GLU A 55 2.834 -10.296 -6.004 1.00 13.51 H new ATOM 0 HA GLU A 55 -0.054 -10.691 -6.198 1.00 14.30 H new ATOM 0 HB2 GLU A 55 1.565 -8.654 -5.542 1.00 54.52 H new ATOM 0 HB3 GLU A 55 1.568 -8.410 -7.277 1.00 54.52 H new ATOM 0 HG2 GLU A 55 -0.936 -8.461 -5.559 1.00 33.33 H new ATOM 0 HG3 GLU A 55 -0.074 -7.004 -6.012 1.00 33.33 H new ATOM 841 N THR A 56 -0.339 -10.689 -8.777 1.00 10.21 N ATOM 842 CA THR A 56 -0.542 -11.129 -10.142 1.00 64.32 C ATOM 843 C THR A 56 0.182 -10.222 -11.162 1.00 3.10 C ATOM 844 O THR A 56 -0.071 -9.026 -11.232 1.00 33.35 O ATOM 845 CB THR A 56 -2.052 -11.179 -10.445 1.00 44.42 C ATOM 846 OG1 THR A 56 -2.691 -12.032 -9.470 1.00 71.45 O ATOM 847 CG2 THR A 56 -2.313 -11.737 -11.837 1.00 0.04 C ATOM 0 H THR A 56 -1.181 -10.325 -8.332 1.00 10.21 H new ATOM 0 HA THR A 56 -0.111 -12.125 -10.241 1.00 64.32 H new ATOM 0 HB THR A 56 -2.453 -10.166 -10.398 1.00 44.42 H new ATOM 0 HG1 THR A 56 -3.653 -12.071 -9.650 1.00 71.45 H new ATOM 0 HG21 THR A 56 -3.387 -11.761 -12.024 1.00 0.04 H new ATOM 0 HG22 THR A 56 -1.829 -11.103 -12.580 1.00 0.04 H new ATOM 0 HG23 THR A 56 -1.910 -12.748 -11.905 1.00 0.04 H new ATOM 855 N GLY A 57 1.071 -10.807 -11.947 1.00 24.04 N ATOM 856 CA GLY A 57 1.798 -10.047 -12.949 1.00 63.13 C ATOM 857 C GLY A 57 3.192 -9.666 -12.491 1.00 13.14 C ATOM 858 O GLY A 57 3.948 -9.019 -13.228 1.00 44.11 O ATOM 0 H GLY A 57 1.305 -11.799 -11.911 1.00 24.04 H new ATOM 0 HA2 GLY A 57 1.868 -10.633 -13.865 1.00 63.13 H new ATOM 0 HA3 GLY A 57 1.239 -9.143 -13.191 1.00 63.13 H new ATOM 862 N VAL A 58 3.528 -10.045 -11.278 1.00 0.11 N ATOM 863 CA VAL A 58 4.835 -9.778 -10.718 1.00 30.51 C ATOM 864 C VAL A 58 5.795 -10.915 -11.075 1.00 1.31 C ATOM 865 O VAL A 58 5.477 -12.082 -10.855 1.00 14.31 O ATOM 866 CB VAL A 58 4.747 -9.625 -9.181 1.00 25.33 C ATOM 867 CG1 VAL A 58 6.118 -9.376 -8.572 1.00 25.01 C ATOM 868 CG2 VAL A 58 3.798 -8.490 -8.830 1.00 2.55 C ATOM 0 H VAL A 58 2.901 -10.548 -10.650 1.00 0.11 H new ATOM 0 HA VAL A 58 5.210 -8.845 -11.138 1.00 30.51 H new ATOM 0 HB VAL A 58 4.363 -10.557 -8.765 1.00 25.33 H new ATOM 0 HG11 VAL A 58 6.023 -9.273 -7.491 1.00 25.01 H new ATOM 0 HG12 VAL A 58 6.775 -10.215 -8.800 1.00 25.01 H new ATOM 0 HG13 VAL A 58 6.540 -8.461 -8.988 1.00 25.01 H new ATOM 0 HG21 VAL A 58 3.740 -8.386 -7.747 1.00 2.55 H new ATOM 0 HG22 VAL A 58 4.166 -7.560 -9.264 1.00 2.55 H new ATOM 0 HG23 VAL A 58 2.807 -8.708 -9.228 1.00 2.55 H new ATOM 878 N PRO A 59 6.968 -10.590 -11.655 1.00 11.14 N ATOM 879 CA PRO A 59 7.954 -11.592 -12.065 1.00 72.03 C ATOM 880 C PRO A 59 8.505 -12.424 -10.908 1.00 41.11 C ATOM 881 O PRO A 59 8.665 -11.935 -9.784 1.00 1.12 O ATOM 882 CB PRO A 59 9.088 -10.780 -12.689 1.00 72.42 C ATOM 883 CG PRO A 59 8.879 -9.383 -12.234 1.00 22.32 C ATOM 884 CD PRO A 59 7.415 -9.223 -11.967 1.00 55.12 C ATOM 0 HA PRO A 59 7.493 -12.313 -12.740 1.00 72.03 H new ATOM 0 HB2 PRO A 59 10.060 -11.155 -12.369 1.00 72.42 H new ATOM 0 HB3 PRO A 59 9.064 -10.845 -13.777 1.00 72.42 H new ATOM 0 HG2 PRO A 59 9.459 -9.180 -11.334 1.00 22.32 H new ATOM 0 HG3 PRO A 59 9.212 -8.676 -12.994 1.00 22.32 H new ATOM 0 HD2 PRO A 59 7.231 -8.542 -11.136 1.00 55.12 H new ATOM 0 HD3 PRO A 59 6.892 -8.818 -12.833 1.00 55.12 H new ATOM 892 N SER A 60 8.844 -13.662 -11.226 1.00 65.25 N ATOM 893 CA SER A 60 9.387 -14.656 -10.298 1.00 24.21 C ATOM 894 C SER A 60 10.749 -14.232 -9.693 1.00 61.02 C ATOM 895 O SER A 60 11.296 -14.923 -8.819 1.00 22.43 O ATOM 896 CB SER A 60 9.531 -15.976 -11.030 1.00 31.51 C ATOM 897 OG SER A 60 8.300 -16.336 -11.651 1.00 35.30 O ATOM 0 H SER A 60 8.747 -14.023 -12.175 1.00 65.25 H new ATOM 0 HA SER A 60 8.693 -14.750 -9.463 1.00 24.21 H new ATOM 0 HB2 SER A 60 10.316 -15.898 -11.782 1.00 31.51 H new ATOM 0 HB3 SER A 60 9.835 -16.755 -10.331 1.00 31.51 H new ATOM 0 HG SER A 60 8.408 -17.189 -12.121 1.00 35.30 H new ATOM 903 N ARG A 61 11.289 -13.096 -10.160 1.00 54.33 N ATOM 904 CA ARG A 61 12.563 -12.582 -9.664 1.00 64.32 C ATOM 905 C ARG A 61 12.394 -12.133 -8.226 1.00 23.41 C ATOM 906 O ARG A 61 13.365 -12.006 -7.495 1.00 25.31 O ATOM 907 CB ARG A 61 13.022 -11.357 -10.490 1.00 1.41 C ATOM 908 CG ARG A 61 13.113 -11.603 -11.981 1.00 63.42 C ATOM 909 CD ARG A 61 13.719 -10.418 -12.734 1.00 3.24 C ATOM 910 NE ARG A 61 13.001 -9.153 -12.569 1.00 0.23 N ATOM 911 CZ ARG A 61 12.235 -8.582 -13.506 1.00 64.01 C ATOM 912 NH1 ARG A 61 11.959 -9.229 -14.633 1.00 23.01 N ATOM 913 NH2 ARG A 61 11.757 -7.372 -13.312 1.00 72.53 N ATOM 0 H ARG A 61 10.858 -12.519 -10.882 1.00 54.33 H new ATOM 0 HA ARG A 61 13.305 -13.377 -9.745 1.00 64.32 H new ATOM 0 HB2 ARG A 61 12.329 -10.535 -10.312 1.00 1.41 H new ATOM 0 HB3 ARG A 61 13.998 -11.035 -10.127 1.00 1.41 H new ATOM 0 HG2 ARG A 61 13.717 -12.492 -12.163 1.00 63.42 H new ATOM 0 HG3 ARG A 61 12.117 -11.808 -12.374 1.00 63.42 H new ATOM 0 HD2 ARG A 61 14.748 -10.282 -12.401 1.00 3.24 H new ATOM 0 HD3 ARG A 61 13.758 -10.662 -13.796 1.00 3.24 H new ATOM 0 HE ARG A 61 13.091 -8.672 -11.674 1.00 0.23 H new ATOM 0 HH11 ARG A 61 12.331 -10.166 -14.788 1.00 23.01 H new ATOM 0 HH12 ARG A 61 11.375 -8.789 -15.344 1.00 23.01 H new ATOM 0 HH21 ARG A 61 11.971 -6.872 -12.449 1.00 72.53 H new ATOM 0 HH22 ARG A 61 11.173 -6.934 -14.024 1.00 72.53 H new ATOM 927 N PHE A 62 11.155 -11.916 -7.831 1.00 74.34 N ATOM 928 CA PHE A 62 10.851 -11.476 -6.489 1.00 0.25 C ATOM 929 C PHE A 62 10.317 -12.617 -5.642 1.00 61.40 C ATOM 930 O PHE A 62 9.634 -13.514 -6.149 1.00 22.32 O ATOM 931 CB PHE A 62 9.837 -10.335 -6.528 1.00 54.21 C ATOM 932 CG PHE A 62 10.325 -9.158 -7.299 1.00 11.24 C ATOM 933 CD1 PHE A 62 11.134 -8.225 -6.701 1.00 34.14 C ATOM 934 CD2 PHE A 62 9.984 -8.990 -8.629 1.00 30.24 C ATOM 935 CE1 PHE A 62 11.599 -7.147 -7.406 1.00 34.22 C ATOM 936 CE2 PHE A 62 10.448 -7.908 -9.337 1.00 43.43 C ATOM 937 CZ PHE A 62 11.255 -6.989 -8.724 1.00 14.31 C ATOM 0 H PHE A 62 10.338 -12.039 -8.429 1.00 74.34 H new ATOM 0 HA PHE A 62 11.776 -11.121 -6.034 1.00 0.25 H new ATOM 0 HB2 PHE A 62 8.908 -10.695 -6.971 1.00 54.21 H new ATOM 0 HB3 PHE A 62 9.605 -10.026 -5.509 1.00 54.21 H new ATOM 0 HD1 PHE A 62 11.407 -8.342 -5.663 1.00 34.14 H new ATOM 0 HD2 PHE A 62 9.348 -9.715 -9.115 1.00 30.24 H new ATOM 0 HE1 PHE A 62 12.237 -6.421 -6.924 1.00 34.22 H new ATOM 0 HE2 PHE A 62 10.176 -7.783 -10.375 1.00 43.43 H new ATOM 0 HZ PHE A 62 11.622 -6.138 -9.279 1.00 14.31 H new ATOM 947 N SER A 63 10.663 -12.595 -4.370 1.00 53.20 N ATOM 948 CA SER A 63 10.173 -13.542 -3.402 1.00 44.21 C ATOM 949 C SER A 63 10.564 -13.055 -2.004 1.00 14.15 C ATOM 950 O SER A 63 11.517 -12.277 -1.856 1.00 0.23 O ATOM 951 CB SER A 63 10.752 -14.948 -3.669 1.00 73.31 C ATOM 952 OG SER A 63 10.200 -15.914 -2.783 1.00 50.14 O ATOM 0 H SER A 63 11.304 -11.905 -3.979 1.00 53.20 H new ATOM 0 HA SER A 63 9.088 -13.615 -3.478 1.00 44.21 H new ATOM 0 HB2 SER A 63 10.547 -15.238 -4.699 1.00 73.31 H new ATOM 0 HB3 SER A 63 11.836 -14.925 -3.555 1.00 73.31 H new ATOM 0 HG SER A 63 10.585 -16.794 -2.978 1.00 50.14 H new ATOM 958 N GLY A 64 9.816 -13.456 -1.003 1.00 50.22 N ATOM 959 CA GLY A 64 10.139 -13.106 0.345 1.00 71.44 C ATOM 960 C GLY A 64 10.110 -14.315 1.250 1.00 52.30 C ATOM 961 O GLY A 64 9.609 -15.366 0.871 1.00 41.22 O ATOM 0 H GLY A 64 8.977 -14.027 -1.106 1.00 50.22 H new ATOM 0 HA2 GLY A 64 11.128 -12.649 0.377 1.00 71.44 H new ATOM 0 HA3 GLY A 64 9.432 -12.360 0.708 1.00 71.44 H new ATOM 965 N SER A 65 10.685 -14.181 2.403 1.00 71.01 N ATOM 966 CA SER A 65 10.714 -15.216 3.405 1.00 72.23 C ATOM 967 C SER A 65 10.621 -14.568 4.783 1.00 10.14 C ATOM 968 O SER A 65 10.807 -13.352 4.905 1.00 30.04 O ATOM 969 CB SER A 65 12.018 -16.009 3.290 1.00 65.22 C ATOM 970 OG SER A 65 12.147 -16.594 1.997 1.00 22.31 O ATOM 0 H SER A 65 11.163 -13.326 2.688 1.00 71.01 H new ATOM 0 HA SER A 65 9.875 -15.896 3.261 1.00 72.23 H new ATOM 0 HB2 SER A 65 12.866 -15.351 3.482 1.00 65.22 H new ATOM 0 HB3 SER A 65 12.041 -16.790 4.050 1.00 65.22 H new ATOM 0 HG SER A 65 12.988 -17.094 1.947 1.00 22.31 H new ATOM 976 N GLY A 66 10.318 -15.345 5.798 1.00 4.41 N ATOM 977 CA GLY A 66 10.279 -14.811 7.138 1.00 12.33 C ATOM 978 C GLY A 66 8.979 -15.095 7.824 1.00 0.21 C ATOM 979 O GLY A 66 8.079 -15.696 7.222 1.00 64.41 O ATOM 0 H GLY A 66 10.097 -16.338 5.722 1.00 4.41 H new ATOM 0 HA2 GLY A 66 11.096 -15.237 7.721 1.00 12.33 H new ATOM 0 HA3 GLY A 66 10.441 -13.734 7.103 1.00 12.33 H new ATOM 983 N SER A 67 8.871 -14.671 9.074 1.00 13.04 N ATOM 984 CA SER A 67 7.676 -14.866 9.863 1.00 61.15 C ATOM 985 C SER A 67 7.783 -14.154 11.204 1.00 4.44 C ATOM 986 O SER A 67 8.859 -14.122 11.829 1.00 0.53 O ATOM 987 CB SER A 67 7.404 -16.364 10.076 1.00 33.15 C ATOM 988 OG SER A 67 8.533 -17.019 10.666 1.00 34.42 O ATOM 0 H SER A 67 9.617 -14.180 9.567 1.00 13.04 H new ATOM 0 HA SER A 67 6.840 -14.434 9.313 1.00 61.15 H new ATOM 0 HB2 SER A 67 6.532 -16.490 10.717 1.00 33.15 H new ATOM 0 HB3 SER A 67 7.167 -16.832 9.121 1.00 33.15 H new ATOM 0 HG SER A 67 8.331 -17.970 10.791 1.00 34.42 H new ATOM 994 N GLY A 68 6.698 -13.567 11.623 1.00 51.05 N ATOM 995 CA GLY A 68 6.633 -12.948 12.915 1.00 51.11 C ATOM 996 C GLY A 68 7.130 -11.540 12.907 1.00 13.10 C ATOM 997 O GLY A 68 6.371 -10.613 12.604 1.00 50.34 O ATOM 0 H GLY A 68 5.837 -13.504 11.080 1.00 51.05 H new ATOM 0 HA2 GLY A 68 5.602 -12.963 13.269 1.00 51.11 H new ATOM 0 HA3 GLY A 68 7.221 -13.532 13.623 1.00 51.11 H new ATOM 1001 N THR A 69 8.383 -11.371 13.245 1.00 43.35 N ATOM 1002 CA THR A 69 8.990 -10.064 13.308 1.00 33.43 C ATOM 1003 C THR A 69 10.123 -9.893 12.285 1.00 25.25 C ATOM 1004 O THR A 69 10.508 -8.773 11.974 1.00 70.15 O ATOM 1005 CB THR A 69 9.527 -9.760 14.734 1.00 23.12 C ATOM 1006 OG1 THR A 69 10.461 -10.783 15.139 1.00 71.31 O ATOM 1007 CG2 THR A 69 8.387 -9.686 15.748 1.00 33.44 C ATOM 0 H THR A 69 9.013 -12.137 13.485 1.00 43.35 H new ATOM 0 HA THR A 69 8.203 -9.352 13.061 1.00 33.43 H new ATOM 0 HB THR A 69 10.029 -8.793 14.704 1.00 23.12 H new ATOM 0 HG1 THR A 69 10.796 -10.583 16.038 1.00 71.31 H new ATOM 0 HG21 THR A 69 8.793 -9.472 16.737 1.00 33.44 H new ATOM 0 HG22 THR A 69 7.695 -8.894 15.461 1.00 33.44 H new ATOM 0 HG23 THR A 69 7.858 -10.639 15.771 1.00 33.44 H new ATOM 1015 N ASP A 70 10.654 -10.991 11.754 1.00 53.14 N ATOM 1016 CA ASP A 70 11.775 -10.874 10.810 1.00 32.30 C ATOM 1017 C ASP A 70 11.350 -11.339 9.443 1.00 22.34 C ATOM 1018 O ASP A 70 10.730 -12.407 9.310 1.00 20.00 O ATOM 1019 CB ASP A 70 12.954 -11.721 11.283 1.00 62.51 C ATOM 1020 CG ASP A 70 14.192 -11.555 10.417 1.00 72.22 C ATOM 1021 OD1 ASP A 70 14.321 -12.266 9.389 1.00 5.04 O ATOM 1022 OD2 ASP A 70 15.067 -10.725 10.777 1.00 44.12 O ATOM 0 H ASP A 70 10.344 -11.943 11.948 1.00 53.14 H new ATOM 0 HA ASP A 70 12.077 -9.828 10.762 1.00 32.30 H new ATOM 0 HB2 ASP A 70 13.198 -11.452 12.311 1.00 62.51 H new ATOM 0 HB3 ASP A 70 12.660 -12.771 11.289 1.00 62.51 H new ATOM 1027 N PHE A 71 11.670 -10.550 8.429 1.00 40.40 N ATOM 1028 CA PHE A 71 11.313 -10.868 7.064 1.00 32.42 C ATOM 1029 C PHE A 71 12.460 -10.578 6.132 1.00 0.11 C ATOM 1030 O PHE A 71 13.191 -9.637 6.339 1.00 0.31 O ATOM 1031 CB PHE A 71 10.074 -10.090 6.636 1.00 13.12 C ATOM 1032 CG PHE A 71 8.870 -10.399 7.470 1.00 54.25 C ATOM 1033 CD1 PHE A 71 8.070 -11.486 7.172 1.00 23.35 C ATOM 1034 CD2 PHE A 71 8.547 -9.609 8.560 1.00 51.43 C ATOM 1035 CE1 PHE A 71 6.971 -11.779 7.941 1.00 53.10 C ATOM 1036 CE2 PHE A 71 7.451 -9.898 9.331 1.00 74.22 C ATOM 1037 CZ PHE A 71 6.662 -10.983 9.023 1.00 2.11 C ATOM 0 H PHE A 71 12.183 -9.675 8.533 1.00 40.40 H new ATOM 0 HA PHE A 71 11.087 -11.933 7.013 1.00 32.42 H new ATOM 0 HB2 PHE A 71 10.285 -9.022 6.694 1.00 13.12 H new ATOM 0 HB3 PHE A 71 9.853 -10.315 5.593 1.00 13.12 H new ATOM 0 HD1 PHE A 71 8.312 -12.111 6.325 1.00 23.35 H new ATOM 0 HD2 PHE A 71 9.164 -8.757 8.805 1.00 51.43 H new ATOM 0 HE1 PHE A 71 6.351 -12.630 7.699 1.00 53.10 H new ATOM 0 HE2 PHE A 71 7.207 -9.275 10.179 1.00 74.22 H new ATOM 0 HZ PHE A 71 5.799 -11.211 9.631 1.00 2.11 H new ATOM 1047 N THR A 72 12.606 -11.366 5.113 1.00 73.41 N ATOM 1048 CA THR A 72 13.653 -11.178 4.153 1.00 35.24 C ATOM 1049 C THR A 72 13.108 -11.261 2.731 1.00 45.12 C ATOM 1050 O THR A 72 12.559 -12.265 2.320 1.00 23.14 O ATOM 1051 CB THR A 72 14.796 -12.201 4.358 1.00 33.01 C ATOM 1052 OG1 THR A 72 15.327 -12.050 5.687 1.00 44.21 O ATOM 1053 CG2 THR A 72 15.922 -11.987 3.347 1.00 21.45 C ATOM 0 H THR A 72 11.999 -12.163 4.921 1.00 73.41 H new ATOM 0 HA THR A 72 14.065 -10.180 4.306 1.00 35.24 H new ATOM 0 HB THR A 72 14.390 -13.202 4.215 1.00 33.01 H new ATOM 0 HG1 THR A 72 16.051 -12.696 5.825 1.00 44.21 H new ATOM 0 HG21 THR A 72 16.709 -12.721 3.518 1.00 21.45 H new ATOM 0 HG22 THR A 72 15.531 -12.103 2.336 1.00 21.45 H new ATOM 0 HG23 THR A 72 16.331 -10.983 3.465 1.00 21.45 H new ATOM 1061 N PHE A 73 13.249 -10.189 2.032 1.00 51.34 N ATOM 1062 CA PHE A 73 12.858 -10.055 0.660 1.00 52.34 C ATOM 1063 C PHE A 73 14.075 -10.273 -0.199 1.00 61.13 C ATOM 1064 O PHE A 73 15.152 -9.742 0.102 1.00 42.32 O ATOM 1065 CB PHE A 73 12.303 -8.655 0.461 1.00 12.32 C ATOM 1066 CG PHE A 73 12.049 -8.225 -0.948 1.00 31.33 C ATOM 1067 CD1 PHE A 73 10.866 -8.526 -1.607 1.00 0.21 C ATOM 1068 CD2 PHE A 73 12.998 -7.478 -1.598 1.00 32.42 C ATOM 1069 CE1 PHE A 73 10.657 -8.075 -2.892 1.00 52.23 C ATOM 1070 CE2 PHE A 73 12.804 -7.036 -2.867 1.00 12.05 C ATOM 1071 CZ PHE A 73 11.641 -7.325 -3.521 1.00 55.33 C ATOM 0 H PHE A 73 13.659 -9.337 2.414 1.00 51.34 H new ATOM 0 HA PHE A 73 12.095 -10.784 0.387 1.00 52.34 H new ATOM 0 HB2 PHE A 73 11.366 -8.579 1.013 1.00 12.32 H new ATOM 0 HB3 PHE A 73 12.998 -7.947 0.912 1.00 12.32 H new ATOM 0 HD1 PHE A 73 10.108 -9.115 -1.112 1.00 0.21 H new ATOM 0 HD2 PHE A 73 13.920 -7.236 -1.089 1.00 32.42 H new ATOM 0 HE1 PHE A 73 9.735 -8.303 -3.406 1.00 52.23 H new ATOM 0 HE2 PHE A 73 13.570 -6.455 -3.359 1.00 12.05 H new ATOM 0 HZ PHE A 73 11.486 -6.970 -4.529 1.00 55.33 H new ATOM 1081 N THR A 74 13.932 -11.047 -1.223 1.00 60.21 N ATOM 1082 CA THR A 74 15.024 -11.327 -2.077 1.00 1.00 C ATOM 1083 C THR A 74 14.643 -11.148 -3.550 1.00 41.52 C ATOM 1084 O THR A 74 13.546 -11.554 -3.983 1.00 31.31 O ATOM 1085 CB THR A 74 15.588 -12.764 -1.815 1.00 63.43 C ATOM 1086 OG1 THR A 74 16.729 -13.009 -2.630 1.00 31.03 O ATOM 1087 CG2 THR A 74 14.540 -13.844 -2.078 1.00 62.15 C ATOM 0 H THR A 74 13.056 -11.499 -1.486 1.00 60.21 H new ATOM 0 HA THR A 74 15.811 -10.608 -1.850 1.00 1.00 H new ATOM 0 HB THR A 74 15.870 -12.809 -0.763 1.00 63.43 H new ATOM 0 HG1 THR A 74 17.202 -12.166 -2.792 1.00 31.03 H new ATOM 0 HG21 THR A 74 14.973 -14.826 -1.884 1.00 62.15 H new ATOM 0 HG22 THR A 74 13.684 -13.688 -1.421 1.00 62.15 H new ATOM 0 HG23 THR A 74 14.214 -13.790 -3.117 1.00 62.15 H new ATOM 1095 N ILE A 75 15.499 -10.481 -4.299 1.00 11.10 N ATOM 1096 CA ILE A 75 15.345 -10.431 -5.717 1.00 22.43 C ATOM 1097 C ILE A 75 16.410 -11.361 -6.259 1.00 1.14 C ATOM 1098 O ILE A 75 17.590 -11.072 -6.131 1.00 54.23 O ATOM 1099 CB ILE A 75 15.577 -8.998 -6.277 1.00 74.35 C ATOM 1100 CG1 ILE A 75 14.630 -7.998 -5.611 1.00 45.45 C ATOM 1101 CG2 ILE A 75 15.391 -8.974 -7.793 1.00 44.10 C ATOM 1102 CD1 ILE A 75 14.838 -6.556 -6.050 1.00 43.55 C ATOM 0 H ILE A 75 16.304 -9.970 -3.938 1.00 11.10 H new ATOM 0 HA ILE A 75 14.334 -10.717 -6.007 1.00 22.43 H new ATOM 0 HB ILE A 75 16.603 -8.708 -6.050 1.00 74.35 H new ATOM 0 HG12 ILE A 75 13.602 -8.288 -5.828 1.00 45.45 H new ATOM 0 HG13 ILE A 75 14.757 -8.059 -4.530 1.00 45.45 H new ATOM 0 HG21 ILE A 75 15.558 -7.963 -8.164 1.00 44.10 H new ATOM 0 HG22 ILE A 75 16.105 -9.654 -8.258 1.00 44.10 H new ATOM 0 HG23 ILE A 75 14.377 -9.289 -8.040 1.00 44.10 H new ATOM 0 HD11 ILE A 75 14.128 -5.912 -5.532 1.00 43.55 H new ATOM 0 HD12 ILE A 75 15.854 -6.245 -5.807 1.00 43.55 H new ATOM 0 HD13 ILE A 75 14.682 -6.477 -7.126 1.00 43.55 H new ATOM 1114 N SER A 76 16.001 -12.469 -6.834 1.00 42.21 N ATOM 1115 CA SER A 76 16.943 -13.468 -7.282 1.00 20.52 C ATOM 1116 C SER A 76 17.699 -13.002 -8.525 1.00 2.21 C ATOM 1117 O SER A 76 18.922 -13.138 -8.607 1.00 20.20 O ATOM 1118 CB SER A 76 16.191 -14.787 -7.550 1.00 44.22 C ATOM 1119 OG SER A 76 17.059 -15.818 -8.001 1.00 33.23 O ATOM 0 H SER A 76 15.022 -12.701 -7.002 1.00 42.21 H new ATOM 0 HA SER A 76 17.686 -13.631 -6.502 1.00 20.52 H new ATOM 0 HB2 SER A 76 15.690 -15.110 -6.637 1.00 44.22 H new ATOM 0 HB3 SER A 76 15.415 -14.616 -8.296 1.00 44.22 H new ATOM 0 HG SER A 76 16.542 -16.636 -8.157 1.00 33.23 H new ATOM 1125 N SER A 77 16.991 -12.445 -9.459 1.00 64.15 N ATOM 1126 CA SER A 77 17.605 -11.905 -10.627 1.00 40.52 C ATOM 1127 C SER A 77 17.333 -10.427 -10.720 1.00 24.50 C ATOM 1128 O SER A 77 16.252 -10.029 -11.116 1.00 2.42 O ATOM 1129 CB SER A 77 17.151 -12.649 -11.870 1.00 53.11 C ATOM 1130 OG SER A 77 17.495 -14.028 -11.772 1.00 24.31 O ATOM 0 H SER A 77 15.976 -12.353 -9.431 1.00 64.15 H new ATOM 0 HA SER A 77 18.684 -12.039 -10.554 1.00 40.52 H new ATOM 0 HB2 SER A 77 16.073 -12.544 -11.992 1.00 53.11 H new ATOM 0 HB3 SER A 77 17.616 -12.213 -12.754 1.00 53.11 H new ATOM 0 HG SER A 77 17.196 -14.498 -12.578 1.00 24.31 H new ATOM 1136 N LEU A 78 18.273 -9.615 -10.312 1.00 25.55 N ATOM 1137 CA LEU A 78 18.069 -8.186 -10.370 1.00 24.12 C ATOM 1138 C LEU A 78 18.199 -7.681 -11.805 1.00 72.15 C ATOM 1139 O LEU A 78 19.221 -7.922 -12.460 1.00 4.34 O ATOM 1140 CB LEU A 78 19.069 -7.474 -9.469 1.00 12.33 C ATOM 1141 CG LEU A 78 18.903 -5.966 -9.379 1.00 52.00 C ATOM 1142 CD1 LEU A 78 17.529 -5.630 -8.828 1.00 33.45 C ATOM 1143 CD2 LEU A 78 19.988 -5.370 -8.510 1.00 35.11 C ATOM 0 H LEU A 78 19.176 -9.910 -9.941 1.00 25.55 H new ATOM 0 HA LEU A 78 17.061 -7.968 -10.018 1.00 24.12 H new ATOM 0 HB2 LEU A 78 18.991 -7.892 -8.465 1.00 12.33 H new ATOM 0 HB3 LEU A 78 20.075 -7.692 -9.827 1.00 12.33 H new ATOM 0 HG LEU A 78 18.992 -5.538 -10.377 1.00 52.00 H new ATOM 0 HD11 LEU A 78 17.417 -4.548 -8.766 1.00 33.45 H new ATOM 0 HD12 LEU A 78 16.763 -6.037 -9.488 1.00 33.45 H new ATOM 0 HD13 LEU A 78 17.420 -6.064 -7.834 1.00 33.45 H new ATOM 0 HD21 LEU A 78 19.857 -4.289 -8.454 1.00 35.11 H new ATOM 0 HD22 LEU A 78 19.926 -5.795 -7.508 1.00 35.11 H new ATOM 0 HD23 LEU A 78 20.964 -5.595 -8.940 1.00 35.11 H new ATOM 1155 N GLN A 79 17.168 -7.010 -12.290 1.00 4.40 N ATOM 1156 CA GLN A 79 17.153 -6.433 -13.628 1.00 21.44 C ATOM 1157 C GLN A 79 17.069 -4.908 -13.533 1.00 74.54 C ATOM 1158 O GLN A 79 16.646 -4.383 -12.517 1.00 40.55 O ATOM 1159 CB GLN A 79 15.947 -6.956 -14.438 1.00 70.31 C ATOM 1160 CG GLN A 79 15.929 -8.455 -14.675 1.00 32.12 C ATOM 1161 CD GLN A 79 17.130 -8.962 -15.444 1.00 63.14 C ATOM 1162 OE1 GLN A 79 17.125 -9.018 -16.672 1.00 53.23 O ATOM 1163 NE2 GLN A 79 18.157 -9.339 -14.741 1.00 3.30 N ATOM 0 H GLN A 79 16.310 -6.848 -11.764 1.00 4.40 H new ATOM 0 HA GLN A 79 18.073 -6.725 -14.135 1.00 21.44 H new ATOM 0 HB2 GLN A 79 15.031 -6.676 -13.918 1.00 70.31 H new ATOM 0 HB3 GLN A 79 15.932 -6.451 -15.404 1.00 70.31 H new ATOM 0 HG2 GLN A 79 15.882 -8.966 -13.713 1.00 32.12 H new ATOM 0 HG3 GLN A 79 15.022 -8.717 -15.220 1.00 32.12 H new ATOM 0 HE21 GLN A 79 18.128 -9.279 -13.723 1.00 3.30 H new ATOM 0 HE22 GLN A 79 18.992 -9.694 -15.207 1.00 3.30 H new ATOM 1172 N PRO A 80 17.501 -4.173 -14.589 1.00 74.21 N ATOM 1173 CA PRO A 80 17.392 -2.694 -14.652 1.00 23.44 C ATOM 1174 C PRO A 80 15.962 -2.210 -14.388 1.00 31.33 C ATOM 1175 O PRO A 80 15.744 -1.127 -13.858 1.00 31.33 O ATOM 1176 CB PRO A 80 17.798 -2.374 -16.091 1.00 14.11 C ATOM 1177 CG PRO A 80 18.709 -3.482 -16.468 1.00 53.02 C ATOM 1178 CD PRO A 80 18.163 -4.710 -15.793 1.00 50.41 C ATOM 0 HA PRO A 80 18.009 -2.205 -13.898 1.00 23.44 H new ATOM 0 HB2 PRO A 80 16.930 -2.331 -16.749 1.00 14.11 H new ATOM 0 HB3 PRO A 80 18.298 -1.408 -16.158 1.00 14.11 H new ATOM 0 HG2 PRO A 80 18.740 -3.612 -17.550 1.00 53.02 H new ATOM 0 HG3 PRO A 80 19.729 -3.278 -16.142 1.00 53.02 H new ATOM 0 HD2 PRO A 80 17.460 -5.242 -16.434 1.00 50.41 H new ATOM 0 HD3 PRO A 80 18.955 -5.413 -15.536 1.00 50.41 H new ATOM 1186 N GLU A 81 14.996 -3.040 -14.762 1.00 42.12 N ATOM 1187 CA GLU A 81 13.577 -2.734 -14.585 1.00 23.35 C ATOM 1188 C GLU A 81 13.188 -2.748 -13.095 1.00 11.01 C ATOM 1189 O GLU A 81 12.075 -2.335 -12.722 1.00 24.11 O ATOM 1190 CB GLU A 81 12.724 -3.772 -15.316 1.00 44.31 C ATOM 1191 CG GLU A 81 13.046 -3.945 -16.789 1.00 11.52 C ATOM 1192 CD GLU A 81 12.130 -4.946 -17.457 1.00 21.34 C ATOM 1193 OE1 GLU A 81 12.163 -6.124 -17.097 1.00 4.43 O ATOM 1194 OE2 GLU A 81 11.333 -4.551 -18.339 1.00 11.31 O ATOM 0 H GLU A 81 15.172 -3.946 -15.197 1.00 42.12 H new ATOM 0 HA GLU A 81 13.400 -1.739 -14.994 1.00 23.35 H new ATOM 0 HB2 GLU A 81 12.844 -4.734 -14.818 1.00 44.31 H new ATOM 0 HB3 GLU A 81 11.675 -3.491 -15.219 1.00 44.31 H new ATOM 0 HG2 GLU A 81 12.961 -2.983 -17.294 1.00 11.52 H new ATOM 0 HG3 GLU A 81 14.080 -4.271 -16.898 1.00 11.52 H new ATOM 1201 N ASP A 82 14.091 -3.231 -12.257 1.00 34.34 N ATOM 1202 CA ASP A 82 13.826 -3.379 -10.837 1.00 74.54 C ATOM 1203 C ASP A 82 14.461 -2.257 -10.029 1.00 52.42 C ATOM 1204 O ASP A 82 14.513 -2.322 -8.797 1.00 60.35 O ATOM 1205 CB ASP A 82 14.333 -4.738 -10.318 1.00 3.15 C ATOM 1206 CG ASP A 82 13.727 -5.928 -11.025 1.00 42.44 C ATOM 1207 OD1 ASP A 82 12.488 -5.952 -11.232 1.00 42.13 O ATOM 1208 OD2 ASP A 82 14.482 -6.841 -11.413 1.00 60.45 O ATOM 0 H ASP A 82 15.024 -3.530 -12.541 1.00 34.34 H new ATOM 0 HA ASP A 82 12.745 -3.329 -10.709 1.00 74.54 H new ATOM 0 HB2 ASP A 82 15.417 -4.776 -10.427 1.00 3.15 H new ATOM 0 HB3 ASP A 82 14.117 -4.812 -9.252 1.00 3.15 H new ATOM 1213 N ILE A 83 14.944 -1.223 -10.701 1.00 52.21 N ATOM 1214 CA ILE A 83 15.518 -0.089 -9.989 1.00 63.34 C ATOM 1215 C ILE A 83 14.404 0.772 -9.425 1.00 63.13 C ATOM 1216 O ILE A 83 13.661 1.423 -10.178 1.00 43.41 O ATOM 1217 CB ILE A 83 16.457 0.775 -10.875 1.00 51.54 C ATOM 1218 CG1 ILE A 83 17.642 -0.047 -11.366 1.00 44.41 C ATOM 1219 CG2 ILE A 83 16.948 2.004 -10.109 1.00 63.33 C ATOM 1220 CD1 ILE A 83 18.475 -0.607 -10.255 1.00 70.04 C ATOM 0 H ILE A 83 14.951 -1.144 -11.718 1.00 52.21 H new ATOM 0 HA ILE A 83 16.132 -0.494 -9.184 1.00 63.34 H new ATOM 0 HB ILE A 83 15.886 1.112 -11.740 1.00 51.54 H new ATOM 0 HG12 ILE A 83 17.276 -0.866 -11.985 1.00 44.41 H new ATOM 0 HG13 ILE A 83 18.269 0.577 -12.002 1.00 44.41 H new ATOM 0 HG21 ILE A 83 17.604 2.594 -10.749 1.00 63.33 H new ATOM 0 HG22 ILE A 83 16.094 2.610 -9.808 1.00 63.33 H new ATOM 0 HG23 ILE A 83 17.497 1.685 -9.223 1.00 63.33 H new ATOM 0 HD11 ILE A 83 19.301 -1.181 -10.674 1.00 70.04 H new ATOM 0 HD12 ILE A 83 18.870 0.209 -9.650 1.00 70.04 H new ATOM 0 HD13 ILE A 83 17.861 -1.257 -9.632 1.00 70.04 H new ATOM 1232 N ALA A 84 14.277 0.762 -8.114 1.00 41.24 N ATOM 1233 CA ALA A 84 13.224 1.481 -7.441 1.00 1.31 C ATOM 1234 C ALA A 84 13.505 1.559 -5.953 1.00 11.40 C ATOM 1235 O ALA A 84 14.622 1.249 -5.505 1.00 50.20 O ATOM 1236 CB ALA A 84 11.929 0.741 -7.661 1.00 4.35 C ATOM 0 H ALA A 84 14.903 0.254 -7.488 1.00 41.24 H new ATOM 0 HA ALA A 84 13.163 2.494 -7.839 1.00 1.31 H new ATOM 0 HB1 ALA A 84 11.118 1.269 -7.159 1.00 4.35 H new ATOM 0 HB2 ALA A 84 11.719 0.685 -8.729 1.00 4.35 H new ATOM 0 HB3 ALA A 84 12.012 -0.267 -7.254 1.00 4.35 H new ATOM 1242 N THR A 85 12.518 2.002 -5.204 1.00 61.21 N ATOM 1243 CA THR A 85 12.586 2.033 -3.771 1.00 12.30 C ATOM 1244 C THR A 85 11.643 0.951 -3.201 1.00 22.41 C ATOM 1245 O THR A 85 10.421 0.990 -3.430 1.00 13.24 O ATOM 1246 CB THR A 85 12.178 3.419 -3.234 1.00 62.41 C ATOM 1247 OG1 THR A 85 13.013 4.431 -3.831 1.00 40.12 O ATOM 1248 CG2 THR A 85 12.334 3.470 -1.723 1.00 34.43 C ATOM 0 H THR A 85 11.639 2.353 -5.584 1.00 61.21 H new ATOM 0 HA THR A 85 13.612 1.836 -3.459 1.00 12.30 H new ATOM 0 HB THR A 85 11.134 3.599 -3.489 1.00 62.41 H new ATOM 0 HG1 THR A 85 12.753 5.312 -3.491 1.00 40.12 H new ATOM 0 HG21 THR A 85 12.042 4.455 -1.360 1.00 34.43 H new ATOM 0 HG22 THR A 85 11.698 2.712 -1.266 1.00 34.43 H new ATOM 0 HG23 THR A 85 13.374 3.279 -1.458 1.00 34.43 H new ATOM 1256 N TYR A 86 12.208 0.004 -2.477 1.00 64.43 N ATOM 1257 CA TYR A 86 11.452 -1.126 -1.930 1.00 53.42 C ATOM 1258 C TYR A 86 11.189 -0.966 -0.462 1.00 14.42 C ATOM 1259 O TYR A 86 12.050 -0.551 0.287 1.00 5.12 O ATOM 1260 CB TYR A 86 12.191 -2.440 -2.171 1.00 63.24 C ATOM 1261 CG TYR A 86 12.289 -2.815 -3.616 1.00 11.41 C ATOM 1262 CD1 TYR A 86 13.226 -2.226 -4.445 1.00 15.02 C ATOM 1263 CD2 TYR A 86 11.431 -3.754 -4.156 1.00 62.42 C ATOM 1264 CE1 TYR A 86 13.306 -2.564 -5.769 1.00 63.34 C ATOM 1265 CE2 TYR A 86 11.505 -4.098 -5.478 1.00 12.10 C ATOM 1266 CZ TYR A 86 12.445 -3.499 -6.280 1.00 62.20 C ATOM 1267 OH TYR A 86 12.515 -3.829 -7.594 1.00 53.44 O ATOM 0 H TYR A 86 13.202 -0.012 -2.247 1.00 64.43 H new ATOM 0 HA TYR A 86 10.494 -1.146 -2.450 1.00 53.42 H new ATOM 0 HB2 TYR A 86 13.196 -2.364 -1.755 1.00 63.24 H new ATOM 0 HB3 TYR A 86 11.682 -3.238 -1.631 1.00 63.24 H new ATOM 0 HD1 TYR A 86 13.904 -1.489 -4.042 1.00 15.02 H new ATOM 0 HD2 TYR A 86 10.691 -4.223 -3.525 1.00 62.42 H new ATOM 0 HE1 TYR A 86 14.042 -2.097 -6.406 1.00 63.34 H new ATOM 0 HE2 TYR A 86 10.830 -4.835 -5.888 1.00 12.10 H new ATOM 0 HH TYR A 86 13.205 -3.288 -8.031 1.00 53.44 H new ATOM 1277 N HIS A 87 9.997 -1.284 -0.054 1.00 42.35 N ATOM 1278 CA HIS A 87 9.618 -1.206 1.344 1.00 44.44 C ATOM 1279 C HIS A 87 8.540 -2.155 1.737 1.00 51.51 C ATOM 1280 O HIS A 87 7.601 -2.415 0.973 1.00 21.21 O ATOM 1281 CB HIS A 87 9.342 0.227 1.863 1.00 71.22 C ATOM 1282 CG HIS A 87 8.664 1.164 0.910 1.00 24.22 C ATOM 1283 ND1 HIS A 87 9.013 2.494 0.822 1.00 31.44 N ATOM 1284 CD2 HIS A 87 7.675 0.978 0.000 1.00 5.12 C ATOM 1285 CE1 HIS A 87 8.287 3.084 -0.091 1.00 34.44 C ATOM 1286 NE2 HIS A 87 7.460 2.191 -0.613 1.00 62.13 N ATOM 0 H HIS A 87 9.253 -1.606 -0.673 1.00 42.35 H new ATOM 0 HA HIS A 87 10.521 -1.536 1.858 1.00 44.44 H new ATOM 0 HB2 HIS A 87 8.730 0.152 2.762 1.00 71.22 H new ATOM 0 HB3 HIS A 87 10.292 0.671 2.160 1.00 71.22 H new ATOM 0 HD1 HIS A 87 9.731 2.950 1.385 1.00 31.44 H new ATOM 0 HD2 HIS A 87 7.155 0.054 -0.204 1.00 5.12 H new ATOM 0 HE1 HIS A 87 8.351 4.125 -0.372 1.00 34.44 H new ATOM 1295 N CYS A 88 8.702 -2.664 2.924 1.00 3.11 N ATOM 1296 CA CYS A 88 7.804 -3.585 3.553 1.00 25.33 C ATOM 1297 C CYS A 88 6.705 -2.828 4.273 1.00 75.52 C ATOM 1298 O CYS A 88 6.942 -1.721 4.770 1.00 64.03 O ATOM 1299 CB CYS A 88 8.617 -4.384 4.570 1.00 14.43 C ATOM 1300 SG CYS A 88 9.606 -3.328 5.691 1.00 51.35 S ATOM 0 H CYS A 88 9.506 -2.435 3.508 1.00 3.11 H new ATOM 0 HA CYS A 88 7.345 -4.239 2.812 1.00 25.33 H new ATOM 0 HB2 CYS A 88 7.941 -4.999 5.163 1.00 14.43 H new ATOM 0 HB3 CYS A 88 9.284 -5.064 4.039 1.00 14.43 H new ATOM 1305 N GLN A 89 5.518 -3.392 4.294 1.00 62.51 N ATOM 1306 CA GLN A 89 4.416 -2.842 5.048 1.00 62.21 C ATOM 1307 C GLN A 89 3.719 -3.959 5.758 1.00 64.34 C ATOM 1308 O GLN A 89 3.663 -5.084 5.247 1.00 44.35 O ATOM 1309 CB GLN A 89 3.423 -2.018 4.173 1.00 72.13 C ATOM 1310 CG GLN A 89 2.559 -2.763 3.146 1.00 34.02 C ATOM 1311 CD GLN A 89 1.291 -3.415 3.719 1.00 70.40 C ATOM 1312 OE1 GLN A 89 1.278 -4.566 4.126 1.00 50.23 O ATOM 1313 NE2 GLN A 89 0.221 -2.668 3.743 1.00 32.23 N ATOM 0 H GLN A 89 5.290 -4.247 3.787 1.00 62.51 H new ATOM 0 HA GLN A 89 4.819 -2.132 5.770 1.00 62.21 H new ATOM 0 HB2 GLN A 89 2.752 -1.485 4.846 1.00 72.13 H new ATOM 0 HB3 GLN A 89 4.000 -1.265 3.636 1.00 72.13 H new ATOM 0 HG2 GLN A 89 2.268 -2.064 2.362 1.00 34.02 H new ATOM 0 HG3 GLN A 89 3.166 -3.536 2.674 1.00 34.02 H new ATOM 0 HE21 GLN A 89 0.260 -1.709 3.396 1.00 32.23 H new ATOM 0 HE22 GLN A 89 -0.655 -3.043 4.108 1.00 32.23 H new ATOM 1322 N GLN A 90 3.280 -3.702 6.927 1.00 52.31 N ATOM 1323 CA GLN A 90 2.497 -4.652 7.659 1.00 62.45 C ATOM 1324 C GLN A 90 1.033 -4.411 7.443 1.00 74.41 C ATOM 1325 O GLN A 90 0.628 -3.292 7.225 1.00 40.55 O ATOM 1326 CB GLN A 90 2.847 -4.651 9.152 1.00 33.33 C ATOM 1327 CG GLN A 90 3.279 -3.304 9.763 1.00 3.52 C ATOM 1328 CD GLN A 90 2.328 -2.126 9.583 1.00 74.32 C ATOM 1329 OE1 GLN A 90 2.426 -1.417 8.608 1.00 22.21 O ATOM 1330 NE2 GLN A 90 1.470 -1.872 10.539 1.00 63.21 N ATOM 0 H GLN A 90 3.447 -2.824 7.419 1.00 52.31 H new ATOM 0 HA GLN A 90 2.739 -5.643 7.276 1.00 62.45 H new ATOM 0 HB2 GLN A 90 1.980 -5.012 9.705 1.00 33.33 H new ATOM 0 HB3 GLN A 90 3.650 -5.370 9.313 1.00 33.33 H new ATOM 0 HG2 GLN A 90 3.437 -3.452 10.831 1.00 3.52 H new ATOM 0 HG3 GLN A 90 4.243 -3.030 9.333 1.00 3.52 H new ATOM 0 HE21 GLN A 90 1.411 -2.489 11.349 1.00 63.21 H new ATOM 0 HE22 GLN A 90 0.860 -1.057 10.474 1.00 63.21 H new ATOM 1339 N TYR A 91 0.236 -5.455 7.456 1.00 62.41 N ATOM 1340 CA TYR A 91 -1.191 -5.249 7.340 1.00 34.44 C ATOM 1341 C TYR A 91 -1.951 -6.023 8.386 1.00 61.03 C ATOM 1342 O TYR A 91 -3.163 -6.151 8.321 1.00 44.23 O ATOM 1343 CB TYR A 91 -1.739 -5.508 5.924 1.00 42.10 C ATOM 1344 CG TYR A 91 -1.755 -6.941 5.430 1.00 13.34 C ATOM 1345 CD1 TYR A 91 -0.654 -7.501 4.835 1.00 55.12 C ATOM 1346 CD2 TYR A 91 -2.908 -7.714 5.534 1.00 11.31 C ATOM 1347 CE1 TYR A 91 -0.686 -8.795 4.354 1.00 33.13 C ATOM 1348 CE2 TYR A 91 -2.952 -9.000 5.053 1.00 63.31 C ATOM 1349 CZ TYR A 91 -1.837 -9.538 4.465 1.00 33.54 C ATOM 1350 OH TYR A 91 -1.877 -10.823 3.973 1.00 45.13 O ATOM 0 H TYR A 91 0.537 -6.426 7.543 1.00 62.41 H new ATOM 0 HA TYR A 91 -1.354 -4.188 7.527 1.00 34.44 H new ATOM 0 HB2 TYR A 91 -2.759 -5.127 5.884 1.00 42.10 H new ATOM 0 HB3 TYR A 91 -1.150 -4.917 5.222 1.00 42.10 H new ATOM 0 HD1 TYR A 91 0.252 -6.921 4.741 1.00 55.12 H new ATOM 0 HD2 TYR A 91 -3.786 -7.294 6.002 1.00 11.31 H new ATOM 0 HE1 TYR A 91 0.191 -9.222 3.892 1.00 33.13 H new ATOM 0 HE2 TYR A 91 -3.858 -9.582 5.137 1.00 63.31 H new ATOM 0 HH TYR A 91 -1.295 -10.891 3.188 1.00 45.13 H new ATOM 1360 N ASP A 92 -1.239 -6.488 9.388 1.00 31.41 N ATOM 1361 CA ASP A 92 -1.877 -7.228 10.460 1.00 72.33 C ATOM 1362 C ASP A 92 -2.656 -6.294 11.383 1.00 13.31 C ATOM 1363 O ASP A 92 -3.732 -6.649 11.881 1.00 53.51 O ATOM 1364 CB ASP A 92 -0.869 -8.077 11.249 1.00 75.21 C ATOM 1365 CG ASP A 92 -1.519 -8.804 12.404 1.00 53.04 C ATOM 1366 OD1 ASP A 92 -2.187 -9.830 12.171 1.00 42.35 O ATOM 1367 OD2 ASP A 92 -1.394 -8.347 13.547 1.00 22.31 O ATOM 0 H ASP A 92 -0.230 -6.371 9.486 1.00 31.41 H new ATOM 0 HA ASP A 92 -2.586 -7.917 10.001 1.00 72.33 H new ATOM 0 HB2 ASP A 92 -0.404 -8.802 10.580 1.00 75.21 H new ATOM 0 HB3 ASP A 92 -0.073 -7.436 11.627 1.00 75.21 H new ATOM 1372 N ASN A 93 -2.122 -5.105 11.602 1.00 55.12 N ATOM 1373 CA ASN A 93 -2.786 -4.113 12.434 1.00 20.04 C ATOM 1374 C ASN A 93 -2.487 -2.702 11.922 1.00 24.35 C ATOM 1375 O ASN A 93 -1.381 -2.431 11.457 1.00 74.35 O ATOM 1376 CB ASN A 93 -2.359 -4.256 13.909 1.00 3.32 C ATOM 1377 CG ASN A 93 -3.064 -3.264 14.828 1.00 51.34 C ATOM 1378 OD1 ASN A 93 -4.206 -2.858 14.579 1.00 11.44 O ATOM 1379 ND2 ASN A 93 -2.401 -2.876 15.880 1.00 71.25 N ATOM 0 H ASN A 93 -1.229 -4.801 11.215 1.00 55.12 H new ATOM 0 HA ASN A 93 -3.861 -4.284 12.376 1.00 20.04 H new ATOM 0 HB2 ASN A 93 -2.570 -5.271 14.247 1.00 3.32 H new ATOM 0 HB3 ASN A 93 -1.281 -4.113 13.986 1.00 3.32 H new ATOM 0 HD21 ASN A 93 -2.822 -2.215 16.533 1.00 71.25 H new ATOM 0 HD22 ASN A 93 -1.461 -3.233 16.051 1.00 71.25 H new ATOM 1386 N LEU A 94 -3.476 -1.830 11.994 1.00 31.05 N ATOM 1387 CA LEU A 94 -3.352 -0.434 11.582 1.00 45.34 C ATOM 1388 C LEU A 94 -2.781 0.426 12.692 1.00 33.21 C ATOM 1389 O LEU A 94 -2.878 0.060 13.869 1.00 24.11 O ATOM 1390 CB LEU A 94 -4.713 0.109 11.141 1.00 22.34 C ATOM 1391 CG LEU A 94 -5.142 -0.269 9.736 1.00 31.02 C ATOM 1392 CD1 LEU A 94 -6.571 0.086 9.509 1.00 41.02 C ATOM 1393 CD2 LEU A 94 -4.304 0.489 8.736 1.00 14.24 C ATOM 0 H LEU A 94 -4.403 -2.070 12.345 1.00 31.05 H new ATOM 0 HA LEU A 94 -2.660 -0.395 10.741 1.00 45.34 H new ATOM 0 HB2 LEU A 94 -5.470 -0.245 11.841 1.00 22.34 H new ATOM 0 HB3 LEU A 94 -4.693 1.196 11.216 1.00 22.34 H new ATOM 0 HG LEU A 94 -5.011 -1.344 9.615 1.00 31.02 H new ATOM 0 HD11 LEU A 94 -6.859 -0.193 8.495 1.00 41.02 H new ATOM 0 HD12 LEU A 94 -7.197 -0.448 10.224 1.00 41.02 H new ATOM 0 HD13 LEU A 94 -6.705 1.160 9.641 1.00 41.02 H new ATOM 0 HD21 LEU A 94 -4.610 0.219 7.725 1.00 14.24 H new ATOM 0 HD22 LEU A 94 -4.442 1.560 8.883 1.00 14.24 H new ATOM 0 HD23 LEU A 94 -3.253 0.236 8.876 1.00 14.24 H new ATOM 1405 N PRO A 95 -2.157 1.578 12.355 1.00 4.15 N ATOM 1406 CA PRO A 95 -1.965 2.033 10.965 1.00 32.52 C ATOM 1407 C PRO A 95 -0.830 1.293 10.239 1.00 54.30 C ATOM 1408 O PRO A 95 0.090 0.753 10.870 1.00 14.32 O ATOM 1409 CB PRO A 95 -1.614 3.511 11.120 1.00 32.40 C ATOM 1410 CG PRO A 95 -0.969 3.603 12.455 1.00 43.10 C ATOM 1411 CD PRO A 95 -1.616 2.550 13.321 1.00 34.02 C ATOM 0 HA PRO A 95 -2.852 1.845 10.360 1.00 32.52 H new ATOM 0 HB2 PRO A 95 -0.941 3.844 10.330 1.00 32.40 H new ATOM 0 HB3 PRO A 95 -2.504 4.138 11.065 1.00 32.40 H new ATOM 0 HG2 PRO A 95 0.105 3.435 12.378 1.00 43.10 H new ATOM 0 HG3 PRO A 95 -1.107 4.595 12.884 1.00 43.10 H new ATOM 0 HD2 PRO A 95 -0.893 2.086 13.992 1.00 34.02 H new ATOM 0 HD3 PRO A 95 -2.403 2.974 13.944 1.00 34.02 H new ATOM 1419 N TYR A 96 -0.917 1.247 8.923 1.00 74.35 N ATOM 1420 CA TYR A 96 0.099 0.596 8.135 1.00 63.23 C ATOM 1421 C TYR A 96 1.164 1.597 7.808 1.00 43.01 C ATOM 1422 O TYR A 96 0.873 2.745 7.463 1.00 33.04 O ATOM 1423 CB TYR A 96 -0.457 -0.009 6.833 1.00 10.11 C ATOM 1424 CG TYR A 96 -1.620 -0.973 7.025 1.00 53.32 C ATOM 1425 CD1 TYR A 96 -1.709 -1.791 8.152 1.00 72.42 C ATOM 1426 CD2 TYR A 96 -2.643 -1.049 6.087 1.00 22.42 C ATOM 1427 CE1 TYR A 96 -2.773 -2.651 8.330 1.00 14.41 C ATOM 1428 CE2 TYR A 96 -3.711 -1.903 6.260 1.00 43.53 C ATOM 1429 CZ TYR A 96 -3.771 -2.700 7.381 1.00 42.23 C ATOM 1430 OH TYR A 96 -4.831 -3.545 7.550 1.00 41.21 O ATOM 0 H TYR A 96 -1.681 1.653 8.383 1.00 74.35 H new ATOM 0 HA TYR A 96 0.502 -0.229 8.722 1.00 63.23 H new ATOM 0 HB2 TYR A 96 -0.779 0.802 6.180 1.00 10.11 H new ATOM 0 HB3 TYR A 96 0.349 -0.532 6.318 1.00 10.11 H new ATOM 0 HD1 TYR A 96 -0.930 -1.750 8.899 1.00 72.42 H new ATOM 0 HD2 TYR A 96 -2.600 -0.427 5.205 1.00 22.42 H new ATOM 0 HE1 TYR A 96 -2.823 -3.281 9.206 1.00 14.41 H new ATOM 0 HE2 TYR A 96 -4.497 -1.947 5.520 1.00 43.53 H new ATOM 0 HH TYR A 96 -4.504 -4.434 7.800 1.00 41.21 H new ATOM 1440 N THR A 97 2.369 1.185 7.943 1.00 53.05 N ATOM 1441 CA THR A 97 3.494 2.010 7.671 1.00 63.34 C ATOM 1442 C THR A 97 4.489 1.208 6.861 1.00 4.50 C ATOM 1443 O THR A 97 4.379 -0.021 6.782 1.00 61.43 O ATOM 1444 CB THR A 97 4.169 2.475 8.999 1.00 5.20 C ATOM 1445 OG1 THR A 97 4.607 1.329 9.747 1.00 45.51 O ATOM 1446 CG2 THR A 97 3.198 3.267 9.859 1.00 64.21 C ATOM 0 H THR A 97 2.610 0.244 8.253 1.00 53.05 H new ATOM 0 HA THR A 97 3.170 2.893 7.120 1.00 63.34 H new ATOM 0 HB THR A 97 5.016 3.110 8.739 1.00 5.20 H new ATOM 0 HG1 THR A 97 5.032 1.624 10.579 1.00 45.51 H new ATOM 0 HG21 THR A 97 3.696 3.578 10.778 1.00 64.21 H new ATOM 0 HG22 THR A 97 2.863 4.148 9.312 1.00 64.21 H new ATOM 0 HG23 THR A 97 2.338 2.644 10.105 1.00 64.21 H new ATOM 1454 N PHE A 98 5.446 1.865 6.281 1.00 12.30 N ATOM 1455 CA PHE A 98 6.482 1.173 5.573 1.00 45.20 C ATOM 1456 C PHE A 98 7.744 1.285 6.351 1.00 70.03 C ATOM 1457 O PHE A 98 7.914 2.218 7.137 1.00 23.43 O ATOM 1458 CB PHE A 98 6.765 1.774 4.200 1.00 10.22 C ATOM 1459 CG PHE A 98 5.695 1.681 3.164 1.00 3.14 C ATOM 1460 CD1 PHE A 98 5.194 0.469 2.770 1.00 0.22 C ATOM 1461 CD2 PHE A 98 5.241 2.813 2.550 1.00 72.52 C ATOM 1462 CE1 PHE A 98 4.241 0.389 1.773 1.00 53.30 C ATOM 1463 CE2 PHE A 98 4.288 2.753 1.556 1.00 54.12 C ATOM 1464 CZ PHE A 98 3.786 1.535 1.165 1.00 44.31 C ATOM 0 H PHE A 98 5.532 2.881 6.283 1.00 12.30 H new ATOM 0 HA PHE A 98 6.146 0.144 5.446 1.00 45.20 H new ATOM 0 HB2 PHE A 98 7.005 2.828 4.339 1.00 10.22 H new ATOM 0 HB3 PHE A 98 7.659 1.293 3.802 1.00 10.22 H new ATOM 0 HD1 PHE A 98 5.548 -0.435 3.244 1.00 0.22 H new ATOM 0 HD2 PHE A 98 5.636 3.773 2.849 1.00 72.52 H new ATOM 0 HE1 PHE A 98 3.854 -0.573 1.471 1.00 53.30 H new ATOM 0 HE2 PHE A 98 3.937 3.660 1.086 1.00 54.12 H new ATOM 0 HZ PHE A 98 3.040 1.478 0.386 1.00 44.31 H new ATOM 1474 N GLY A 99 8.638 0.359 6.131 1.00 62.34 N ATOM 1475 CA GLY A 99 9.935 0.425 6.748 1.00 2.32 C ATOM 1476 C GLY A 99 10.836 1.389 6.022 1.00 72.43 C ATOM 1477 O GLY A 99 11.876 1.009 5.541 1.00 34.05 O ATOM 0 H GLY A 99 8.492 -0.451 5.528 1.00 62.34 H new ATOM 0 HA2 GLY A 99 9.830 0.734 7.788 1.00 2.32 H new ATOM 0 HA3 GLY A 99 10.388 -0.566 6.754 1.00 2.32 H new ATOM 1481 N GLN A 100 10.412 2.641 5.942 1.00 20.04 N ATOM 1482 CA GLN A 100 11.131 3.685 5.227 1.00 50.22 C ATOM 1483 C GLN A 100 11.212 3.370 3.713 1.00 43.20 C ATOM 1484 O GLN A 100 10.326 3.759 2.934 1.00 3.31 O ATOM 1485 CB GLN A 100 12.527 3.918 5.849 1.00 53.01 C ATOM 1486 CG GLN A 100 13.374 4.968 5.173 1.00 43.13 C ATOM 1487 CD GLN A 100 14.733 5.129 5.827 1.00 42.51 C ATOM 1488 OE1 GLN A 100 15.261 4.069 6.399 1.00 32.15 O flip ATOM 1489 NE2 GLN A 100 15.307 6.207 5.819 1.00 43.12 N flip ATOM 0 H GLN A 100 9.548 2.965 6.377 1.00 20.04 H new ATOM 0 HA GLN A 100 10.573 4.616 5.329 1.00 50.22 H new ATOM 0 HB2 GLN A 100 12.397 4.199 6.894 1.00 53.01 H new ATOM 0 HB3 GLN A 100 13.072 2.974 5.838 1.00 53.01 H new ATOM 0 HG2 GLN A 100 13.508 4.702 4.125 1.00 43.13 H new ATOM 0 HG3 GLN A 100 12.849 5.923 5.195 1.00 43.13 H new ATOM 0 HE21 GLN A 100 14.873 7.012 5.368 1.00 43.12 H new ATOM 0 HE22 GLN A 100 16.220 6.302 6.264 1.00 43.12 H new ATOM 1498 N GLY A 101 12.203 2.605 3.324 1.00 72.10 N ATOM 1499 CA GLY A 101 12.410 2.293 1.945 1.00 1.54 C ATOM 1500 C GLY A 101 13.850 2.034 1.645 1.00 25.51 C ATOM 1501 O GLY A 101 14.729 2.716 2.165 1.00 43.22 O ATOM 0 H GLY A 101 12.883 2.186 3.958 1.00 72.10 H new ATOM 0 HA2 GLY A 101 11.820 1.416 1.678 1.00 1.54 H new ATOM 0 HA3 GLY A 101 12.053 3.118 1.328 1.00 1.54 H new ATOM 1505 N THR A 102 14.087 1.052 0.832 1.00 65.11 N ATOM 1506 CA THR A 102 15.399 0.711 0.405 1.00 12.11 C ATOM 1507 C THR A 102 15.604 1.232 -0.992 1.00 64.44 C ATOM 1508 O THR A 102 14.822 0.922 -1.904 1.00 2.31 O ATOM 1509 CB THR A 102 15.579 -0.818 0.393 1.00 74.43 C ATOM 1510 OG1 THR A 102 15.312 -1.345 1.697 1.00 52.14 O ATOM 1511 CG2 THR A 102 16.987 -1.221 -0.054 1.00 74.11 C ATOM 0 H THR A 102 13.357 0.456 0.442 1.00 65.11 H new ATOM 0 HA THR A 102 16.123 1.151 1.091 1.00 12.11 H new ATOM 0 HB THR A 102 14.872 -1.233 -0.326 1.00 74.43 H new ATOM 0 HG1 THR A 102 16.158 -1.550 2.146 1.00 52.14 H new ATOM 0 HG21 THR A 102 17.073 -2.308 -0.049 1.00 74.11 H new ATOM 0 HG22 THR A 102 17.170 -0.847 -1.061 1.00 74.11 H new ATOM 0 HG23 THR A 102 17.722 -0.796 0.630 1.00 74.11 H new ATOM 1519 N LYS A 103 16.626 2.019 -1.158 1.00 40.22 N ATOM 1520 CA LYS A 103 16.961 2.554 -2.441 1.00 72.15 C ATOM 1521 C LYS A 103 17.749 1.453 -3.141 1.00 64.31 C ATOM 1522 O LYS A 103 18.845 1.091 -2.703 1.00 61.04 O ATOM 1523 CB LYS A 103 17.852 3.792 -2.244 1.00 64.41 C ATOM 1524 CG LYS A 103 17.818 4.917 -3.314 1.00 62.41 C ATOM 1525 CD LYS A 103 18.117 4.503 -4.754 1.00 32.40 C ATOM 1526 CE LYS A 103 16.886 3.960 -5.475 1.00 3.13 C ATOM 1527 NZ LYS A 103 17.162 3.676 -6.894 1.00 54.03 N ATOM 0 H LYS A 103 17.251 2.307 -0.405 1.00 40.22 H new ATOM 0 HA LYS A 103 16.084 2.851 -3.017 1.00 72.15 H new ATOM 0 HB2 LYS A 103 17.587 4.240 -1.286 1.00 64.41 H new ATOM 0 HB3 LYS A 103 18.883 3.447 -2.161 1.00 64.41 H new ATOM 0 HG2 LYS A 103 16.831 5.379 -3.291 1.00 62.41 H new ATOM 0 HG3 LYS A 103 18.536 5.684 -3.024 1.00 62.41 H new ATOM 0 HD2 LYS A 103 18.506 5.361 -5.302 1.00 32.40 H new ATOM 0 HD3 LYS A 103 18.899 3.744 -4.755 1.00 32.40 H new ATOM 0 HE2 LYS A 103 16.548 3.049 -4.981 1.00 3.13 H new ATOM 0 HE3 LYS A 103 16.073 4.683 -5.401 1.00 3.13 H new ATOM 0 HZ1 LYS A 103 16.271 3.690 -7.431 1.00 54.03 H new ATOM 0 HZ2 LYS A 103 17.806 4.399 -7.274 1.00 54.03 H new ATOM 0 HZ3 LYS A 103 17.603 2.738 -6.981 1.00 54.03 H new ATOM 1541 N LEU A 104 17.192 0.902 -4.178 1.00 50.15 N ATOM 1542 CA LEU A 104 17.822 -0.203 -4.864 1.00 41.15 C ATOM 1543 C LEU A 104 18.529 0.343 -6.081 1.00 4.45 C ATOM 1544 O LEU A 104 17.942 1.106 -6.863 1.00 4.32 O ATOM 1545 CB LEU A 104 16.737 -1.243 -5.247 1.00 33.42 C ATOM 1546 CG LEU A 104 17.188 -2.637 -5.752 1.00 23.13 C ATOM 1547 CD1 LEU A 104 17.873 -2.576 -7.099 1.00 33.45 C ATOM 1548 CD2 LEU A 104 18.087 -3.304 -4.732 1.00 45.11 C ATOM 0 H LEU A 104 16.299 1.196 -4.574 1.00 50.15 H new ATOM 0 HA LEU A 104 18.554 -0.703 -4.230 1.00 41.15 H new ATOM 0 HB2 LEU A 104 16.104 -1.397 -4.373 1.00 33.42 H new ATOM 0 HB3 LEU A 104 16.111 -0.798 -6.020 1.00 33.42 H new ATOM 0 HG LEU A 104 16.285 -3.234 -5.882 1.00 23.13 H new ATOM 0 HD11 LEU A 104 18.167 -3.580 -7.403 1.00 33.45 H new ATOM 0 HD12 LEU A 104 17.188 -2.159 -7.837 1.00 33.45 H new ATOM 0 HD13 LEU A 104 18.758 -1.944 -7.029 1.00 33.45 H new ATOM 0 HD21 LEU A 104 18.395 -4.282 -5.102 1.00 45.11 H new ATOM 0 HD22 LEU A 104 18.969 -2.686 -4.565 1.00 45.11 H new ATOM 0 HD23 LEU A 104 17.545 -3.425 -3.794 1.00 45.11 H new ATOM 1560 N GLU A 105 19.780 -0.009 -6.226 1.00 24.41 N ATOM 1561 CA GLU A 105 20.595 0.490 -7.304 1.00 61.10 C ATOM 1562 C GLU A 105 21.352 -0.652 -7.961 1.00 54.21 C ATOM 1563 O GLU A 105 21.558 -1.700 -7.351 1.00 72.41 O ATOM 1564 CB GLU A 105 21.610 1.471 -6.738 1.00 64.22 C ATOM 1565 CG GLU A 105 21.003 2.625 -5.982 1.00 23.11 C ATOM 1566 CD GLU A 105 22.039 3.507 -5.364 1.00 61.44 C ATOM 1567 OE1 GLU A 105 22.671 4.290 -6.093 1.00 54.33 O ATOM 1568 OE2 GLU A 105 22.258 3.421 -4.142 1.00 32.33 O ATOM 0 H GLU A 105 20.264 -0.651 -5.599 1.00 24.41 H new ATOM 0 HA GLU A 105 19.953 0.974 -8.040 1.00 61.10 H new ATOM 0 HB2 GLU A 105 22.287 0.933 -6.074 1.00 64.22 H new ATOM 0 HB3 GLU A 105 22.213 1.865 -7.556 1.00 64.22 H new ATOM 0 HG2 GLU A 105 20.384 3.214 -6.659 1.00 23.11 H new ATOM 0 HG3 GLU A 105 20.345 2.240 -5.203 1.00 23.11 H new ATOM 1575 N ILE A 106 21.753 -0.446 -9.191 1.00 21.33 N ATOM 1576 CA ILE A 106 22.585 -1.391 -9.889 1.00 74.50 C ATOM 1577 C ILE A 106 24.021 -0.904 -9.963 1.00 15.14 C ATOM 1578 O ILE A 106 24.304 0.194 -10.466 1.00 13.11 O ATOM 1579 CB ILE A 106 22.001 -1.829 -11.278 1.00 74.35 C ATOM 1580 CG1 ILE A 106 20.912 -2.899 -11.055 1.00 5.31 C ATOM 1581 CG2 ILE A 106 23.089 -2.352 -12.226 1.00 23.43 C ATOM 1582 CD1 ILE A 106 20.125 -3.251 -12.281 1.00 31.43 C ATOM 0 H ILE A 106 21.511 0.382 -9.735 1.00 21.33 H new ATOM 0 HA ILE A 106 22.591 -2.308 -9.299 1.00 74.50 H new ATOM 0 HB ILE A 106 21.565 -0.952 -11.757 1.00 74.35 H new ATOM 0 HG12 ILE A 106 21.383 -3.803 -10.669 1.00 5.31 H new ATOM 0 HG13 ILE A 106 20.225 -2.545 -10.287 1.00 5.31 H new ATOM 0 HG21 ILE A 106 22.636 -2.643 -13.174 1.00 23.43 H new ATOM 0 HG22 ILE A 106 23.826 -1.569 -12.401 1.00 23.43 H new ATOM 0 HG23 ILE A 106 23.578 -3.217 -11.777 1.00 23.43 H new ATOM 0 HD11 ILE A 106 19.383 -4.010 -12.032 1.00 31.43 H new ATOM 0 HD12 ILE A 106 19.621 -2.361 -12.658 1.00 31.43 H new ATOM 0 HD13 ILE A 106 20.797 -3.639 -13.046 1.00 31.43 H new ATOM 1594 N LYS A 107 24.913 -1.709 -9.420 1.00 61.14 N ATOM 1595 CA LYS A 107 26.307 -1.376 -9.358 1.00 11.12 C ATOM 1596 C LYS A 107 27.021 -1.830 -10.619 1.00 33.44 C ATOM 1597 O LYS A 107 26.936 -2.996 -11.021 1.00 24.35 O ATOM 1598 CB LYS A 107 26.966 -1.959 -8.088 1.00 23.15 C ATOM 1599 CG LYS A 107 26.980 -3.447 -8.021 1.00 51.00 C ATOM 1600 CD LYS A 107 27.543 -3.941 -6.716 1.00 45.44 C ATOM 1601 CE LYS A 107 27.611 -5.436 -6.734 1.00 45.13 C ATOM 1602 NZ LYS A 107 28.073 -6.020 -5.447 1.00 71.43 N ATOM 0 H LYS A 107 24.682 -2.614 -9.010 1.00 61.14 H new ATOM 0 HA LYS A 107 26.397 -0.291 -9.296 1.00 11.12 H new ATOM 0 HB2 LYS A 107 27.992 -1.597 -8.029 1.00 23.15 H new ATOM 0 HB3 LYS A 107 26.441 -1.574 -7.214 1.00 23.15 H new ATOM 0 HG2 LYS A 107 25.966 -3.826 -8.146 1.00 51.00 H new ATOM 0 HG3 LYS A 107 27.573 -3.843 -8.846 1.00 51.00 H new ATOM 0 HD2 LYS A 107 28.537 -3.523 -6.556 1.00 45.44 H new ATOM 0 HD3 LYS A 107 26.919 -3.605 -5.888 1.00 45.44 H new ATOM 0 HE2 LYS A 107 26.625 -5.835 -6.973 1.00 45.13 H new ATOM 0 HE3 LYS A 107 28.284 -5.752 -7.531 1.00 45.13 H new ATOM 0 HZ1 LYS A 107 28.098 -7.057 -5.525 1.00 71.43 H new ATOM 0 HZ2 LYS A 107 29.026 -5.666 -5.228 1.00 71.43 H new ATOM 0 HZ3 LYS A 107 27.418 -5.746 -4.687 1.00 71.43 H new ATOM 1616 N ARG A 108 27.670 -0.904 -11.244 1.00 2.44 N ATOM 1617 CA ARG A 108 28.425 -1.139 -12.450 1.00 5.43 C ATOM 1618 C ARG A 108 29.474 -0.052 -12.617 1.00 63.35 C ATOM 1619 O ARG A 108 29.749 0.703 -11.657 1.00 2.23 O ATOM 1620 CB ARG A 108 27.493 -1.185 -13.664 1.00 32.01 C ATOM 1621 CG ARG A 108 28.205 -1.361 -14.991 1.00 12.12 C ATOM 1622 CD ARG A 108 27.213 -1.471 -16.135 1.00 24.33 C ATOM 1623 NE ARG A 108 26.356 -2.657 -15.993 1.00 61.41 N ATOM 1624 CZ ARG A 108 25.153 -2.813 -16.560 1.00 12.13 C ATOM 1625 NH1 ARG A 108 24.618 -1.839 -17.275 1.00 3.33 N ATOM 1626 NH2 ARG A 108 24.489 -3.943 -16.399 1.00 1.55 N ATOM 0 H ARG A 108 27.696 0.066 -10.929 1.00 2.44 H new ATOM 0 HA ARG A 108 28.928 -2.103 -12.374 1.00 5.43 H new ATOM 0 HB2 ARG A 108 26.785 -2.004 -13.533 1.00 32.01 H new ATOM 0 HB3 ARG A 108 26.912 -0.263 -13.696 1.00 32.01 H new ATOM 0 HG2 ARG A 108 28.872 -0.516 -15.164 1.00 12.12 H new ATOM 0 HG3 ARG A 108 28.826 -2.256 -14.958 1.00 12.12 H new ATOM 0 HD2 ARG A 108 26.593 -0.575 -16.168 1.00 24.33 H new ATOM 0 HD3 ARG A 108 27.752 -1.521 -17.081 1.00 24.33 H new ATOM 0 HE ARG A 108 26.706 -3.422 -15.416 1.00 61.41 H new ATOM 0 HH11 ARG A 108 25.122 -0.961 -17.398 1.00 3.33 H new ATOM 0 HH12 ARG A 108 23.701 -1.965 -17.704 1.00 3.33 H new ATOM 0 HH21 ARG A 108 24.892 -4.697 -15.843 1.00 1.55 H new ATOM 0 HH22 ARG A 108 23.573 -4.062 -16.831 1.00 1.55 H new ATOM 1641 N ASP B 201 7.670 12.234 7.711 1.00 24.42 N ATOM 1642 CA ASP B 201 6.378 11.636 7.438 1.00 64.32 C ATOM 1643 C ASP B 201 5.393 12.692 7.027 1.00 74.43 C ATOM 1644 O ASP B 201 5.448 13.828 7.500 1.00 55.10 O ATOM 1645 CB ASP B 201 5.813 10.909 8.680 1.00 3.13 C ATOM 1646 CG ASP B 201 5.480 11.847 9.842 1.00 74.15 C ATOM 1647 OD1 ASP B 201 6.377 12.125 10.667 1.00 43.52 O ATOM 1648 OD2 ASP B 201 4.312 12.302 9.955 1.00 11.45 O ATOM 0 HA ASP B 201 6.524 10.914 6.635 1.00 64.32 H new ATOM 0 HB2 ASP B 201 4.913 10.365 8.394 1.00 3.13 H new ATOM 0 HB3 ASP B 201 6.538 10.169 9.018 1.00 3.13 H new ATOM 1653 N ILE B 202 4.562 12.346 6.104 1.00 13.15 N ATOM 1654 CA ILE B 202 3.430 13.150 5.768 1.00 30.44 C ATOM 1655 C ILE B 202 2.261 12.458 6.395 1.00 75.11 C ATOM 1656 O ILE B 202 1.906 11.350 5.985 1.00 34.22 O ATOM 1657 CB ILE B 202 3.226 13.264 4.244 1.00 51.13 C ATOM 1658 CG1 ILE B 202 4.450 13.908 3.576 1.00 42.45 C ATOM 1659 CG2 ILE B 202 1.962 14.074 3.936 1.00 45.04 C ATOM 1660 CD1 ILE B 202 4.404 13.870 2.066 1.00 51.33 C ATOM 0 H ILE B 202 4.647 11.491 5.555 1.00 13.15 H new ATOM 0 HA ILE B 202 3.560 14.171 6.127 1.00 30.44 H new ATOM 0 HB ILE B 202 3.106 12.259 3.839 1.00 51.13 H new ATOM 0 HG12 ILE B 202 4.529 14.945 3.903 1.00 42.45 H new ATOM 0 HG13 ILE B 202 5.351 13.397 3.917 1.00 42.45 H new ATOM 0 HG21 ILE B 202 1.830 14.146 2.856 1.00 45.04 H new ATOM 0 HG22 ILE B 202 1.096 13.578 4.375 1.00 45.04 H new ATOM 0 HG23 ILE B 202 2.059 15.074 4.358 1.00 45.04 H new ATOM 0 HD11 ILE B 202 5.300 14.342 1.663 1.00 51.33 H new ATOM 0 HD12 ILE B 202 4.357 12.834 1.729 1.00 51.33 H new ATOM 0 HD13 ILE B 202 3.522 14.406 1.715 1.00 51.33 H new ATOM 1672 N GLN B 203 1.700 13.062 7.401 1.00 13.23 N ATOM 1673 CA GLN B 203 0.649 12.431 8.137 1.00 31.23 C ATOM 1674 C GLN B 203 -0.661 12.542 7.394 1.00 23.10 C ATOM 1675 O GLN B 203 -0.945 13.563 6.776 1.00 52.41 O ATOM 1676 CB GLN B 203 0.516 13.058 9.507 1.00 0.35 C ATOM 1677 CG GLN B 203 -0.306 12.227 10.449 1.00 70.53 C ATOM 1678 CD GLN B 203 -0.377 12.805 11.830 1.00 25.35 C ATOM 1679 OE1 GLN B 203 -1.266 13.592 12.136 1.00 35.02 O ATOM 1680 NE2 GLN B 203 0.540 12.420 12.674 1.00 51.33 N ATOM 0 H GLN B 203 1.955 13.993 7.730 1.00 13.23 H new ATOM 0 HA GLN B 203 0.899 11.376 8.252 1.00 31.23 H new ATOM 0 HB2 GLN B 203 1.509 13.206 9.932 1.00 0.35 H new ATOM 0 HB3 GLN B 203 0.061 14.044 9.408 1.00 0.35 H new ATOM 0 HG2 GLN B 203 -1.316 12.127 10.050 1.00 70.53 H new ATOM 0 HG3 GLN B 203 0.116 11.223 10.502 1.00 70.53 H new ATOM 0 HE21 GLN B 203 1.262 11.763 12.378 1.00 51.33 H new ATOM 0 HE22 GLN B 203 0.535 12.776 13.630 1.00 51.33 H new ATOM 1689 N MET B 204 -1.434 11.497 7.447 1.00 73.04 N ATOM 1690 CA MET B 204 -2.714 11.448 6.790 1.00 25.31 C ATOM 1691 C MET B 204 -3.780 11.259 7.857 1.00 24.31 C ATOM 1692 O MET B 204 -3.629 10.416 8.741 1.00 72.13 O ATOM 1693 CB MET B 204 -2.755 10.287 5.784 1.00 72.22 C ATOM 1694 CG MET B 204 -1.641 10.315 4.741 1.00 12.22 C ATOM 1695 SD MET B 204 -1.629 11.816 3.732 1.00 14.51 S ATOM 1696 CE MET B 204 -3.194 11.692 2.884 1.00 1.11 C ATOM 0 H MET B 204 -1.194 10.644 7.952 1.00 73.04 H new ATOM 0 HA MET B 204 -2.890 12.372 6.240 1.00 25.31 H new ATOM 0 HB2 MET B 204 -2.700 9.346 6.332 1.00 72.22 H new ATOM 0 HB3 MET B 204 -3.717 10.301 5.271 1.00 72.22 H new ATOM 0 HG2 MET B 204 -0.680 10.219 5.246 1.00 12.22 H new ATOM 0 HG3 MET B 204 -1.745 9.449 4.087 1.00 12.22 H new ATOM 0 HE1 MET B 204 -3.059 11.945 1.832 1.00 1.11 H new ATOM 0 HE2 MET B 204 -3.573 10.673 2.967 1.00 1.11 H new ATOM 0 HE3 MET B 204 -3.907 12.382 3.334 1.00 1.11 H new ATOM 1706 N THR B 205 -4.801 12.056 7.828 1.00 13.52 N ATOM 1707 CA THR B 205 -5.863 11.940 8.808 1.00 4.42 C ATOM 1708 C THR B 205 -7.213 11.705 8.104 1.00 12.35 C ATOM 1709 O THR B 205 -7.585 12.477 7.222 1.00 52.35 O ATOM 1710 CB THR B 205 -5.937 13.232 9.658 1.00 71.30 C ATOM 1711 OG1 THR B 205 -4.624 13.545 10.165 1.00 72.50 O ATOM 1712 CG2 THR B 205 -6.871 13.036 10.843 1.00 5.30 C ATOM 0 H THR B 205 -4.933 12.798 7.141 1.00 13.52 H new ATOM 0 HA THR B 205 -5.650 11.092 9.458 1.00 4.42 H new ATOM 0 HB THR B 205 -6.310 14.040 9.028 1.00 71.30 H new ATOM 0 HG1 THR B 205 -4.667 14.364 10.702 1.00 72.50 H new ATOM 0 HG21 THR B 205 -6.912 13.954 11.430 1.00 5.30 H new ATOM 0 HG22 THR B 205 -7.870 12.792 10.482 1.00 5.30 H new ATOM 0 HG23 THR B 205 -6.501 12.222 11.467 1.00 5.30 H new ATOM 1720 N GLN B 206 -7.925 10.637 8.476 1.00 65.44 N ATOM 1721 CA GLN B 206 -9.235 10.356 7.895 1.00 50.30 C ATOM 1722 C GLN B 206 -10.332 10.684 8.849 1.00 13.32 C ATOM 1723 O GLN B 206 -10.309 10.292 10.018 1.00 70.31 O ATOM 1724 CB GLN B 206 -9.411 8.907 7.450 1.00 70.13 C ATOM 1725 CG GLN B 206 -8.516 8.475 6.335 1.00 12.11 C ATOM 1726 CD GLN B 206 -8.827 7.079 5.866 1.00 45.24 C ATOM 1727 OE1 GLN B 206 -9.614 6.871 4.968 1.00 12.41 O ATOM 1728 NE2 GLN B 206 -8.217 6.119 6.475 1.00 5.34 N ATOM 0 H GLN B 206 -7.616 9.959 9.172 1.00 65.44 H new ATOM 0 HA GLN B 206 -9.289 10.992 7.011 1.00 50.30 H new ATOM 0 HB2 GLN B 206 -9.238 8.256 8.307 1.00 70.13 H new ATOM 0 HB3 GLN B 206 -10.446 8.761 7.142 1.00 70.13 H new ATOM 0 HG2 GLN B 206 -8.618 9.168 5.500 1.00 12.11 H new ATOM 0 HG3 GLN B 206 -7.478 8.523 6.665 1.00 12.11 H new ATOM 0 HE21 GLN B 206 -7.560 6.328 7.227 1.00 5.34 H new ATOM 0 HE22 GLN B 206 -8.391 5.151 6.204 1.00 5.34 H new ATOM 1737 N SER B 207 -11.264 11.421 8.378 1.00 52.14 N ATOM 1738 CA SER B 207 -12.424 11.735 9.116 1.00 2.33 C ATOM 1739 C SER B 207 -13.618 11.713 8.158 1.00 5.33 C ATOM 1740 O SER B 207 -13.538 12.271 7.066 1.00 52.31 O ATOM 1741 CB SER B 207 -12.250 13.083 9.793 1.00 20.20 C ATOM 1742 OG SER B 207 -11.068 13.070 10.608 1.00 42.21 O ATOM 0 H SER B 207 -11.240 11.833 7.445 1.00 52.14 H new ATOM 0 HA SER B 207 -12.601 11.004 9.905 1.00 2.33 H new ATOM 0 HB2 SER B 207 -12.177 13.870 9.043 1.00 20.20 H new ATOM 0 HB3 SER B 207 -13.123 13.308 10.406 1.00 20.20 H new ATOM 0 HG SER B 207 -10.960 13.942 11.041 1.00 42.21 H new ATOM 1748 N PRO B 208 -14.712 11.040 8.514 1.00 71.13 N ATOM 1749 CA PRO B 208 -14.842 10.330 9.788 1.00 74.11 C ATOM 1750 C PRO B 208 -13.992 9.056 9.838 1.00 35.40 C ATOM 1751 O PRO B 208 -13.705 8.441 8.805 1.00 53.15 O ATOM 1752 CB PRO B 208 -16.330 9.986 9.849 1.00 4.45 C ATOM 1753 CG PRO B 208 -16.753 9.899 8.426 1.00 11.55 C ATOM 1754 CD PRO B 208 -15.920 10.901 7.680 1.00 64.24 C ATOM 0 HA PRO B 208 -14.494 10.932 10.628 1.00 74.11 H new ATOM 0 HB2 PRO B 208 -16.498 9.044 10.371 1.00 4.45 H new ATOM 0 HB3 PRO B 208 -16.892 10.751 10.384 1.00 4.45 H new ATOM 0 HG2 PRO B 208 -16.597 8.894 8.034 1.00 11.55 H new ATOM 0 HG3 PRO B 208 -17.815 10.120 8.321 1.00 11.55 H new ATOM 0 HD2 PRO B 208 -15.676 10.552 6.677 1.00 64.24 H new ATOM 0 HD3 PRO B 208 -16.441 11.852 7.568 1.00 64.24 H new ATOM 1762 N SER B 209 -13.579 8.681 11.030 1.00 31.23 N ATOM 1763 CA SER B 209 -12.770 7.496 11.235 1.00 13.25 C ATOM 1764 C SER B 209 -13.623 6.215 11.147 1.00 55.03 C ATOM 1765 O SER B 209 -13.110 5.098 11.101 1.00 0.00 O ATOM 1766 CB SER B 209 -12.047 7.618 12.571 1.00 43.20 C ATOM 1767 OG SER B 209 -12.964 7.971 13.599 1.00 63.44 O ATOM 0 H SER B 209 -13.795 9.190 11.887 1.00 31.23 H new ATOM 0 HA SER B 209 -12.026 7.418 10.443 1.00 13.25 H new ATOM 0 HB2 SER B 209 -11.561 6.674 12.817 1.00 43.20 H new ATOM 0 HB3 SER B 209 -11.262 8.371 12.500 1.00 43.20 H new ATOM 0 HG SER B 209 -12.487 8.044 14.452 1.00 63.44 H new ATOM 1773 N SER B 210 -14.920 6.398 11.124 1.00 23.41 N ATOM 1774 CA SER B 210 -15.854 5.325 10.945 1.00 63.40 C ATOM 1775 C SER B 210 -17.152 5.896 10.406 1.00 31.44 C ATOM 1776 O SER B 210 -17.562 6.994 10.807 1.00 73.00 O ATOM 1777 CB SER B 210 -16.064 4.564 12.262 1.00 14.33 C ATOM 1778 OG SER B 210 -16.436 5.446 13.309 1.00 55.10 O ATOM 0 H SER B 210 -15.359 7.313 11.231 1.00 23.41 H new ATOM 0 HA SER B 210 -15.463 4.604 10.227 1.00 63.40 H new ATOM 0 HB2 SER B 210 -16.837 3.807 12.129 1.00 14.33 H new ATOM 0 HB3 SER B 210 -15.147 4.040 12.533 1.00 14.33 H new ATOM 0 HG SER B 210 -16.565 4.936 14.136 1.00 55.10 H new ATOM 1784 N LEU B 211 -17.781 5.194 9.500 1.00 55.30 N ATOM 1785 CA LEU B 211 -18.980 5.690 8.879 1.00 21.23 C ATOM 1786 C LEU B 211 -19.914 4.540 8.574 1.00 34.40 C ATOM 1787 O LEU B 211 -19.509 3.531 7.997 1.00 70.10 O ATOM 1788 CB LEU B 211 -18.598 6.506 7.605 1.00 41.12 C ATOM 1789 CG LEU B 211 -19.713 7.252 6.824 1.00 14.53 C ATOM 1790 CD1 LEU B 211 -19.082 8.230 5.864 1.00 55.43 C ATOM 1791 CD2 LEU B 211 -20.592 6.295 6.023 1.00 10.11 C ATOM 0 H LEU B 211 -17.482 4.275 9.175 1.00 55.30 H new ATOM 0 HA LEU B 211 -19.511 6.361 9.555 1.00 21.23 H new ATOM 0 HB2 LEU B 211 -17.852 7.245 7.899 1.00 41.12 H new ATOM 0 HB3 LEU B 211 -18.112 5.822 6.910 1.00 41.12 H new ATOM 0 HG LEU B 211 -20.337 7.763 7.557 1.00 14.53 H new ATOM 0 HD11 LEU B 211 -19.863 8.755 5.314 1.00 55.43 H new ATOM 0 HD12 LEU B 211 -18.482 8.951 6.420 1.00 55.43 H new ATOM 0 HD13 LEU B 211 -18.444 7.692 5.163 1.00 55.43 H new ATOM 0 HD21 LEU B 211 -21.358 6.862 5.493 1.00 10.11 H new ATOM 0 HD22 LEU B 211 -19.978 5.753 5.303 1.00 10.11 H new ATOM 0 HD23 LEU B 211 -21.069 5.586 6.700 1.00 10.11 H new ATOM 1803 N SER B 212 -21.144 4.688 8.987 1.00 61.21 N ATOM 1804 CA SER B 212 -22.151 3.711 8.737 1.00 34.01 C ATOM 1805 C SER B 212 -23.231 4.296 7.820 1.00 63.34 C ATOM 1806 O SER B 212 -23.887 5.277 8.174 1.00 54.52 O ATOM 1807 CB SER B 212 -22.744 3.260 10.064 1.00 70.34 C ATOM 1808 OG SER B 212 -23.228 4.382 10.804 1.00 75.32 O ATOM 0 H SER B 212 -21.471 5.500 9.511 1.00 61.21 H new ATOM 0 HA SER B 212 -21.717 2.847 8.234 1.00 34.01 H new ATOM 0 HB2 SER B 212 -23.557 2.557 9.885 1.00 70.34 H new ATOM 0 HB3 SER B 212 -21.988 2.732 10.646 1.00 70.34 H new ATOM 0 HG SER B 212 -23.630 5.031 10.189 1.00 75.32 H new ATOM 1814 N ALA B 213 -23.404 3.710 6.667 1.00 42.22 N ATOM 1815 CA ALA B 213 -24.390 4.174 5.698 1.00 4.13 C ATOM 1816 C ALA B 213 -25.187 2.989 5.204 1.00 63.13 C ATOM 1817 O ALA B 213 -24.702 1.886 5.251 1.00 10.23 O ATOM 1818 CB ALA B 213 -23.708 4.887 4.544 1.00 43.40 C ATOM 0 H ALA B 213 -22.871 2.896 6.362 1.00 42.22 H new ATOM 0 HA ALA B 213 -25.064 4.887 6.174 1.00 4.13 H new ATOM 0 HB1 ALA B 213 -24.459 5.226 3.831 1.00 43.40 H new ATOM 0 HB2 ALA B 213 -23.154 5.746 4.923 1.00 43.40 H new ATOM 0 HB3 ALA B 213 -23.020 4.202 4.048 1.00 43.40 H new ATOM 1824 N SER B 214 -26.401 3.198 4.770 1.00 52.11 N ATOM 1825 CA SER B 214 -27.222 2.086 4.329 1.00 71.52 C ATOM 1826 C SER B 214 -26.908 1.740 2.866 1.00 34.22 C ATOM 1827 O SER B 214 -26.282 2.552 2.161 1.00 64.32 O ATOM 1828 CB SER B 214 -28.725 2.379 4.560 1.00 54.43 C ATOM 1829 OG SER B 214 -29.156 3.594 3.949 1.00 45.30 O ATOM 0 H SER B 214 -26.846 4.114 4.710 1.00 52.11 H new ATOM 0 HA SER B 214 -26.981 1.208 4.929 1.00 71.52 H new ATOM 0 HB2 SER B 214 -29.316 1.552 4.167 1.00 54.43 H new ATOM 0 HB3 SER B 214 -28.919 2.429 5.631 1.00 54.43 H new ATOM 0 HG SER B 214 -28.400 4.016 3.490 1.00 45.30 H new ATOM 1835 N VAL B 215 -27.311 0.548 2.419 1.00 23.23 N ATOM 1836 CA VAL B 215 -27.048 0.104 1.045 1.00 45.40 C ATOM 1837 C VAL B 215 -27.573 1.114 0.037 1.00 23.12 C ATOM 1838 O VAL B 215 -28.756 1.482 0.060 1.00 51.40 O ATOM 1839 CB VAL B 215 -27.662 -1.298 0.749 1.00 51.52 C ATOM 1840 CG1 VAL B 215 -27.423 -1.708 -0.704 1.00 25.41 C ATOM 1841 CG2 VAL B 215 -27.055 -2.330 1.663 1.00 31.22 C ATOM 0 H VAL B 215 -27.821 -0.128 2.988 1.00 23.23 H new ATOM 0 HA VAL B 215 -25.965 0.024 0.947 1.00 45.40 H new ATOM 0 HB VAL B 215 -28.736 -1.237 0.922 1.00 51.52 H new ATOM 0 HG11 VAL B 215 -27.862 -2.690 -0.882 1.00 25.41 H new ATOM 0 HG12 VAL B 215 -27.885 -0.978 -1.369 1.00 25.41 H new ATOM 0 HG13 VAL B 215 -26.351 -1.749 -0.899 1.00 25.41 H new ATOM 0 HG21 VAL B 215 -27.490 -3.306 1.449 1.00 31.22 H new ATOM 0 HG22 VAL B 215 -25.978 -2.370 1.502 1.00 31.22 H new ATOM 0 HG23 VAL B 215 -27.258 -2.062 2.700 1.00 31.22 H new ATOM 1851 N GLY B 216 -26.695 1.566 -0.814 1.00 5.54 N ATOM 1852 CA GLY B 216 -27.063 2.522 -1.831 1.00 42.12 C ATOM 1853 C GLY B 216 -26.679 3.950 -1.492 1.00 21.42 C ATOM 1854 O GLY B 216 -26.726 4.818 -2.365 1.00 3.45 O ATOM 0 H GLY B 216 -25.714 1.289 -0.827 1.00 5.54 H new ATOM 0 HA2 GLY B 216 -26.588 2.241 -2.771 1.00 42.12 H new ATOM 0 HA3 GLY B 216 -28.140 2.473 -1.991 1.00 42.12 H new ATOM 1858 N ASP B 217 -26.301 4.205 -0.243 1.00 14.13 N ATOM 1859 CA ASP B 217 -25.892 5.563 0.152 1.00 71.21 C ATOM 1860 C ASP B 217 -24.524 5.892 -0.356 1.00 3.13 C ATOM 1861 O ASP B 217 -23.723 4.998 -0.653 1.00 75.34 O ATOM 1862 CB ASP B 217 -25.910 5.811 1.673 1.00 22.31 C ATOM 1863 CG ASP B 217 -27.274 5.864 2.301 1.00 44.41 C ATOM 1864 OD1 ASP B 217 -28.212 6.407 1.681 1.00 3.23 O ATOM 1865 OD2 ASP B 217 -27.417 5.426 3.471 1.00 64.02 O ATOM 0 H ASP B 217 -26.267 3.511 0.504 1.00 14.13 H new ATOM 0 HA ASP B 217 -26.641 6.212 -0.302 1.00 71.21 H new ATOM 0 HB2 ASP B 217 -25.335 5.023 2.159 1.00 22.31 H new ATOM 0 HB3 ASP B 217 -25.398 6.751 1.877 1.00 22.31 H new ATOM 1870 N ARG B 218 -24.256 7.169 -0.466 1.00 54.11 N ATOM 1871 CA ARG B 218 -22.973 7.633 -0.863 1.00 14.43 C ATOM 1872 C ARG B 218 -22.124 7.861 0.382 1.00 62.45 C ATOM 1873 O ARG B 218 -22.522 8.593 1.297 1.00 31.20 O ATOM 1874 CB ARG B 218 -23.081 8.926 -1.672 1.00 25.51 C ATOM 1875 CG ARG B 218 -21.743 9.422 -2.189 1.00 64.21 C ATOM 1876 CD ARG B 218 -21.859 10.734 -2.945 1.00 11.33 C ATOM 1877 NE ARG B 218 -22.393 11.814 -2.109 1.00 2.04 N ATOM 1878 CZ ARG B 218 -22.317 13.116 -2.398 1.00 1.41 C ATOM 1879 NH1 ARG B 218 -21.676 13.528 -3.489 1.00 51.25 N ATOM 1880 NH2 ARG B 218 -22.863 14.000 -1.585 1.00 75.43 N ATOM 0 H ARG B 218 -24.932 7.910 -0.279 1.00 54.11 H new ATOM 0 HA ARG B 218 -22.505 6.882 -1.500 1.00 14.43 H new ATOM 0 HB2 ARG B 218 -23.752 8.764 -2.516 1.00 25.51 H new ATOM 0 HB3 ARG B 218 -23.532 9.699 -1.050 1.00 25.51 H new ATOM 0 HG2 ARG B 218 -21.058 9.549 -1.351 1.00 64.21 H new ATOM 0 HG3 ARG B 218 -21.308 8.667 -2.844 1.00 64.21 H new ATOM 0 HD2 ARG B 218 -20.877 11.021 -3.322 1.00 11.33 H new ATOM 0 HD3 ARG B 218 -22.505 10.595 -3.812 1.00 11.33 H new ATOM 0 HE ARG B 218 -22.858 11.551 -1.240 1.00 2.04 H new ATOM 0 HH11 ARG B 218 -21.239 12.848 -4.111 1.00 51.25 H new ATOM 0 HH12 ARG B 218 -21.622 14.524 -3.703 1.00 51.25 H new ATOM 0 HH21 ARG B 218 -23.341 13.688 -0.739 1.00 75.43 H new ATOM 0 HH22 ARG B 218 -22.807 14.995 -1.802 1.00 75.43 H new ATOM 1894 N VAL B 219 -20.997 7.224 0.423 1.00 55.50 N ATOM 1895 CA VAL B 219 -20.064 7.338 1.524 1.00 61.34 C ATOM 1896 C VAL B 219 -19.135 8.502 1.271 1.00 22.24 C ATOM 1897 O VAL B 219 -18.644 8.660 0.161 1.00 33.03 O ATOM 1898 CB VAL B 219 -19.214 6.050 1.648 1.00 53.14 C ATOM 1899 CG1 VAL B 219 -18.190 6.158 2.768 1.00 75.22 C ATOM 1900 CG2 VAL B 219 -20.102 4.844 1.856 1.00 45.43 C ATOM 0 H VAL B 219 -20.684 6.595 -0.317 1.00 55.50 H new ATOM 0 HA VAL B 219 -20.628 7.490 2.444 1.00 61.34 H new ATOM 0 HB VAL B 219 -18.668 5.926 0.713 1.00 53.14 H new ATOM 0 HG11 VAL B 219 -17.613 5.235 2.824 1.00 75.22 H new ATOM 0 HG12 VAL B 219 -17.519 6.994 2.568 1.00 75.22 H new ATOM 0 HG13 VAL B 219 -18.703 6.323 3.715 1.00 75.22 H new ATOM 0 HG21 VAL B 219 -19.486 3.949 1.941 1.00 45.43 H new ATOM 0 HG22 VAL B 219 -20.683 4.973 2.770 1.00 45.43 H new ATOM 0 HG23 VAL B 219 -20.779 4.740 1.008 1.00 45.43 H new ATOM 1910 N THR B 220 -18.908 9.310 2.269 1.00 15.54 N ATOM 1911 CA THR B 220 -17.980 10.394 2.136 1.00 64.22 C ATOM 1912 C THR B 220 -16.892 10.279 3.206 1.00 63.13 C ATOM 1913 O THR B 220 -17.165 10.342 4.402 1.00 23.30 O ATOM 1914 CB THR B 220 -18.708 11.758 2.264 1.00 3.44 C ATOM 1915 OG1 THR B 220 -19.739 11.847 1.263 1.00 71.00 O ATOM 1916 CG2 THR B 220 -17.733 12.920 2.083 1.00 42.13 C ATOM 0 H THR B 220 -19.354 9.237 3.183 1.00 15.54 H new ATOM 0 HA THR B 220 -17.522 10.340 1.148 1.00 64.22 H new ATOM 0 HB THR B 220 -19.143 11.821 3.261 1.00 3.44 H new ATOM 0 HG1 THR B 220 -20.200 12.708 1.344 1.00 71.00 H new ATOM 0 HG21 THR B 220 -18.270 13.864 2.178 1.00 42.13 H new ATOM 0 HG22 THR B 220 -16.957 12.866 2.846 1.00 42.13 H new ATOM 0 HG23 THR B 220 -17.275 12.860 1.096 1.00 42.13 H new ATOM 1924 N ILE B 221 -15.676 10.102 2.764 1.00 54.25 N ATOM 1925 CA ILE B 221 -14.532 10.027 3.637 1.00 75.52 C ATOM 1926 C ILE B 221 -13.578 11.138 3.255 1.00 33.40 C ATOM 1927 O ILE B 221 -13.189 11.247 2.094 1.00 74.34 O ATOM 1928 CB ILE B 221 -13.789 8.654 3.487 1.00 64.24 C ATOM 1929 CG1 ILE B 221 -14.700 7.476 3.896 1.00 11.52 C ATOM 1930 CG2 ILE B 221 -12.502 8.652 4.308 1.00 72.52 C ATOM 1931 CD1 ILE B 221 -14.104 6.087 3.665 1.00 30.54 C ATOM 0 H ILE B 221 -15.447 10.004 1.775 1.00 54.25 H new ATOM 0 HA ILE B 221 -14.868 10.124 4.669 1.00 75.52 H new ATOM 0 HB ILE B 221 -13.531 8.524 2.436 1.00 64.24 H new ATOM 0 HG12 ILE B 221 -14.947 7.578 4.953 1.00 11.52 H new ATOM 0 HG13 ILE B 221 -15.635 7.550 3.341 1.00 11.52 H new ATOM 0 HG21 ILE B 221 -11.999 7.692 4.193 1.00 72.52 H new ATOM 0 HG22 ILE B 221 -11.846 9.450 3.959 1.00 72.52 H new ATOM 0 HG23 ILE B 221 -12.741 8.813 5.359 1.00 72.52 H new ATOM 0 HD11 ILE B 221 -14.818 5.327 3.983 1.00 30.54 H new ATOM 0 HD12 ILE B 221 -13.884 5.957 2.605 1.00 30.54 H new ATOM 0 HD13 ILE B 221 -13.185 5.985 4.242 1.00 30.54 H new ATOM 1943 N THR B 222 -13.214 11.955 4.187 1.00 72.42 N ATOM 1944 CA THR B 222 -12.276 12.990 3.904 1.00 44.41 C ATOM 1945 C THR B 222 -10.952 12.704 4.580 1.00 24.03 C ATOM 1946 O THR B 222 -10.908 12.364 5.763 1.00 24.04 O ATOM 1947 CB THR B 222 -12.825 14.412 4.246 1.00 3.25 C ATOM 1948 OG1 THR B 222 -13.352 14.458 5.586 1.00 52.33 O ATOM 1949 CG2 THR B 222 -13.911 14.821 3.265 1.00 71.23 C ATOM 0 H THR B 222 -13.551 11.926 5.149 1.00 72.42 H new ATOM 0 HA THR B 222 -12.108 12.996 2.827 1.00 44.41 H new ATOM 0 HB THR B 222 -11.991 15.109 4.171 1.00 3.25 H new ATOM 0 HG1 THR B 222 -13.047 13.671 6.085 1.00 52.33 H new ATOM 0 HG21 THR B 222 -14.279 15.814 3.522 1.00 71.23 H new ATOM 0 HG22 THR B 222 -13.502 14.836 2.255 1.00 71.23 H new ATOM 0 HG23 THR B 222 -14.733 14.106 3.313 1.00 71.23 H new ATOM 1957 N CYS B 223 -9.897 12.800 3.827 1.00 21.42 N ATOM 1958 CA CYS B 223 -8.580 12.566 4.335 1.00 62.51 C ATOM 1959 C CYS B 223 -7.767 13.800 4.119 1.00 60.40 C ATOM 1960 O CYS B 223 -7.840 14.420 3.058 1.00 54.15 O ATOM 1961 CB CYS B 223 -7.916 11.350 3.658 1.00 24.10 C ATOM 1962 SG CYS B 223 -6.193 11.041 4.215 1.00 44.33 S ATOM 0 H CYS B 223 -9.927 13.044 2.837 1.00 21.42 H new ATOM 0 HA CYS B 223 -8.642 12.338 5.399 1.00 62.51 H new ATOM 0 HB2 CYS B 223 -8.517 10.462 3.856 1.00 24.10 H new ATOM 0 HB3 CYS B 223 -7.917 11.501 2.579 1.00 24.10 H new ATOM 1967 N GLN B 224 -7.022 14.169 5.110 1.00 41.10 N ATOM 1968 CA GLN B 224 -6.235 15.359 5.056 1.00 22.21 C ATOM 1969 C GLN B 224 -4.773 15.044 5.246 1.00 42.34 C ATOM 1970 O GLN B 224 -4.388 14.386 6.227 1.00 45.34 O ATOM 1971 CB GLN B 224 -6.686 16.329 6.123 1.00 33.34 C ATOM 1972 CG GLN B 224 -8.131 16.761 6.012 1.00 31.55 C ATOM 1973 CD GLN B 224 -8.533 17.708 7.121 1.00 64.23 C ATOM 1974 OE1 GLN B 224 -7.599 18.484 7.596 1.00 42.12 O flip ATOM 1975 NE2 GLN B 224 -9.689 17.738 7.538 1.00 2.51 N flip ATOM 0 H GLN B 224 -6.942 13.651 5.985 1.00 41.10 H new ATOM 0 HA GLN B 224 -6.371 15.811 4.074 1.00 22.21 H new ATOM 0 HB2 GLN B 224 -6.532 15.871 7.100 1.00 33.34 H new ATOM 0 HB3 GLN B 224 -6.052 17.214 6.082 1.00 33.34 H new ATOM 0 HG2 GLN B 224 -8.290 17.245 5.048 1.00 31.55 H new ATOM 0 HG3 GLN B 224 -8.774 15.881 6.037 1.00 31.55 H new ATOM 0 HE21 GLN B 224 -10.391 17.114 7.140 1.00 2.51 H new ATOM 0 HE22 GLN B 224 -9.946 18.387 8.282 1.00 2.51 H new ATOM 1984 N ALA B 225 -3.975 15.500 4.328 1.00 34.52 N ATOM 1985 CA ALA B 225 -2.550 15.328 4.382 1.00 52.11 C ATOM 1986 C ALA B 225 -1.918 16.477 5.162 1.00 45.44 C ATOM 1987 O ALA B 225 -2.298 17.644 4.986 1.00 54.02 O ATOM 1988 CB ALA B 225 -1.979 15.268 2.972 1.00 20.43 C ATOM 0 H ALA B 225 -4.298 16.011 3.506 1.00 34.52 H new ATOM 0 HA ALA B 225 -2.322 14.391 4.891 1.00 52.11 H new ATOM 0 HB1 ALA B 225 -0.898 15.137 3.022 1.00 20.43 H new ATOM 0 HB2 ALA B 225 -2.421 14.428 2.436 1.00 20.43 H new ATOM 0 HB3 ALA B 225 -2.208 16.195 2.447 1.00 20.43 H new ATOM 1994 N SER B 226 -0.981 16.142 6.030 1.00 74.44 N ATOM 1995 CA SER B 226 -0.262 17.110 6.842 1.00 22.35 C ATOM 1996 C SER B 226 0.593 18.034 5.958 1.00 21.34 C ATOM 1997 O SER B 226 0.960 19.138 6.353 1.00 31.30 O ATOM 1998 CB SER B 226 0.618 16.367 7.860 1.00 61.04 C ATOM 1999 OG SER B 226 1.286 17.257 8.741 1.00 15.40 O ATOM 0 H SER B 226 -0.693 15.177 6.194 1.00 74.44 H new ATOM 0 HA SER B 226 -0.980 17.732 7.376 1.00 22.35 H new ATOM 0 HB2 SER B 226 0.000 15.681 8.439 1.00 61.04 H new ATOM 0 HB3 SER B 226 1.354 15.763 7.329 1.00 61.04 H new ATOM 0 HG SER B 226 1.833 16.744 9.372 1.00 15.40 H new ATOM 2005 N GLN B 227 0.896 17.575 4.772 1.00 5.43 N ATOM 2006 CA GLN B 227 1.666 18.323 3.820 1.00 11.32 C ATOM 2007 C GLN B 227 1.115 18.001 2.456 1.00 21.33 C ATOM 2008 O GLN B 227 0.661 16.881 2.239 1.00 1.51 O ATOM 2009 CB GLN B 227 3.134 17.938 3.941 1.00 70.01 C ATOM 2010 CG GLN B 227 4.076 18.708 3.046 1.00 64.41 C ATOM 2011 CD GLN B 227 5.510 18.343 3.306 1.00 34.43 C ATOM 2012 OE1 GLN B 227 6.174 18.944 4.156 1.00 42.14 O ATOM 2013 NE2 GLN B 227 6.005 17.385 2.579 1.00 11.12 N ATOM 0 H GLN B 227 0.609 16.655 4.437 1.00 5.43 H new ATOM 0 HA GLN B 227 1.599 19.396 3.997 1.00 11.32 H new ATOM 0 HB2 GLN B 227 3.446 18.078 4.976 1.00 70.01 H new ATOM 0 HB3 GLN B 227 3.234 16.876 3.719 1.00 70.01 H new ATOM 0 HG2 GLN B 227 3.833 18.507 2.003 1.00 64.41 H new ATOM 0 HG3 GLN B 227 3.938 19.777 3.206 1.00 64.41 H new ATOM 0 HE21 GLN B 227 5.420 16.915 1.888 1.00 11.12 H new ATOM 0 HE22 GLN B 227 6.978 17.104 2.700 1.00 11.12 H new ATOM 2022 N ASP B 228 1.123 18.962 1.556 1.00 15.43 N ATOM 2023 CA ASP B 228 0.539 18.766 0.246 1.00 21.44 C ATOM 2024 C ASP B 228 1.267 17.700 -0.563 1.00 51.40 C ATOM 2025 O ASP B 228 2.490 17.726 -0.733 1.00 64.35 O ATOM 2026 CB ASP B 228 0.385 20.081 -0.547 1.00 52.14 C ATOM 2027 CG ASP B 228 1.683 20.770 -0.896 1.00 61.33 C ATOM 2028 OD1 ASP B 228 2.155 21.608 -0.103 1.00 72.22 O ATOM 2029 OD2 ASP B 228 2.235 20.506 -1.975 1.00 51.04 O ATOM 0 H ASP B 228 1.527 19.886 1.708 1.00 15.43 H new ATOM 0 HA ASP B 228 -0.470 18.395 0.427 1.00 21.44 H new ATOM 0 HB2 ASP B 228 -0.157 19.871 -1.469 1.00 52.14 H new ATOM 0 HB3 ASP B 228 -0.229 20.769 0.034 1.00 52.14 H new ATOM 2034 N ILE B 229 0.497 16.742 -1.016 1.00 11.31 N ATOM 2035 CA ILE B 229 0.991 15.622 -1.813 1.00 34.23 C ATOM 2036 C ILE B 229 0.430 15.738 -3.219 1.00 33.54 C ATOM 2037 O ILE B 229 0.536 14.829 -4.048 1.00 34.23 O ATOM 2038 CB ILE B 229 0.544 14.289 -1.180 1.00 44.25 C ATOM 2039 CG1 ILE B 229 -0.993 14.241 -1.086 1.00 75.04 C ATOM 2040 CG2 ILE B 229 1.182 14.141 0.194 1.00 22.33 C ATOM 2041 CD1 ILE B 229 -1.552 12.986 -0.459 1.00 13.20 C ATOM 0 H ILE B 229 -0.508 16.708 -0.844 1.00 11.31 H new ATOM 0 HA ILE B 229 2.080 15.645 -1.846 1.00 34.23 H new ATOM 0 HB ILE B 229 0.870 13.457 -1.805 1.00 44.25 H new ATOM 0 HG12 ILE B 229 -1.334 15.101 -0.510 1.00 75.04 H new ATOM 0 HG13 ILE B 229 -1.407 14.345 -2.089 1.00 75.04 H new ATOM 0 HG21 ILE B 229 0.866 13.199 0.642 1.00 22.33 H new ATOM 0 HG22 ILE B 229 2.267 14.150 0.094 1.00 22.33 H new ATOM 0 HG23 ILE B 229 0.870 14.968 0.831 1.00 22.33 H new ATOM 0 HD11 ILE B 229 -2.640 13.044 -0.437 1.00 13.20 H new ATOM 0 HD12 ILE B 229 -1.247 12.119 -1.045 1.00 13.20 H new ATOM 0 HD13 ILE B 229 -1.173 12.887 0.558 1.00 13.20 H new ATOM 2053 N SER B 230 -0.158 16.880 -3.446 1.00 4.44 N ATOM 2054 CA SER B 230 -0.797 17.257 -4.690 1.00 4.24 C ATOM 2055 C SER B 230 -1.944 16.296 -5.091 1.00 11.32 C ATOM 2056 O SER B 230 -3.041 16.398 -4.563 1.00 75.21 O ATOM 2057 CB SER B 230 0.232 17.482 -5.811 1.00 43.43 C ATOM 2058 OG SER B 230 1.194 18.462 -5.407 1.00 1.23 O ATOM 0 H SER B 230 -0.211 17.613 -2.738 1.00 4.44 H new ATOM 0 HA SER B 230 -1.281 18.219 -4.521 1.00 4.24 H new ATOM 0 HB2 SER B 230 0.734 16.544 -6.048 1.00 43.43 H new ATOM 0 HB3 SER B 230 -0.274 17.810 -6.719 1.00 43.43 H new ATOM 0 HG SER B 230 1.846 18.597 -6.127 1.00 1.23 H new ATOM 2064 N ASN B 231 -1.685 15.379 -5.988 1.00 52.54 N ATOM 2065 CA ASN B 231 -2.690 14.407 -6.415 1.00 11.20 C ATOM 2066 C ASN B 231 -2.218 12.988 -6.139 1.00 22.52 C ATOM 2067 O ASN B 231 -2.870 12.009 -6.504 1.00 72.34 O ATOM 2068 CB ASN B 231 -3.027 14.604 -7.904 1.00 41.01 C ATOM 2069 CG ASN B 231 -1.819 14.466 -8.816 1.00 74.10 C ATOM 2070 OD1 ASN B 231 -1.097 15.433 -9.050 1.00 24.33 O ATOM 2071 ND2 ASN B 231 -1.608 13.310 -9.363 1.00 4.45 N ATOM 0 H ASN B 231 -0.780 15.275 -6.448 1.00 52.54 H new ATOM 0 HA ASN B 231 -3.600 14.571 -5.838 1.00 11.20 H new ATOM 0 HB2 ASN B 231 -3.781 13.874 -8.198 1.00 41.01 H new ATOM 0 HB3 ASN B 231 -3.467 15.591 -8.042 1.00 41.01 H new ATOM 0 HD21 ASN B 231 -0.826 13.185 -10.006 1.00 4.45 H new ATOM 0 HD22 ASN B 231 -2.224 12.525 -9.150 1.00 4.45 H new ATOM 2078 N TYR B 232 -1.098 12.881 -5.468 1.00 22.12 N ATOM 2079 CA TYR B 232 -0.473 11.601 -5.242 1.00 3.32 C ATOM 2080 C TYR B 232 -0.979 10.938 -3.970 1.00 41.21 C ATOM 2081 O TYR B 232 -0.390 11.079 -2.891 1.00 32.15 O ATOM 2082 CB TYR B 232 1.056 11.729 -5.272 1.00 24.21 C ATOM 2083 CG TYR B 232 1.567 12.219 -6.615 1.00 1.31 C ATOM 2084 CD1 TYR B 232 1.602 13.571 -6.923 1.00 14.51 C ATOM 2085 CD2 TYR B 232 1.991 11.325 -7.577 1.00 24.31 C ATOM 2086 CE1 TYR B 232 2.045 14.010 -8.151 1.00 73.35 C ATOM 2087 CE2 TYR B 232 2.434 11.753 -8.806 1.00 64.54 C ATOM 2088 CZ TYR B 232 2.459 13.095 -9.090 1.00 71.40 C ATOM 2089 OH TYR B 232 2.895 13.523 -10.322 1.00 11.41 O ATOM 0 H TYR B 232 -0.596 13.673 -5.065 1.00 22.12 H new ATOM 0 HA TYR B 232 -0.758 10.939 -6.059 1.00 3.32 H new ATOM 0 HB2 TYR B 232 1.376 12.418 -4.491 1.00 24.21 H new ATOM 0 HB3 TYR B 232 1.504 10.761 -5.046 1.00 24.21 H new ATOM 0 HD1 TYR B 232 1.276 14.292 -6.187 1.00 14.51 H new ATOM 0 HD2 TYR B 232 1.974 10.267 -7.360 1.00 24.31 H new ATOM 0 HE1 TYR B 232 2.067 15.066 -8.375 1.00 73.35 H new ATOM 0 HE2 TYR B 232 2.761 11.036 -9.545 1.00 64.54 H new ATOM 0 HH TYR B 232 3.152 12.749 -10.865 1.00 11.41 H new ATOM 2099 N LEU B 233 -2.086 10.234 -4.114 1.00 53.12 N ATOM 2100 CA LEU B 233 -2.770 9.591 -3.009 1.00 61.44 C ATOM 2101 C LEU B 233 -3.309 8.217 -3.436 1.00 62.30 C ATOM 2102 O LEU B 233 -3.896 8.096 -4.511 1.00 15.32 O ATOM 2103 CB LEU B 233 -3.956 10.476 -2.612 1.00 63.12 C ATOM 2104 CG LEU B 233 -4.857 9.954 -1.502 1.00 45.12 C ATOM 2105 CD1 LEU B 233 -4.129 9.904 -0.192 1.00 63.01 C ATOM 2106 CD2 LEU B 233 -6.104 10.788 -1.391 1.00 55.31 C ATOM 0 H LEU B 233 -2.542 10.091 -5.015 1.00 53.12 H new ATOM 0 HA LEU B 233 -2.076 9.456 -2.179 1.00 61.44 H new ATOM 0 HB2 LEU B 233 -3.568 11.448 -2.307 1.00 63.12 H new ATOM 0 HB3 LEU B 233 -4.569 10.641 -3.498 1.00 63.12 H new ATOM 0 HG LEU B 233 -5.150 8.936 -1.759 1.00 45.12 H new ATOM 0 HD11 LEU B 233 -4.798 9.527 0.582 1.00 63.01 H new ATOM 0 HD12 LEU B 233 -3.267 9.243 -0.280 1.00 63.01 H new ATOM 0 HD13 LEU B 233 -3.792 10.906 0.076 1.00 63.01 H new ATOM 0 HD21 LEU B 233 -6.733 10.397 -0.592 1.00 55.31 H new ATOM 0 HD22 LEU B 233 -5.833 11.820 -1.168 1.00 55.31 H new ATOM 0 HD23 LEU B 233 -6.651 10.752 -2.333 1.00 55.31 H new ATOM 2118 N ASN B 234 -3.101 7.198 -2.607 1.00 22.41 N ATOM 2119 CA ASN B 234 -3.670 5.861 -2.859 1.00 50.21 C ATOM 2120 C ASN B 234 -4.722 5.523 -1.823 1.00 14.14 C ATOM 2121 O ASN B 234 -4.627 5.949 -0.662 1.00 13.44 O ATOM 2122 CB ASN B 234 -2.604 4.737 -2.851 1.00 52.04 C ATOM 2123 CG ASN B 234 -1.715 4.662 -4.069 1.00 14.20 C ATOM 2124 OD1 ASN B 234 -1.446 5.756 -4.655 1.00 4.22 O flip ATOM 2125 ND2 ASN B 234 -1.270 3.596 -4.463 1.00 45.30 N flip ATOM 0 H ASN B 234 -2.545 7.264 -1.754 1.00 22.41 H new ATOM 0 HA ASN B 234 -4.110 5.910 -3.855 1.00 50.21 H new ATOM 0 HB2 ASN B 234 -1.973 4.868 -1.972 1.00 52.04 H new ATOM 0 HB3 ASN B 234 -3.114 3.780 -2.738 1.00 52.04 H new ATOM 0 HD21 ASN B 234 -1.503 2.733 -3.972 1.00 45.30 H new ATOM 0 HD22 ASN B 234 -0.665 3.568 -5.283 1.00 45.30 H new ATOM 2132 N TRP B 235 -5.728 4.778 -2.242 1.00 63.23 N ATOM 2133 CA TRP B 235 -6.757 4.301 -1.342 1.00 74.11 C ATOM 2134 C TRP B 235 -6.778 2.782 -1.320 1.00 21.02 C ATOM 2135 O TRP B 235 -6.830 2.140 -2.365 1.00 62.12 O ATOM 2136 CB TRP B 235 -8.144 4.827 -1.749 1.00 21.40 C ATOM 2137 CG TRP B 235 -8.324 6.300 -1.557 1.00 12.34 C ATOM 2138 CD1 TRP B 235 -8.134 7.297 -2.478 1.00 3.42 C ATOM 2139 CD2 TRP B 235 -8.746 6.937 -0.356 1.00 3.35 C ATOM 2140 NE1 TRP B 235 -8.404 8.512 -1.907 1.00 4.33 N ATOM 2141 CE2 TRP B 235 -8.785 8.318 -0.601 1.00 24.13 C ATOM 2142 CE3 TRP B 235 -9.100 6.462 0.909 1.00 24.52 C ATOM 2143 CZ2 TRP B 235 -9.159 9.240 0.383 1.00 43.12 C ATOM 2144 CZ3 TRP B 235 -9.474 7.356 1.881 1.00 64.30 C ATOM 2145 CH2 TRP B 235 -9.504 8.739 1.617 1.00 12.34 C ATOM 0 H TRP B 235 -5.853 4.488 -3.212 1.00 63.23 H new ATOM 0 HA TRP B 235 -6.523 4.676 -0.346 1.00 74.11 H new ATOM 0 HB2 TRP B 235 -8.318 4.585 -2.797 1.00 21.40 H new ATOM 0 HB3 TRP B 235 -8.903 4.301 -1.170 1.00 21.40 H new ATOM 0 HD1 TRP B 235 -7.819 7.147 -3.500 1.00 3.42 H new ATOM 0 HE1 TRP B 235 -8.334 9.415 -2.375 1.00 4.33 H new ATOM 0 HE3 TRP B 235 -9.080 5.403 1.120 1.00 24.52 H new ATOM 0 HZ2 TRP B 235 -9.176 10.301 0.182 1.00 43.12 H new ATOM 0 HZ3 TRP B 235 -9.749 6.994 2.861 1.00 64.30 H new ATOM 0 HH2 TRP B 235 -9.804 9.420 2.399 1.00 12.34 H new ATOM 2156 N TYR B 236 -6.762 2.223 -0.134 1.00 35.14 N ATOM 2157 CA TYR B 236 -6.805 0.778 0.065 1.00 42.11 C ATOM 2158 C TYR B 236 -8.012 0.368 0.908 1.00 72.43 C ATOM 2159 O TYR B 236 -8.455 1.112 1.793 1.00 52.31 O ATOM 2160 CB TYR B 236 -5.521 0.279 0.755 1.00 61.02 C ATOM 2161 CG TYR B 236 -4.257 0.409 -0.054 1.00 1.41 C ATOM 2162 CD1 TYR B 236 -3.577 1.614 -0.128 1.00 70.32 C ATOM 2163 CD2 TYR B 236 -3.733 -0.681 -0.732 1.00 43.42 C ATOM 2164 CE1 TYR B 236 -2.416 1.734 -0.855 1.00 20.33 C ATOM 2165 CE2 TYR B 236 -2.565 -0.566 -1.466 1.00 33.11 C ATOM 2166 CZ TYR B 236 -1.912 0.647 -1.521 1.00 74.24 C ATOM 2167 OH TYR B 236 -0.750 0.776 -2.243 1.00 34.24 O ATOM 0 H TYR B 236 -6.718 2.756 0.735 1.00 35.14 H new ATOM 0 HA TYR B 236 -6.889 0.323 -0.922 1.00 42.11 H new ATOM 0 HB2 TYR B 236 -5.393 0.829 1.687 1.00 61.02 H new ATOM 0 HB3 TYR B 236 -5.656 -0.770 1.020 1.00 61.02 H new ATOM 0 HD1 TYR B 236 -3.966 2.475 0.395 1.00 70.32 H new ATOM 0 HD2 TYR B 236 -4.243 -1.632 -0.687 1.00 43.42 H new ATOM 0 HE1 TYR B 236 -1.902 2.683 -0.901 1.00 20.33 H new ATOM 0 HE2 TYR B 236 -2.168 -1.421 -1.992 1.00 33.11 H new ATOM 0 HH TYR B 236 -0.178 -0.004 -2.084 1.00 34.24 H new ATOM 2177 N GLN B 237 -8.513 -0.810 0.626 1.00 73.43 N ATOM 2178 CA GLN B 237 -9.626 -1.434 1.321 1.00 55.44 C ATOM 2179 C GLN B 237 -9.118 -2.688 2.014 1.00 13.54 C ATOM 2180 O GLN B 237 -8.583 -3.565 1.373 1.00 51.24 O ATOM 2181 CB GLN B 237 -10.690 -1.853 0.289 1.00 73.41 C ATOM 2182 CG GLN B 237 -11.849 -2.641 0.845 1.00 51.31 C ATOM 2183 CD GLN B 237 -12.731 -3.219 -0.247 1.00 44.24 C ATOM 2184 OE1 GLN B 237 -12.500 -4.335 -0.714 1.00 13.13 O ATOM 2185 NE2 GLN B 237 -13.743 -2.501 -0.643 1.00 64.41 N ATOM 0 H GLN B 237 -8.143 -1.390 -0.127 1.00 73.43 H new ATOM 0 HA GLN B 237 -10.053 -0.738 2.043 1.00 55.44 H new ATOM 0 HB2 GLN B 237 -11.079 -0.956 -0.192 1.00 73.41 H new ATOM 0 HB3 GLN B 237 -10.207 -2.447 -0.487 1.00 73.41 H new ATOM 0 HG2 GLN B 237 -11.469 -3.451 1.468 1.00 51.31 H new ATOM 0 HG3 GLN B 237 -12.448 -1.997 1.489 1.00 51.31 H new ATOM 0 HE21 GLN B 237 -13.906 -1.580 -0.235 1.00 64.41 H new ATOM 0 HE22 GLN B 237 -14.373 -2.859 -1.361 1.00 64.41 H new ATOM 2194 N GLN B 238 -9.265 -2.766 3.304 1.00 62.33 N ATOM 2195 CA GLN B 238 -8.856 -3.962 4.018 1.00 43.24 C ATOM 2196 C GLN B 238 -10.058 -4.527 4.703 1.00 22.33 C ATOM 2197 O GLN B 238 -10.696 -3.850 5.502 1.00 0.00 O ATOM 2198 CB GLN B 238 -7.683 -3.671 4.997 1.00 53.32 C ATOM 2199 CG GLN B 238 -7.083 -4.897 5.726 1.00 32.02 C ATOM 2200 CD GLN B 238 -7.949 -5.460 6.845 1.00 44.23 C ATOM 2201 OE1 GLN B 238 -8.691 -4.729 7.508 1.00 51.15 O ATOM 2202 NE2 GLN B 238 -7.869 -6.745 7.056 1.00 64.14 N ATOM 0 H GLN B 238 -9.660 -2.029 3.888 1.00 62.33 H new ATOM 0 HA GLN B 238 -8.467 -4.703 3.320 1.00 43.24 H new ATOM 0 HB2 GLN B 238 -6.886 -3.179 4.440 1.00 53.32 H new ATOM 0 HB3 GLN B 238 -8.031 -2.962 5.748 1.00 53.32 H new ATOM 0 HG2 GLN B 238 -6.902 -5.684 4.994 1.00 32.02 H new ATOM 0 HG3 GLN B 238 -6.114 -4.618 6.140 1.00 32.02 H new ATOM 0 HE21 GLN B 238 -7.244 -7.317 6.488 1.00 64.14 H new ATOM 0 HE22 GLN B 238 -8.431 -7.177 7.789 1.00 64.14 H new ATOM 2211 N LYS B 239 -10.384 -5.729 4.355 1.00 34.44 N ATOM 2212 CA LYS B 239 -11.519 -6.405 4.886 1.00 34.13 C ATOM 2213 C LYS B 239 -11.078 -7.715 5.488 1.00 30.32 C ATOM 2214 O LYS B 239 -10.068 -8.280 5.054 1.00 53.45 O ATOM 2215 CB LYS B 239 -12.570 -6.661 3.820 1.00 40.42 C ATOM 2216 CG LYS B 239 -12.129 -7.566 2.708 1.00 72.34 C ATOM 2217 CD LYS B 239 -13.287 -7.926 1.827 1.00 22.45 C ATOM 2218 CE LYS B 239 -13.919 -6.687 1.199 1.00 2.21 C ATOM 2219 NZ LYS B 239 -14.996 -7.017 0.240 1.00 72.22 N ATOM 0 H LYS B 239 -9.856 -6.279 3.678 1.00 34.44 H new ATOM 0 HA LYS B 239 -11.968 -5.769 5.649 1.00 34.13 H new ATOM 0 HB2 LYS B 239 -13.451 -7.094 4.294 1.00 40.42 H new ATOM 0 HB3 LYS B 239 -12.875 -5.706 3.393 1.00 40.42 H new ATOM 0 HG2 LYS B 239 -11.356 -7.075 2.118 1.00 72.34 H new ATOM 0 HG3 LYS B 239 -11.686 -8.471 3.123 1.00 72.34 H new ATOM 0 HD2 LYS B 239 -12.951 -8.602 1.041 1.00 22.45 H new ATOM 0 HD3 LYS B 239 -14.036 -8.462 2.410 1.00 22.45 H new ATOM 0 HE2 LYS B 239 -14.323 -6.051 1.987 1.00 2.21 H new ATOM 0 HE3 LYS B 239 -13.148 -6.110 0.688 1.00 2.21 H new ATOM 0 HZ1 LYS B 239 -15.523 -6.153 -0.001 1.00 72.22 H new ATOM 0 HZ2 LYS B 239 -14.580 -7.421 -0.623 1.00 72.22 H new ATOM 0 HZ3 LYS B 239 -15.643 -7.709 0.669 1.00 72.22 H new ATOM 2276 N ALA B 243 -6.328 -9.086 2.058 1.00 15.44 N ATOM 2277 CA ALA B 243 -5.246 -8.146 2.188 1.00 51.24 C ATOM 2278 C ALA B 243 -5.747 -6.801 1.657 1.00 54.55 C ATOM 2279 O ALA B 243 -6.676 -6.790 0.826 1.00 24.21 O ATOM 2280 CB ALA B 243 -4.037 -8.637 1.375 1.00 62.21 C ATOM 0 HA ALA B 243 -4.931 -8.045 3.227 1.00 51.24 H new ATOM 0 HB1 ALA B 243 -3.218 -7.924 1.474 1.00 62.21 H new ATOM 0 HB2 ALA B 243 -3.718 -9.610 1.749 1.00 62.21 H new ATOM 0 HB3 ALA B 243 -4.316 -8.725 0.325 1.00 62.21 H new ATOM 2286 N PRO B 244 -5.190 -5.656 2.131 1.00 41.21 N ATOM 2287 CA PRO B 244 -5.626 -4.337 1.689 1.00 51.25 C ATOM 2288 C PRO B 244 -5.515 -4.184 0.171 1.00 25.43 C ATOM 2289 O PRO B 244 -4.430 -4.258 -0.407 1.00 3.31 O ATOM 2290 CB PRO B 244 -4.687 -3.355 2.436 1.00 23.33 C ATOM 2291 CG PRO B 244 -3.540 -4.197 2.872 1.00 41.54 C ATOM 2292 CD PRO B 244 -4.108 -5.566 3.113 1.00 60.22 C ATOM 0 HA PRO B 244 -6.677 -4.153 1.912 1.00 51.25 H new ATOM 0 HB2 PRO B 244 -4.360 -2.545 1.784 1.00 23.33 H new ATOM 0 HB3 PRO B 244 -5.189 -2.896 3.288 1.00 23.33 H new ATOM 0 HG2 PRO B 244 -2.762 -4.225 2.109 1.00 41.54 H new ATOM 0 HG3 PRO B 244 -3.083 -3.798 3.778 1.00 41.54 H new ATOM 0 HD2 PRO B 244 -3.361 -6.345 2.961 1.00 60.22 H new ATOM 0 HD3 PRO B 244 -4.479 -5.675 4.132 1.00 60.22 H new ATOM 2300 N LYS B 245 -6.640 -3.978 -0.448 1.00 3.02 N ATOM 2301 CA LYS B 245 -6.743 -3.879 -1.867 1.00 64.40 C ATOM 2302 C LYS B 245 -6.891 -2.439 -2.272 1.00 61.11 C ATOM 2303 O LYS B 245 -7.752 -1.736 -1.779 1.00 53.15 O ATOM 2304 CB LYS B 245 -7.930 -4.723 -2.378 1.00 5.40 C ATOM 2305 CG LYS B 245 -8.192 -4.636 -3.886 1.00 13.45 C ATOM 2306 CD LYS B 245 -6.970 -5.022 -4.708 1.00 52.22 C ATOM 2307 CE LYS B 245 -7.262 -5.005 -6.211 1.00 51.34 C ATOM 2308 NZ LYS B 245 -7.758 -3.690 -6.702 1.00 21.20 N ATOM 0 H LYS B 245 -7.532 -3.872 0.036 1.00 3.02 H new ATOM 0 HA LYS B 245 -5.832 -4.271 -2.319 1.00 64.40 H new ATOM 0 HB2 LYS B 245 -7.753 -5.766 -2.116 1.00 5.40 H new ATOM 0 HB3 LYS B 245 -8.831 -4.410 -1.850 1.00 5.40 H new ATOM 0 HG2 LYS B 245 -9.024 -5.291 -4.146 1.00 13.45 H new ATOM 0 HG3 LYS B 245 -8.493 -3.620 -4.142 1.00 13.45 H new ATOM 0 HD2 LYS B 245 -6.154 -4.334 -4.489 1.00 52.22 H new ATOM 0 HD3 LYS B 245 -6.635 -6.017 -4.415 1.00 52.22 H new ATOM 0 HE2 LYS B 245 -6.354 -5.268 -6.753 1.00 51.34 H new ATOM 0 HE3 LYS B 245 -8.002 -5.772 -6.439 1.00 51.34 H new ATOM 0 HZ1 LYS B 245 -7.355 -3.496 -7.641 1.00 21.20 H new ATOM 0 HZ2 LYS B 245 -8.796 -3.713 -6.769 1.00 21.20 H new ATOM 0 HZ3 LYS B 245 -7.470 -2.941 -6.040 1.00 21.20 H new ATOM 2322 N LEU B 246 -6.022 -2.016 -3.119 1.00 70.14 N ATOM 2323 CA LEU B 246 -6.007 -0.682 -3.645 1.00 33.30 C ATOM 2324 C LEU B 246 -7.133 -0.458 -4.617 1.00 51.14 C ATOM 2325 O LEU B 246 -7.361 -1.262 -5.525 1.00 12.32 O ATOM 2326 CB LEU B 246 -4.666 -0.473 -4.291 1.00 35.43 C ATOM 2327 CG LEU B 246 -4.387 0.781 -5.044 1.00 22.14 C ATOM 2328 CD1 LEU B 246 -4.212 1.897 -4.077 1.00 64.24 C ATOM 2329 CD2 LEU B 246 -3.152 0.604 -5.903 1.00 61.03 C ATOM 0 H LEU B 246 -5.272 -2.604 -3.483 1.00 70.14 H new ATOM 0 HA LEU B 246 -6.157 0.043 -2.845 1.00 33.30 H new ATOM 0 HB2 LEU B 246 -3.913 -0.554 -3.507 1.00 35.43 H new ATOM 0 HB3 LEU B 246 -4.504 -1.305 -4.976 1.00 35.43 H new ATOM 0 HG LEU B 246 -5.223 1.015 -5.704 1.00 22.14 H new ATOM 0 HD11 LEU B 246 -4.007 2.820 -4.620 1.00 64.24 H new ATOM 0 HD12 LEU B 246 -5.123 2.016 -3.490 1.00 64.24 H new ATOM 0 HD13 LEU B 246 -3.378 1.675 -3.412 1.00 64.24 H new ATOM 0 HD21 LEU B 246 -2.955 1.526 -6.451 1.00 61.03 H new ATOM 0 HD22 LEU B 246 -2.298 0.369 -5.268 1.00 61.03 H new ATOM 0 HD23 LEU B 246 -3.314 -0.210 -6.609 1.00 61.03 H new ATOM 2341 N LEU B 247 -7.835 0.621 -4.401 1.00 50.14 N ATOM 2342 CA LEU B 247 -8.942 1.007 -5.231 1.00 74.45 C ATOM 2343 C LEU B 247 -8.507 2.111 -6.137 1.00 0.43 C ATOM 2344 O LEU B 247 -8.867 2.156 -7.300 1.00 34.15 O ATOM 2345 CB LEU B 247 -10.130 1.543 -4.396 1.00 44.54 C ATOM 2346 CG LEU B 247 -10.698 0.660 -3.293 1.00 4.44 C ATOM 2347 CD1 LEU B 247 -11.029 -0.747 -3.772 1.00 43.14 C ATOM 2348 CD2 LEU B 247 -9.814 0.668 -2.081 1.00 13.33 C ATOM 0 H LEU B 247 -7.651 1.266 -3.632 1.00 50.14 H new ATOM 0 HA LEU B 247 -9.261 0.123 -5.783 1.00 74.45 H new ATOM 0 HB2 LEU B 247 -9.818 2.483 -3.941 1.00 44.54 H new ATOM 0 HB3 LEU B 247 -10.942 1.776 -5.085 1.00 44.54 H new ATOM 0 HG LEU B 247 -11.653 1.094 -2.997 1.00 4.44 H new ATOM 0 HD11 LEU B 247 -11.430 -1.329 -2.942 1.00 43.14 H new ATOM 0 HD12 LEU B 247 -11.770 -0.695 -4.570 1.00 43.14 H new ATOM 0 HD13 LEU B 247 -10.125 -1.226 -4.147 1.00 43.14 H new ATOM 0 HD21 LEU B 247 -10.246 0.029 -1.311 1.00 13.33 H new ATOM 0 HD22 LEU B 247 -8.825 0.295 -2.349 1.00 13.33 H new ATOM 0 HD23 LEU B 247 -9.727 1.686 -1.701 1.00 13.33 H new ATOM 2360 N ILE B 248 -7.703 3.002 -5.598 1.00 34.32 N ATOM 2361 CA ILE B 248 -7.329 4.213 -6.308 1.00 43.41 C ATOM 2362 C ILE B 248 -5.868 4.457 -6.091 1.00 51.45 C ATOM 2363 O ILE B 248 -5.415 4.365 -4.981 1.00 54.52 O ATOM 2364 CB ILE B 248 -8.125 5.424 -5.725 1.00 40.23 C ATOM 2365 CG1 ILE B 248 -9.639 5.186 -5.848 1.00 21.42 C ATOM 2366 CG2 ILE B 248 -7.719 6.727 -6.392 1.00 41.23 C ATOM 2367 CD1 ILE B 248 -10.499 6.297 -5.306 1.00 11.10 C ATOM 0 H ILE B 248 -7.293 2.913 -4.668 1.00 34.32 H new ATOM 0 HA ILE B 248 -7.549 4.103 -7.370 1.00 43.41 H new ATOM 0 HB ILE B 248 -7.878 5.510 -4.667 1.00 40.23 H new ATOM 0 HG12 ILE B 248 -9.885 5.035 -6.899 1.00 21.42 H new ATOM 0 HG13 ILE B 248 -9.891 4.263 -5.326 1.00 21.42 H new ATOM 0 HG21 ILE B 248 -8.292 7.549 -5.963 1.00 41.23 H new ATOM 0 HG22 ILE B 248 -6.655 6.903 -6.230 1.00 41.23 H new ATOM 0 HG23 ILE B 248 -7.918 6.666 -7.462 1.00 41.23 H new ATOM 0 HD11 ILE B 248 -11.550 6.040 -5.436 1.00 11.10 H new ATOM 0 HD12 ILE B 248 -10.288 6.436 -4.246 1.00 11.10 H new ATOM 0 HD13 ILE B 248 -10.282 7.220 -5.843 1.00 11.10 H new ATOM 2379 N TYR B 249 -5.160 4.853 -7.116 1.00 2.52 N ATOM 2380 CA TYR B 249 -3.720 5.034 -6.989 1.00 64.13 C ATOM 2381 C TYR B 249 -3.279 6.453 -7.255 1.00 60.34 C ATOM 2382 O TYR B 249 -2.109 6.771 -7.141 1.00 12.41 O ATOM 2383 CB TYR B 249 -2.943 4.050 -7.872 1.00 72.41 C ATOM 2384 CG TYR B 249 -3.322 4.089 -9.325 1.00 35.52 C ATOM 2385 CD1 TYR B 249 -2.922 5.131 -10.142 1.00 24.33 C ATOM 2386 CD2 TYR B 249 -4.087 3.083 -9.876 1.00 25.13 C ATOM 2387 CE1 TYR B 249 -3.271 5.171 -11.458 1.00 44.34 C ATOM 2388 CE2 TYR B 249 -4.442 3.107 -11.195 1.00 52.12 C ATOM 2389 CZ TYR B 249 -4.033 4.156 -11.988 1.00 51.22 C ATOM 2390 OH TYR B 249 -4.384 4.195 -13.313 1.00 4.42 O ATOM 0 H TYR B 249 -5.541 5.056 -8.040 1.00 2.52 H new ATOM 0 HA TYR B 249 -3.485 4.818 -5.947 1.00 64.13 H new ATOM 0 HB2 TYR B 249 -1.878 4.262 -7.781 1.00 72.41 H new ATOM 0 HB3 TYR B 249 -3.100 3.040 -7.495 1.00 72.41 H new ATOM 0 HD1 TYR B 249 -2.322 5.928 -9.729 1.00 24.33 H new ATOM 0 HD2 TYR B 249 -4.411 2.262 -9.254 1.00 25.13 H new ATOM 0 HE1 TYR B 249 -2.952 5.994 -12.081 1.00 44.34 H new ATOM 0 HE2 TYR B 249 -5.039 2.310 -11.613 1.00 52.12 H new ATOM 0 HH TYR B 249 -4.921 3.405 -13.533 1.00 4.42 H new ATOM 2400 N ASP B 250 -4.188 7.295 -7.635 1.00 25.44 N ATOM 2401 CA ASP B 250 -3.830 8.674 -7.847 1.00 13.44 C ATOM 2402 C ASP B 250 -5.017 9.542 -7.602 1.00 23.21 C ATOM 2403 O ASP B 250 -5.657 9.977 -8.556 1.00 14.24 O ATOM 2404 CB ASP B 250 -3.291 8.919 -9.263 1.00 71.33 C ATOM 2405 CG ASP B 250 -2.702 10.295 -9.431 1.00 75.13 C ATOM 2406 OD1 ASP B 250 -3.437 11.238 -9.790 1.00 23.54 O ATOM 2407 OD2 ASP B 250 -1.480 10.442 -9.229 1.00 41.43 O ATOM 0 H ASP B 250 -5.167 7.065 -7.804 1.00 25.44 H new ATOM 0 HA ASP B 250 -3.034 8.921 -7.145 1.00 13.44 H new ATOM 0 HB2 ASP B 250 -2.531 8.172 -9.492 1.00 71.33 H new ATOM 0 HB3 ASP B 250 -4.098 8.783 -9.983 1.00 71.33 H new ATOM 2412 N ALA B 251 -5.375 9.674 -6.310 1.00 45.25 N ATOM 2413 CA ALA B 251 -6.491 10.517 -5.796 1.00 51.33 C ATOM 2414 C ALA B 251 -7.875 10.147 -6.369 1.00 52.35 C ATOM 2415 O ALA B 251 -8.778 9.774 -5.629 1.00 65.02 O ATOM 2416 CB ALA B 251 -6.199 12.002 -5.981 1.00 33.01 C ATOM 0 H ALA B 251 -4.883 9.183 -5.563 1.00 45.25 H new ATOM 0 HA ALA B 251 -6.546 10.302 -4.729 1.00 51.33 H new ATOM 0 HB1 ALA B 251 -7.033 12.588 -5.595 1.00 33.01 H new ATOM 0 HB2 ALA B 251 -5.290 12.264 -5.439 1.00 33.01 H new ATOM 0 HB3 ALA B 251 -6.064 12.217 -7.041 1.00 33.01 H new ATOM 2422 N SER B 252 -8.004 10.250 -7.657 1.00 22.04 N ATOM 2423 CA SER B 252 -9.214 10.002 -8.373 1.00 22.22 C ATOM 2424 C SER B 252 -9.106 8.764 -9.288 1.00 10.34 C ATOM 2425 O SER B 252 -10.109 8.137 -9.604 1.00 52.32 O ATOM 2426 CB SER B 252 -9.490 11.238 -9.210 1.00 12.13 C ATOM 2427 OG SER B 252 -8.321 11.592 -9.956 1.00 72.34 O ATOM 0 H SER B 252 -7.231 10.522 -8.264 1.00 22.04 H new ATOM 0 HA SER B 252 -10.020 9.798 -7.668 1.00 22.22 H new ATOM 0 HB2 SER B 252 -10.322 11.050 -9.889 1.00 12.13 H new ATOM 0 HB3 SER B 252 -9.785 12.066 -8.565 1.00 12.13 H new ATOM 0 HG SER B 252 -8.506 12.389 -10.495 1.00 72.34 H new ATOM 2433 N ASN B 253 -7.884 8.406 -9.677 1.00 22.02 N ATOM 2434 CA ASN B 253 -7.668 7.346 -10.666 1.00 63.53 C ATOM 2435 C ASN B 253 -7.770 5.956 -10.060 1.00 40.24 C ATOM 2436 O ASN B 253 -6.928 5.565 -9.229 1.00 33.01 O ATOM 2437 CB ASN B 253 -6.312 7.515 -11.373 1.00 11.40 C ATOM 2438 CG ASN B 253 -6.186 8.824 -12.146 1.00 62.42 C ATOM 2439 OD1 ASN B 253 -5.662 9.856 -11.511 1.00 32.40 O flip ATOM 2440 ND2 ASN B 253 -6.549 8.901 -13.318 1.00 31.31 N flip ATOM 0 H ASN B 253 -7.027 8.833 -9.324 1.00 22.02 H new ATOM 0 HA ASN B 253 -8.467 7.444 -11.401 1.00 63.53 H new ATOM 0 HB2 ASN B 253 -5.516 7.463 -10.631 1.00 11.40 H new ATOM 0 HB3 ASN B 253 -6.163 6.681 -12.059 1.00 11.40 H new ATOM 0 HD21 ASN B 253 -6.950 8.086 -13.782 1.00 31.31 H new ATOM 0 HD22 ASN B 253 -6.449 9.780 -13.826 1.00 31.31 H new ATOM 2447 N LEU B 254 -8.786 5.206 -10.485 1.00 31.02 N ATOM 2448 CA LEU B 254 -9.024 3.849 -9.985 1.00 23.10 C ATOM 2449 C LEU B 254 -8.101 2.824 -10.597 1.00 10.53 C ATOM 2450 O LEU B 254 -7.668 2.946 -11.750 1.00 63.31 O ATOM 2451 CB LEU B 254 -10.481 3.351 -10.141 1.00 73.11 C ATOM 2452 CG LEU B 254 -11.571 3.988 -9.286 1.00 51.15 C ATOM 2453 CD1 LEU B 254 -11.900 5.402 -9.709 1.00 31.43 C ATOM 2454 CD2 LEU B 254 -12.808 3.119 -9.288 1.00 42.32 C ATOM 0 H LEU B 254 -9.464 5.517 -11.181 1.00 31.02 H new ATOM 0 HA LEU B 254 -8.814 3.943 -8.920 1.00 23.10 H new ATOM 0 HB2 LEU B 254 -10.764 3.480 -11.186 1.00 73.11 H new ATOM 0 HB3 LEU B 254 -10.487 2.280 -9.939 1.00 73.11 H new ATOM 0 HG LEU B 254 -11.183 4.057 -8.270 1.00 51.15 H new ATOM 0 HD11 LEU B 254 -12.682 5.802 -9.064 1.00 31.43 H new ATOM 0 HD12 LEU B 254 -11.008 6.023 -9.626 1.00 31.43 H new ATOM 0 HD13 LEU B 254 -12.247 5.401 -10.742 1.00 31.43 H new ATOM 0 HD21 LEU B 254 -13.580 3.583 -8.674 1.00 42.32 H new ATOM 0 HD22 LEU B 254 -13.174 3.009 -10.309 1.00 42.32 H new ATOM 0 HD23 LEU B 254 -12.564 2.137 -8.882 1.00 42.32 H new ATOM 2466 N GLU B 255 -7.816 1.822 -9.809 1.00 20.31 N ATOM 2467 CA GLU B 255 -6.998 0.704 -10.194 1.00 51.51 C ATOM 2468 C GLU B 255 -7.875 -0.204 -11.095 1.00 23.22 C ATOM 2469 O GLU B 255 -9.094 -0.287 -10.903 1.00 42.43 O ATOM 2470 CB GLU B 255 -6.538 0.007 -8.882 1.00 55.40 C ATOM 2471 CG GLU B 255 -5.367 -0.983 -8.960 1.00 72.33 C ATOM 2472 CD GLU B 255 -5.640 -2.244 -9.730 1.00 62.01 C ATOM 2473 OE1 GLU B 255 -6.336 -3.143 -9.188 1.00 10.04 O ATOM 2474 OE2 GLU B 255 -5.144 -2.357 -10.885 1.00 12.04 O ATOM 0 H GLU B 255 -8.158 1.760 -8.850 1.00 20.31 H new ATOM 0 HA GLU B 255 -6.106 0.976 -10.758 1.00 51.51 H new ATOM 0 HB2 GLU B 255 -6.269 0.785 -8.168 1.00 55.40 H new ATOM 0 HB3 GLU B 255 -7.396 -0.523 -8.468 1.00 55.40 H new ATOM 0 HG2 GLU B 255 -4.515 -0.477 -9.414 1.00 72.33 H new ATOM 0 HG3 GLU B 255 -5.073 -1.253 -7.946 1.00 72.33 H new ATOM 2481 N THR B 256 -7.273 -0.832 -12.067 1.00 21.12 N ATOM 2482 CA THR B 256 -7.993 -1.638 -13.030 1.00 74.13 C ATOM 2483 C THR B 256 -8.667 -2.855 -12.357 1.00 2.54 C ATOM 2484 O THR B 256 -8.010 -3.680 -11.723 1.00 3.10 O ATOM 2485 CB THR B 256 -7.031 -2.106 -14.139 1.00 3.53 C ATOM 2486 OG1 THR B 256 -6.332 -0.950 -14.659 1.00 4.04 O ATOM 2487 CG2 THR B 256 -7.793 -2.778 -15.278 1.00 64.44 C ATOM 0 H THR B 256 -6.265 -0.803 -12.219 1.00 21.12 H new ATOM 0 HA THR B 256 -8.780 -1.024 -13.468 1.00 74.13 H new ATOM 0 HB THR B 256 -6.332 -2.828 -13.718 1.00 3.53 H new ATOM 0 HG1 THR B 256 -5.714 -1.232 -15.365 1.00 4.04 H new ATOM 0 HG21 THR B 256 -7.090 -3.098 -16.047 1.00 64.44 H new ATOM 0 HG22 THR B 256 -8.331 -3.645 -14.894 1.00 64.44 H new ATOM 0 HG23 THR B 256 -8.503 -2.071 -15.708 1.00 64.44 H new ATOM 2495 N GLY B 257 -9.976 -2.935 -12.493 1.00 55.30 N ATOM 2496 CA GLY B 257 -10.720 -4.025 -11.923 1.00 71.43 C ATOM 2497 C GLY B 257 -11.590 -3.559 -10.787 1.00 63.03 C ATOM 2498 O GLY B 257 -12.542 -4.242 -10.400 1.00 3.54 O ATOM 0 H GLY B 257 -10.542 -2.252 -12.996 1.00 55.30 H new ATOM 0 HA2 GLY B 257 -11.339 -4.487 -12.692 1.00 71.43 H new ATOM 0 HA3 GLY B 257 -10.031 -4.791 -11.566 1.00 71.43 H new ATOM 2502 N VAL B 258 -11.273 -2.397 -10.262 1.00 32.41 N ATOM 2503 CA VAL B 258 -12.003 -1.814 -9.158 1.00 34.43 C ATOM 2504 C VAL B 258 -13.325 -1.238 -9.658 1.00 55.52 C ATOM 2505 O VAL B 258 -13.347 -0.515 -10.657 1.00 62.52 O ATOM 2506 CB VAL B 258 -11.170 -0.697 -8.481 1.00 44.24 C ATOM 2507 CG1 VAL B 258 -11.923 -0.066 -7.322 1.00 53.45 C ATOM 2508 CG2 VAL B 258 -9.846 -1.253 -8.006 1.00 35.04 C ATOM 0 H VAL B 258 -10.495 -1.825 -10.591 1.00 32.41 H new ATOM 0 HA VAL B 258 -12.201 -2.595 -8.424 1.00 34.43 H new ATOM 0 HB VAL B 258 -10.987 0.082 -9.221 1.00 44.24 H new ATOM 0 HG11 VAL B 258 -11.309 0.713 -6.870 1.00 53.45 H new ATOM 0 HG12 VAL B 258 -12.853 0.370 -7.687 1.00 53.45 H new ATOM 0 HG13 VAL B 258 -12.148 -0.828 -6.576 1.00 53.45 H new ATOM 0 HG21 VAL B 258 -9.268 -0.460 -7.532 1.00 35.04 H new ATOM 0 HG22 VAL B 258 -10.024 -2.052 -7.287 1.00 35.04 H new ATOM 0 HG23 VAL B 258 -9.291 -1.648 -8.857 1.00 35.04 H new ATOM 2518 N PRO B 259 -14.445 -1.567 -8.990 1.00 13.01 N ATOM 2519 CA PRO B 259 -15.755 -1.069 -9.374 1.00 71.01 C ATOM 2520 C PRO B 259 -15.867 0.450 -9.325 1.00 31.04 C ATOM 2521 O PRO B 259 -15.285 1.118 -8.460 1.00 3.24 O ATOM 2522 CB PRO B 259 -16.716 -1.690 -8.358 1.00 61.54 C ATOM 2523 CG PRO B 259 -15.864 -2.180 -7.248 1.00 22.04 C ATOM 2524 CD PRO B 259 -14.517 -2.472 -7.829 1.00 4.50 C ATOM 0 HA PRO B 259 -15.970 -1.336 -10.409 1.00 71.01 H new ATOM 0 HB2 PRO B 259 -17.438 -0.955 -8.002 1.00 61.54 H new ATOM 0 HB3 PRO B 259 -17.285 -2.506 -8.805 1.00 61.54 H new ATOM 0 HG2 PRO B 259 -15.790 -1.432 -6.459 1.00 22.04 H new ATOM 0 HG3 PRO B 259 -16.293 -3.076 -6.799 1.00 22.04 H new ATOM 0 HD2 PRO B 259 -13.719 -2.273 -7.114 1.00 4.50 H new ATOM 0 HD3 PRO B 259 -14.425 -3.516 -8.127 1.00 4.50 H new ATOM 2532 N SER B 260 -16.666 0.968 -10.232 1.00 34.43 N ATOM 2533 CA SER B 260 -16.942 2.392 -10.399 1.00 15.13 C ATOM 2534 C SER B 260 -17.633 3.015 -9.167 1.00 4.54 C ATOM 2535 O SER B 260 -17.890 4.224 -9.133 1.00 62.13 O ATOM 2536 CB SER B 260 -17.789 2.582 -11.644 1.00 71.41 C ATOM 2537 OG SER B 260 -17.153 1.978 -12.762 1.00 35.40 O ATOM 0 H SER B 260 -17.167 0.389 -10.906 1.00 34.43 H new ATOM 0 HA SER B 260 -15.990 2.912 -10.506 1.00 15.13 H new ATOM 0 HB2 SER B 260 -18.775 2.141 -11.494 1.00 71.41 H new ATOM 0 HB3 SER B 260 -17.941 3.645 -11.832 1.00 71.41 H new ATOM 0 HG SER B 260 -17.707 2.104 -13.561 1.00 35.40 H new ATOM 2543 N ARG B 261 -17.955 2.182 -8.167 1.00 1.34 N ATOM 2544 CA ARG B 261 -18.600 2.664 -6.950 1.00 74.44 C ATOM 2545 C ARG B 261 -17.612 3.525 -6.175 1.00 0.21 C ATOM 2546 O ARG B 261 -18.008 4.355 -5.360 1.00 71.21 O ATOM 2547 CB ARG B 261 -19.015 1.484 -6.044 1.00 1.33 C ATOM 2548 CG ARG B 261 -19.874 0.436 -6.723 1.00 52.23 C ATOM 2549 CD ARG B 261 -20.389 -0.617 -5.739 1.00 73.35 C ATOM 2550 NE ARG B 261 -19.345 -1.342 -5.000 1.00 43.23 N ATOM 2551 CZ ARG B 261 -18.955 -2.597 -5.260 1.00 13.23 C ATOM 2552 NH1 ARG B 261 -19.393 -3.230 -6.333 1.00 11.34 N ATOM 2553 NH2 ARG B 261 -18.135 -3.210 -4.436 1.00 53.42 N ATOM 0 H ARG B 261 -17.778 1.178 -8.182 1.00 1.34 H new ATOM 0 HA ARG B 261 -19.486 3.234 -7.232 1.00 74.44 H new ATOM 0 HB2 ARG B 261 -18.115 1.004 -5.661 1.00 1.33 H new ATOM 0 HB3 ARG B 261 -19.557 1.877 -5.184 1.00 1.33 H new ATOM 0 HG2 ARG B 261 -20.721 0.922 -7.208 1.00 52.23 H new ATOM 0 HG3 ARG B 261 -19.295 -0.054 -7.506 1.00 52.23 H new ATOM 0 HD2 ARG B 261 -21.049 -0.129 -5.021 1.00 73.35 H new ATOM 0 HD3 ARG B 261 -20.993 -1.340 -6.287 1.00 73.35 H new ATOM 0 HE ARG B 261 -18.884 -0.853 -4.233 1.00 43.23 H new ATOM 0 HH11 ARG B 261 -20.035 -2.763 -6.974 1.00 11.34 H new ATOM 0 HH12 ARG B 261 -19.089 -4.185 -6.521 1.00 11.34 H new ATOM 0 HH21 ARG B 261 -17.798 -2.730 -3.602 1.00 53.42 H new ATOM 0 HH22 ARG B 261 -17.836 -4.166 -4.631 1.00 53.42 H new ATOM 2567 N PHE B 262 -16.339 3.358 -6.478 1.00 33.04 N ATOM 2568 CA PHE B 262 -15.290 4.099 -5.823 1.00 20.54 C ATOM 2569 C PHE B 262 -14.810 5.232 -6.693 1.00 43.33 C ATOM 2570 O PHE B 262 -14.848 5.138 -7.922 1.00 13.13 O ATOM 2571 CB PHE B 262 -14.132 3.173 -5.489 1.00 63.41 C ATOM 2572 CG PHE B 262 -14.543 2.059 -4.597 1.00 25.34 C ATOM 2573 CD1 PHE B 262 -14.640 2.255 -3.244 1.00 61.23 C ATOM 2574 CD2 PHE B 262 -14.861 0.820 -5.116 1.00 24.22 C ATOM 2575 CE1 PHE B 262 -15.039 1.241 -2.418 1.00 73.30 C ATOM 2576 CE2 PHE B 262 -15.267 -0.195 -4.288 1.00 45.02 C ATOM 2577 CZ PHE B 262 -15.351 0.018 -2.943 1.00 41.11 C ATOM 0 H PHE B 262 -16.008 2.703 -7.186 1.00 33.04 H new ATOM 0 HA PHE B 262 -15.691 4.521 -4.901 1.00 20.54 H new ATOM 0 HB2 PHE B 262 -13.719 2.764 -6.411 1.00 63.41 H new ATOM 0 HB3 PHE B 262 -13.338 3.746 -5.010 1.00 63.41 H new ATOM 0 HD1 PHE B 262 -14.399 3.221 -2.826 1.00 61.23 H new ATOM 0 HD2 PHE B 262 -14.790 0.649 -6.180 1.00 24.22 H new ATOM 0 HE1 PHE B 262 -15.108 1.406 -1.353 1.00 73.30 H new ATOM 0 HE2 PHE B 262 -15.520 -1.161 -4.700 1.00 45.02 H new ATOM 0 HZ PHE B 262 -15.665 -0.783 -2.290 1.00 41.11 H new ATOM 2587 N SER B 263 -14.403 6.308 -6.056 1.00 24.44 N ATOM 2588 CA SER B 263 -13.836 7.459 -6.712 1.00 4.04 C ATOM 2589 C SER B 263 -13.400 8.437 -5.636 1.00 11.40 C ATOM 2590 O SER B 263 -14.000 8.482 -4.550 1.00 51.25 O ATOM 2591 CB SER B 263 -14.862 8.126 -7.660 1.00 2.22 C ATOM 2592 OG SER B 263 -14.286 9.213 -8.379 1.00 3.41 O ATOM 0 H SER B 263 -14.460 6.406 -5.042 1.00 24.44 H new ATOM 0 HA SER B 263 -12.986 7.153 -7.322 1.00 4.04 H new ATOM 0 HB2 SER B 263 -15.243 7.385 -8.363 1.00 2.22 H new ATOM 0 HB3 SER B 263 -15.714 8.483 -7.081 1.00 2.22 H new ATOM 0 HG SER B 263 -14.961 9.609 -8.969 1.00 3.41 H new ATOM 2598 N GLY B 264 -12.357 9.168 -5.897 1.00 43.04 N ATOM 2599 CA GLY B 264 -11.916 10.154 -4.973 1.00 23.24 C ATOM 2600 C GLY B 264 -11.665 11.454 -5.672 1.00 44.02 C ATOM 2601 O GLY B 264 -11.579 11.492 -6.896 1.00 42.33 O ATOM 0 H GLY B 264 -11.798 9.095 -6.747 1.00 43.04 H new ATOM 0 HA2 GLY B 264 -12.666 10.292 -4.194 1.00 23.24 H new ATOM 0 HA3 GLY B 264 -11.004 9.817 -4.481 1.00 23.24 H new ATOM 2605 N SER B 265 -11.613 12.514 -4.932 1.00 50.34 N ATOM 2606 CA SER B 265 -11.348 13.817 -5.473 1.00 51.43 C ATOM 2607 C SER B 265 -10.536 14.632 -4.475 1.00 74.11 C ATOM 2608 O SER B 265 -10.472 14.277 -3.287 1.00 53.33 O ATOM 2609 CB SER B 265 -12.666 14.508 -5.822 1.00 32.15 C ATOM 2610 OG SER B 265 -13.383 13.723 -6.775 1.00 14.13 O ATOM 0 H SER B 265 -11.754 12.504 -3.922 1.00 50.34 H new ATOM 0 HA SER B 265 -10.763 13.726 -6.388 1.00 51.43 H new ATOM 0 HB2 SER B 265 -13.266 14.643 -4.922 1.00 32.15 H new ATOM 0 HB3 SER B 265 -12.471 15.501 -6.227 1.00 32.15 H new ATOM 0 HG SER B 265 -14.228 14.168 -6.996 1.00 14.13 H new ATOM 2616 N GLY B 266 -9.914 15.682 -4.939 1.00 74.15 N ATOM 2617 CA GLY B 266 -9.151 16.525 -4.069 1.00 34.43 C ATOM 2618 C GLY B 266 -7.777 16.792 -4.614 1.00 35.03 C ATOM 2619 O GLY B 266 -7.314 16.090 -5.526 1.00 42.42 O ATOM 0 H GLY B 266 -9.923 15.972 -5.917 1.00 74.15 H new ATOM 0 HA2 GLY B 266 -9.675 17.470 -3.927 1.00 34.43 H new ATOM 0 HA3 GLY B 266 -9.068 16.056 -3.089 1.00 34.43 H new ATOM 2623 N SER B 267 -7.126 17.793 -4.070 1.00 4.34 N ATOM 2624 CA SER B 267 -5.813 18.173 -4.497 1.00 3.04 C ATOM 2625 C SER B 267 -5.079 18.937 -3.384 1.00 1.44 C ATOM 2626 O SER B 267 -5.639 19.851 -2.761 1.00 72.22 O ATOM 2627 CB SER B 267 -5.914 19.018 -5.780 1.00 11.13 C ATOM 2628 OG SER B 267 -6.773 20.150 -5.586 1.00 60.14 O ATOM 0 H SER B 267 -7.501 18.366 -3.314 1.00 4.34 H new ATOM 0 HA SER B 267 -5.233 17.276 -4.714 1.00 3.04 H new ATOM 0 HB2 SER B 267 -4.921 19.357 -6.075 1.00 11.13 H new ATOM 0 HB3 SER B 267 -6.296 18.403 -6.595 1.00 11.13 H new ATOM 0 HG SER B 267 -6.819 20.671 -6.414 1.00 60.14 H new ATOM 2634 N GLY B 268 -3.858 18.548 -3.120 1.00 4.15 N ATOM 2635 CA GLY B 268 -3.056 19.236 -2.146 1.00 54.42 C ATOM 2636 C GLY B 268 -3.062 18.556 -0.801 1.00 41.24 C ATOM 2637 O GLY B 268 -2.364 17.555 -0.602 1.00 71.41 O ATOM 0 H GLY B 268 -3.398 17.756 -3.568 1.00 4.15 H new ATOM 0 HA2 GLY B 268 -2.031 19.305 -2.509 1.00 54.42 H new ATOM 0 HA3 GLY B 268 -3.423 20.256 -2.034 1.00 54.42 H new ATOM 2641 N THR B 269 -3.822 19.108 0.116 1.00 65.42 N ATOM 2642 CA THR B 269 -3.928 18.584 1.459 1.00 72.31 C ATOM 2643 C THR B 269 -5.266 17.876 1.726 1.00 71.35 C ATOM 2644 O THR B 269 -5.291 16.814 2.334 1.00 40.13 O ATOM 2645 CB THR B 269 -3.711 19.703 2.496 1.00 10.41 C ATOM 2646 OG1 THR B 269 -4.542 20.836 2.161 1.00 44.24 O ATOM 2647 CG2 THR B 269 -2.251 20.130 2.538 1.00 41.44 C ATOM 0 H THR B 269 -4.389 19.940 -0.050 1.00 65.42 H new ATOM 0 HA THR B 269 -3.144 17.833 1.558 1.00 72.31 H new ATOM 0 HB THR B 269 -3.984 19.323 3.480 1.00 10.41 H new ATOM 0 HG1 THR B 269 -4.406 21.548 2.821 1.00 44.24 H new ATOM 0 HG21 THR B 269 -2.124 20.921 3.278 1.00 41.44 H new ATOM 0 HG22 THR B 269 -1.630 19.276 2.809 1.00 41.44 H new ATOM 0 HG23 THR B 269 -1.952 20.499 1.557 1.00 41.44 H new ATOM 2655 N ASP B 270 -6.364 18.456 1.273 1.00 11.11 N ATOM 2656 CA ASP B 270 -7.685 17.873 1.534 1.00 35.43 C ATOM 2657 C ASP B 270 -8.109 16.962 0.397 1.00 33.53 C ATOM 2658 O ASP B 270 -7.995 17.323 -0.784 1.00 23.02 O ATOM 2659 CB ASP B 270 -8.726 18.987 1.743 1.00 53.43 C ATOM 2660 CG ASP B 270 -10.140 18.470 1.962 1.00 64.03 C ATOM 2661 OD1 ASP B 270 -10.496 18.138 3.108 1.00 11.42 O ATOM 2662 OD2 ASP B 270 -10.921 18.416 0.982 1.00 62.22 O ATOM 0 H ASP B 270 -6.377 19.319 0.729 1.00 11.11 H new ATOM 0 HA ASP B 270 -7.621 17.275 2.443 1.00 35.43 H new ATOM 0 HB2 ASP B 270 -8.432 19.590 2.602 1.00 53.43 H new ATOM 0 HB3 ASP B 270 -8.720 19.645 0.874 1.00 53.43 H new ATOM 2667 N PHE B 271 -8.591 15.789 0.748 1.00 44.32 N ATOM 2668 CA PHE B 271 -9.044 14.798 -0.207 1.00 72.31 C ATOM 2669 C PHE B 271 -10.348 14.182 0.240 1.00 3.04 C ATOM 2670 O PHE B 271 -10.633 14.106 1.435 1.00 12.03 O ATOM 2671 CB PHE B 271 -7.998 13.697 -0.397 1.00 13.15 C ATOM 2672 CG PHE B 271 -6.704 14.181 -0.968 1.00 1.35 C ATOM 2673 CD1 PHE B 271 -6.534 14.275 -2.336 1.00 63.22 C ATOM 2674 CD2 PHE B 271 -5.658 14.542 -0.139 1.00 12.24 C ATOM 2675 CE1 PHE B 271 -5.347 14.720 -2.866 1.00 61.21 C ATOM 2676 CE2 PHE B 271 -4.470 14.988 -0.662 1.00 52.24 C ATOM 2677 CZ PHE B 271 -4.315 15.077 -2.031 1.00 12.03 C ATOM 0 H PHE B 271 -8.681 15.492 1.720 1.00 44.32 H new ATOM 0 HA PHE B 271 -9.196 15.306 -1.159 1.00 72.31 H new ATOM 0 HB2 PHE B 271 -7.804 13.224 0.566 1.00 13.15 H new ATOM 0 HB3 PHE B 271 -8.408 12.929 -1.053 1.00 13.15 H new ATOM 0 HD1 PHE B 271 -7.342 13.996 -2.995 1.00 63.22 H new ATOM 0 HD2 PHE B 271 -5.777 14.472 0.932 1.00 12.24 H new ATOM 0 HE1 PHE B 271 -5.225 14.789 -3.937 1.00 61.21 H new ATOM 0 HE2 PHE B 271 -3.660 15.268 -0.005 1.00 52.24 H new ATOM 0 HZ PHE B 271 -3.382 15.428 -2.446 1.00 12.03 H new ATOM 2687 N THR B 272 -11.124 13.735 -0.696 1.00 24.15 N ATOM 2688 CA THR B 272 -12.384 13.122 -0.415 1.00 4.25 C ATOM 2689 C THR B 272 -12.525 11.829 -1.211 1.00 72.53 C ATOM 2690 O THR B 272 -12.356 11.816 -2.417 1.00 35.24 O ATOM 2691 CB THR B 272 -13.535 14.066 -0.798 1.00 24.11 C ATOM 2692 OG1 THR B 272 -13.340 15.332 -0.161 1.00 30.33 O ATOM 2693 CG2 THR B 272 -14.881 13.496 -0.368 1.00 14.02 C ATOM 0 H THR B 272 -10.898 13.786 -1.689 1.00 24.15 H new ATOM 0 HA THR B 272 -12.429 12.907 0.653 1.00 4.25 H new ATOM 0 HB THR B 272 -13.537 14.181 -1.882 1.00 24.11 H new ATOM 0 HG1 THR B 272 -14.072 15.937 -0.404 1.00 30.33 H new ATOM 0 HG21 THR B 272 -15.676 14.186 -0.652 1.00 14.02 H new ATOM 0 HG22 THR B 272 -15.042 12.535 -0.857 1.00 14.02 H new ATOM 0 HG23 THR B 272 -14.889 13.359 0.713 1.00 14.02 H new ATOM 2701 N PHE B 273 -12.797 10.778 -0.518 1.00 54.11 N ATOM 2702 CA PHE B 273 -13.069 9.491 -1.088 1.00 5.02 C ATOM 2703 C PHE B 273 -14.537 9.244 -0.949 1.00 4.22 C ATOM 2704 O PHE B 273 -15.089 9.377 0.149 1.00 43.24 O ATOM 2705 CB PHE B 273 -12.285 8.433 -0.333 1.00 40.24 C ATOM 2706 CG PHE B 273 -12.645 7.012 -0.630 1.00 54.21 C ATOM 2707 CD1 PHE B 273 -12.094 6.320 -1.698 1.00 72.43 C ATOM 2708 CD2 PHE B 273 -13.528 6.361 0.197 1.00 2.13 C ATOM 2709 CE1 PHE B 273 -12.436 4.998 -1.916 1.00 0.34 C ATOM 2710 CE2 PHE B 273 -13.874 5.064 -0.012 1.00 54.31 C ATOM 2711 CZ PHE B 273 -13.334 4.375 -1.060 1.00 24.44 C ATOM 0 H PHE B 273 -12.839 10.785 0.501 1.00 54.11 H new ATOM 0 HA PHE B 273 -12.776 9.453 -2.137 1.00 5.02 H new ATOM 0 HB2 PHE B 273 -11.226 8.571 -0.549 1.00 40.24 H new ATOM 0 HB3 PHE B 273 -12.417 8.605 0.735 1.00 40.24 H new ATOM 0 HD1 PHE B 273 -11.398 6.814 -2.360 1.00 72.43 H new ATOM 0 HD2 PHE B 273 -13.957 6.893 1.033 1.00 2.13 H new ATOM 0 HE1 PHE B 273 -12.008 4.455 -2.745 1.00 0.34 H new ATOM 0 HE2 PHE B 273 -14.576 4.578 0.650 1.00 54.31 H new ATOM 0 HZ PHE B 273 -13.606 3.343 -1.223 1.00 24.44 H new ATOM 2721 N THR B 274 -15.177 8.925 -2.012 1.00 1.31 N ATOM 2722 CA THR B 274 -16.561 8.722 -1.948 1.00 40.44 C ATOM 2723 C THR B 274 -16.993 7.429 -2.652 1.00 12.35 C ATOM 2724 O THR B 274 -16.551 7.122 -3.778 1.00 31.10 O ATOM 2725 CB THR B 274 -17.331 9.964 -2.477 1.00 13.33 C ATOM 2726 OG1 THR B 274 -18.729 9.773 -2.331 1.00 43.40 O ATOM 2727 CG2 THR B 274 -17.000 10.245 -3.930 1.00 74.03 C ATOM 0 H THR B 274 -14.758 8.801 -2.934 1.00 1.31 H new ATOM 0 HA THR B 274 -16.824 8.596 -0.898 1.00 40.44 H new ATOM 0 HB THR B 274 -17.019 10.824 -1.885 1.00 13.33 H new ATOM 0 HG1 THR B 274 -18.913 9.348 -1.467 1.00 43.40 H new ATOM 0 HG21 THR B 274 -17.556 11.120 -4.267 1.00 74.03 H new ATOM 0 HG22 THR B 274 -15.931 10.434 -4.030 1.00 74.03 H new ATOM 0 HG23 THR B 274 -17.275 9.384 -4.539 1.00 74.03 H new ATOM 2735 N ILE B 275 -17.811 6.658 -1.978 1.00 40.32 N ATOM 2736 CA ILE B 275 -18.398 5.491 -2.566 1.00 63.31 C ATOM 2737 C ILE B 275 -19.809 5.891 -2.942 1.00 4.12 C ATOM 2738 O ILE B 275 -20.614 6.160 -2.067 1.00 53.43 O ATOM 2739 CB ILE B 275 -18.448 4.311 -1.548 1.00 52.41 C ATOM 2740 CG1 ILE B 275 -17.043 3.980 -1.039 1.00 11.40 C ATOM 2741 CG2 ILE B 275 -19.094 3.078 -2.171 1.00 3.12 C ATOM 2742 CD1 ILE B 275 -17.011 2.911 0.041 1.00 20.10 C ATOM 0 H ILE B 275 -18.085 6.826 -1.010 1.00 40.32 H new ATOM 0 HA ILE B 275 -17.815 5.152 -3.423 1.00 63.31 H new ATOM 0 HB ILE B 275 -19.060 4.622 -0.701 1.00 52.41 H new ATOM 0 HG12 ILE B 275 -16.432 3.651 -1.879 1.00 11.40 H new ATOM 0 HG13 ILE B 275 -16.586 4.889 -0.649 1.00 11.40 H new ATOM 0 HG21 ILE B 275 -19.116 2.270 -1.440 1.00 3.12 H new ATOM 0 HG22 ILE B 275 -20.112 3.317 -2.479 1.00 3.12 H new ATOM 0 HG23 ILE B 275 -18.516 2.765 -3.040 1.00 3.12 H new ATOM 0 HD11 ILE B 275 -15.980 2.734 0.348 1.00 20.10 H new ATOM 0 HD12 ILE B 275 -17.593 3.244 0.900 1.00 20.10 H new ATOM 0 HD13 ILE B 275 -17.437 1.987 -0.349 1.00 20.10 H new ATOM 2754 N SER B 276 -20.097 5.957 -4.221 1.00 12.52 N ATOM 2755 CA SER B 276 -21.389 6.427 -4.670 1.00 72.34 C ATOM 2756 C SER B 276 -22.480 5.391 -4.414 1.00 10.24 C ATOM 2757 O SER B 276 -23.577 5.733 -3.969 1.00 30.45 O ATOM 2758 CB SER B 276 -21.331 6.828 -6.161 1.00 44.14 C ATOM 2759 OG SER B 276 -22.584 7.338 -6.635 1.00 20.32 O ATOM 0 H SER B 276 -19.456 5.692 -4.969 1.00 12.52 H new ATOM 0 HA SER B 276 -21.646 7.313 -4.090 1.00 72.34 H new ATOM 0 HB2 SER B 276 -20.557 7.582 -6.302 1.00 44.14 H new ATOM 0 HB3 SER B 276 -21.045 5.962 -6.757 1.00 44.14 H new ATOM 0 HG SER B 276 -22.502 7.580 -7.581 1.00 20.32 H new ATOM 2765 N SER B 277 -22.181 4.153 -4.683 1.00 24.52 N ATOM 2766 CA SER B 277 -23.104 3.090 -4.432 1.00 71.41 C ATOM 2767 C SER B 277 -22.515 2.163 -3.404 1.00 34.12 C ATOM 2768 O SER B 277 -21.634 1.377 -3.721 1.00 1.34 O ATOM 2769 CB SER B 277 -23.414 2.345 -5.728 1.00 72.33 C ATOM 2770 OG SER B 277 -23.924 3.246 -6.706 1.00 54.41 O ATOM 0 H SER B 277 -21.291 3.855 -5.082 1.00 24.52 H new ATOM 0 HA SER B 277 -24.041 3.495 -4.049 1.00 71.41 H new ATOM 0 HB2 SER B 277 -22.511 1.863 -6.103 1.00 72.33 H new ATOM 0 HB3 SER B 277 -24.141 1.556 -5.537 1.00 72.33 H new ATOM 0 HG SER B 277 -24.117 2.756 -7.533 1.00 54.41 H new ATOM 2776 N LEU B 278 -22.937 2.291 -2.171 1.00 23.30 N ATOM 2777 CA LEU B 278 -22.400 1.441 -1.143 1.00 4.34 C ATOM 2778 C LEU B 278 -23.055 0.075 -1.198 1.00 71.35 C ATOM 2779 O LEU B 278 -24.291 -0.041 -1.110 1.00 1.24 O ATOM 2780 CB LEU B 278 -22.590 2.076 0.233 1.00 20.43 C ATOM 2781 CG LEU B 278 -22.012 1.296 1.409 1.00 51.42 C ATOM 2782 CD1 LEU B 278 -20.520 1.093 1.220 1.00 3.21 C ATOM 2783 CD2 LEU B 278 -22.284 2.029 2.705 1.00 41.12 C ATOM 0 H LEU B 278 -23.638 2.963 -1.860 1.00 23.30 H new ATOM 0 HA LEU B 278 -21.331 1.319 -1.315 1.00 4.34 H new ATOM 0 HB2 LEU B 278 -22.137 3.067 0.221 1.00 20.43 H new ATOM 0 HB3 LEU B 278 -23.657 2.216 0.404 1.00 20.43 H new ATOM 0 HG LEU B 278 -22.493 0.319 1.454 1.00 51.42 H new ATOM 0 HD11 LEU B 278 -20.119 0.535 2.066 1.00 3.21 H new ATOM 0 HD12 LEU B 278 -20.342 0.536 0.300 1.00 3.21 H new ATOM 0 HD13 LEU B 278 -20.026 2.063 1.158 1.00 3.21 H new ATOM 0 HD21 LEU B 278 -21.867 1.463 3.538 1.00 41.12 H new ATOM 0 HD22 LEU B 278 -21.822 3.015 2.669 1.00 41.12 H new ATOM 0 HD23 LEU B 278 -23.360 2.137 2.843 1.00 41.12 H new ATOM 2795 N GLN B 279 -22.238 -0.941 -1.337 1.00 15.31 N ATOM 2796 CA GLN B 279 -22.690 -2.302 -1.408 1.00 62.11 C ATOM 2797 C GLN B 279 -22.142 -3.104 -0.240 1.00 72.23 C ATOM 2798 O GLN B 279 -21.151 -2.714 0.369 1.00 14.52 O ATOM 2799 CB GLN B 279 -22.277 -2.952 -2.740 1.00 60.44 C ATOM 2800 CG GLN B 279 -22.862 -2.274 -3.959 1.00 52.14 C ATOM 2801 CD GLN B 279 -24.374 -2.199 -3.923 1.00 34.41 C ATOM 2802 OE1 GLN B 279 -25.049 -3.054 -3.346 1.00 71.45 O ATOM 2803 NE2 GLN B 279 -24.911 -1.192 -4.543 1.00 5.41 N ATOM 0 H GLN B 279 -21.225 -0.840 -1.405 1.00 15.31 H new ATOM 0 HA GLN B 279 -23.779 -2.299 -1.353 1.00 62.11 H new ATOM 0 HB2 GLN B 279 -21.190 -2.941 -2.817 1.00 60.44 H new ATOM 0 HB3 GLN B 279 -22.586 -3.997 -2.734 1.00 60.44 H new ATOM 0 HG2 GLN B 279 -22.455 -1.266 -4.038 1.00 52.14 H new ATOM 0 HG3 GLN B 279 -22.551 -2.814 -4.853 1.00 52.14 H new ATOM 0 HE21 GLN B 279 -24.318 -0.505 -5.009 1.00 5.41 H new ATOM 0 HE22 GLN B 279 -25.925 -1.088 -4.564 1.00 5.41 H new ATOM 2812 N PRO B 280 -22.800 -4.227 0.115 1.00 62.25 N ATOM 2813 CA PRO B 280 -22.357 -5.119 1.207 1.00 55.15 C ATOM 2814 C PRO B 280 -20.886 -5.540 1.066 1.00 41.52 C ATOM 2815 O PRO B 280 -20.190 -5.755 2.063 1.00 62.04 O ATOM 2816 CB PRO B 280 -23.274 -6.330 1.060 1.00 24.42 C ATOM 2817 CG PRO B 280 -24.507 -5.778 0.445 1.00 24.54 C ATOM 2818 CD PRO B 280 -24.048 -4.722 -0.507 1.00 41.31 C ATOM 0 HA PRO B 280 -22.417 -4.632 2.180 1.00 55.15 H new ATOM 0 HB2 PRO B 280 -22.823 -7.097 0.430 1.00 24.42 H new ATOM 0 HB3 PRO B 280 -23.482 -6.792 2.025 1.00 24.42 H new ATOM 0 HG2 PRO B 280 -25.067 -6.556 -0.074 1.00 24.54 H new ATOM 0 HG3 PRO B 280 -25.169 -5.360 1.203 1.00 24.54 H new ATOM 0 HD2 PRO B 280 -23.869 -5.128 -1.503 1.00 41.31 H new ATOM 0 HD3 PRO B 280 -24.787 -3.928 -0.615 1.00 41.31 H new ATOM 2826 N GLU B 281 -20.420 -5.637 -0.173 1.00 32.02 N ATOM 2827 CA GLU B 281 -19.049 -6.053 -0.465 1.00 32.32 C ATOM 2828 C GLU B 281 -18.043 -4.937 -0.163 1.00 23.03 C ATOM 2829 O GLU B 281 -16.829 -5.132 -0.283 1.00 12.21 O ATOM 2830 CB GLU B 281 -18.913 -6.450 -1.932 1.00 60.31 C ATOM 2831 CG GLU B 281 -19.877 -7.526 -2.380 1.00 54.20 C ATOM 2832 CD GLU B 281 -19.611 -7.972 -3.793 1.00 23.14 C ATOM 2833 OE1 GLU B 281 -19.996 -7.268 -4.742 1.00 3.13 O ATOM 2834 OE2 GLU B 281 -19.003 -9.043 -3.975 1.00 31.41 O ATOM 0 H GLU B 281 -20.977 -5.431 -1.002 1.00 32.02 H new ATOM 0 HA GLU B 281 -18.831 -6.907 0.176 1.00 32.32 H new ATOM 0 HB2 GLU B 281 -19.062 -5.565 -2.551 1.00 60.31 H new ATOM 0 HB3 GLU B 281 -17.894 -6.795 -2.110 1.00 60.31 H new ATOM 0 HG2 GLU B 281 -19.801 -8.382 -1.710 1.00 54.20 H new ATOM 0 HG3 GLU B 281 -20.898 -7.152 -2.305 1.00 54.20 H new ATOM 2841 N ASP B 282 -18.539 -3.780 0.220 1.00 30.30 N ATOM 2842 CA ASP B 282 -17.675 -2.645 0.493 1.00 13.12 C ATOM 2843 C ASP B 282 -17.444 -2.482 1.979 1.00 71.34 C ATOM 2844 O ASP B 282 -16.849 -1.493 2.417 1.00 64.32 O ATOM 2845 CB ASP B 282 -18.243 -1.349 -0.092 1.00 21.43 C ATOM 2846 CG ASP B 282 -18.451 -1.419 -1.583 1.00 31.41 C ATOM 2847 OD1 ASP B 282 -17.523 -1.830 -2.306 1.00 54.25 O ATOM 2848 OD2 ASP B 282 -19.554 -1.102 -2.050 1.00 21.31 O ATOM 0 H ASP B 282 -19.534 -3.598 0.350 1.00 30.30 H new ATOM 0 HA ASP B 282 -16.720 -2.848 0.009 1.00 13.12 H new ATOM 0 HB2 ASP B 282 -19.193 -1.124 0.392 1.00 21.43 H new ATOM 0 HB3 ASP B 282 -17.566 -0.526 0.137 1.00 21.43 H new ATOM 2853 N ILE B 283 -17.905 -3.446 2.767 1.00 41.45 N ATOM 2854 CA ILE B 283 -17.670 -3.402 4.196 1.00 44.34 C ATOM 2855 C ILE B 283 -16.237 -3.775 4.476 1.00 0.02 C ATOM 2856 O ILE B 283 -15.842 -4.948 4.326 1.00 41.41 O ATOM 2857 CB ILE B 283 -18.622 -4.314 5.017 1.00 44.04 C ATOM 2858 CG1 ILE B 283 -20.078 -3.878 4.833 1.00 53.12 C ATOM 2859 CG2 ILE B 283 -18.239 -4.268 6.502 1.00 71.34 C ATOM 2860 CD1 ILE B 283 -20.332 -2.470 5.275 1.00 11.55 C ATOM 0 H ILE B 283 -18.436 -4.254 2.442 1.00 41.45 H new ATOM 0 HA ILE B 283 -17.877 -2.381 4.517 1.00 44.34 H new ATOM 0 HB ILE B 283 -18.522 -5.337 4.655 1.00 44.04 H new ATOM 0 HG12 ILE B 283 -20.350 -3.977 3.782 1.00 53.12 H new ATOM 0 HG13 ILE B 283 -20.726 -4.551 5.395 1.00 53.12 H new ATOM 0 HG21 ILE B 283 -18.911 -4.910 7.071 1.00 71.34 H new ATOM 0 HG22 ILE B 283 -17.214 -4.617 6.624 1.00 71.34 H new ATOM 0 HG23 ILE B 283 -18.320 -3.244 6.867 1.00 71.34 H new ATOM 0 HD11 ILE B 283 -21.382 -2.223 5.118 1.00 11.55 H new ATOM 0 HD12 ILE B 283 -20.090 -2.372 6.333 1.00 11.55 H new ATOM 0 HD13 ILE B 283 -19.709 -1.789 4.696 1.00 11.55 H new ATOM 2872 N ALA B 284 -15.467 -2.785 4.849 1.00 20.51 N ATOM 2873 CA ALA B 284 -14.073 -2.944 5.107 1.00 61.52 C ATOM 2874 C ALA B 284 -13.542 -1.718 5.821 1.00 73.51 C ATOM 2875 O ALA B 284 -14.315 -0.873 6.290 1.00 73.35 O ATOM 2876 CB ALA B 284 -13.351 -3.107 3.790 1.00 2.03 C ATOM 0 H ALA B 284 -15.805 -1.832 4.982 1.00 20.51 H new ATOM 0 HA ALA B 284 -13.913 -3.821 5.734 1.00 61.52 H new ATOM 0 HB1 ALA B 284 -12.283 -3.230 3.973 1.00 2.03 H new ATOM 0 HB2 ALA B 284 -13.734 -3.986 3.272 1.00 2.03 H new ATOM 0 HB3 ALA B 284 -13.514 -2.223 3.174 1.00 2.03 H new ATOM 2882 N THR B 285 -12.242 -1.641 5.929 1.00 33.21 N ATOM 2883 CA THR B 285 -11.585 -0.494 6.469 1.00 32.42 C ATOM 2884 C THR B 285 -10.825 0.203 5.321 1.00 53.04 C ATOM 2885 O THR B 285 -10.021 -0.438 4.616 1.00 75.44 O ATOM 2886 CB THR B 285 -10.584 -0.917 7.559 1.00 22.52 C ATOM 2887 OG1 THR B 285 -11.238 -1.765 8.504 1.00 54.21 O ATOM 2888 CG2 THR B 285 -10.038 0.300 8.289 1.00 74.31 C ATOM 0 H THR B 285 -11.607 -2.385 5.639 1.00 33.21 H new ATOM 0 HA THR B 285 -12.318 0.179 6.914 1.00 32.42 H new ATOM 0 HB THR B 285 -9.760 -1.447 7.082 1.00 22.52 H new ATOM 0 HG1 THR B 285 -10.600 -2.036 9.197 1.00 54.21 H new ATOM 0 HG21 THR B 285 -9.332 -0.021 9.055 1.00 74.31 H new ATOM 0 HG22 THR B 285 -9.530 0.953 7.579 1.00 74.31 H new ATOM 0 HG23 THR B 285 -10.859 0.842 8.757 1.00 74.31 H new ATOM 2896 N TYR B 286 -11.066 1.482 5.142 1.00 41.14 N ATOM 2897 CA TYR B 286 -10.438 2.251 4.069 1.00 10.22 C ATOM 2898 C TYR B 286 -9.318 3.086 4.595 1.00 44.11 C ATOM 2899 O TYR B 286 -9.328 3.495 5.747 1.00 23.30 O ATOM 2900 CB TYR B 286 -11.472 3.079 3.312 1.00 21.20 C ATOM 2901 CG TYR B 286 -12.430 2.198 2.561 1.00 23.51 C ATOM 2902 CD1 TYR B 286 -13.556 1.670 3.178 1.00 10.04 C ATOM 2903 CD2 TYR B 286 -12.186 1.860 1.243 1.00 20.22 C ATOM 2904 CE1 TYR B 286 -14.410 0.838 2.496 1.00 54.52 C ATOM 2905 CE2 TYR B 286 -13.031 1.024 0.559 1.00 3.50 C ATOM 2906 CZ TYR B 286 -14.141 0.518 1.189 1.00 42.12 C ATOM 2907 OH TYR B 286 -14.968 -0.328 0.514 1.00 13.00 O ATOM 0 H TYR B 286 -11.699 2.025 5.729 1.00 41.14 H new ATOM 0 HA TYR B 286 -10.005 1.552 3.353 1.00 10.22 H new ATOM 0 HB2 TYR B 286 -12.023 3.706 4.013 1.00 21.20 H new ATOM 0 HB3 TYR B 286 -10.967 3.748 2.615 1.00 21.20 H new ATOM 0 HD1 TYR B 286 -13.763 1.917 4.209 1.00 10.04 H new ATOM 0 HD2 TYR B 286 -11.316 2.261 0.744 1.00 20.22 H new ATOM 0 HE1 TYR B 286 -15.286 0.439 2.985 1.00 54.52 H new ATOM 0 HE2 TYR B 286 -12.825 0.765 -0.469 1.00 3.50 H new ATOM 0 HH TYR B 286 -15.607 -0.729 1.140 1.00 13.00 H new ATOM 2917 N HIS B 287 -8.310 3.294 3.777 1.00 4.22 N ATOM 2918 CA HIS B 287 -7.113 3.960 4.239 1.00 61.12 C ATOM 2919 C HIS B 287 -6.582 4.830 3.145 1.00 1.44 C ATOM 2920 O HIS B 287 -6.455 4.372 2.002 1.00 61.12 O ATOM 2921 CB HIS B 287 -5.991 2.939 4.565 1.00 44.20 C ATOM 2922 CG HIS B 287 -6.436 1.548 4.923 1.00 43.50 C ATOM 2923 ND1 HIS B 287 -6.710 1.116 6.193 1.00 34.42 N ATOM 2924 CD2 HIS B 287 -6.659 0.486 4.123 1.00 61.22 C ATOM 2925 CE1 HIS B 287 -7.083 -0.157 6.135 1.00 61.54 C ATOM 2926 NE2 HIS B 287 -7.054 -0.543 4.896 1.00 11.33 N ATOM 0 H HIS B 287 -8.295 3.014 2.796 1.00 4.22 H new ATOM 0 HA HIS B 287 -7.378 4.529 5.130 1.00 61.12 H new ATOM 0 HB2 HIS B 287 -5.327 2.874 3.703 1.00 44.20 H new ATOM 0 HB3 HIS B 287 -5.401 3.333 5.393 1.00 44.20 H new ATOM 0 HD1 HIS B 287 -6.639 1.678 7.041 1.00 34.42 H new ATOM 0 HD2 HIS B 287 -6.541 0.464 3.050 1.00 61.22 H new ATOM 0 HE1 HIS B 287 -7.364 -0.770 6.979 1.00 61.54 H new ATOM 2935 N CYS B 288 -6.278 6.047 3.469 1.00 15.30 N ATOM 2936 CA CYS B 288 -5.633 6.941 2.543 1.00 24.32 C ATOM 2937 C CYS B 288 -4.131 6.905 2.818 1.00 73.10 C ATOM 2938 O CYS B 288 -3.720 6.868 3.988 1.00 52.35 O ATOM 2939 CB CYS B 288 -6.184 8.364 2.728 1.00 12.13 C ATOM 2940 SG CYS B 288 -6.018 9.022 4.418 1.00 33.10 S ATOM 0 H CYS B 288 -6.468 6.456 4.384 1.00 15.30 H new ATOM 0 HA CYS B 288 -5.826 6.635 1.515 1.00 24.32 H new ATOM 0 HB2 CYS B 288 -5.668 9.033 2.039 1.00 12.13 H new ATOM 0 HB3 CYS B 288 -7.238 8.371 2.450 1.00 12.13 H new ATOM 2945 N GLN B 289 -3.328 6.851 1.780 1.00 72.25 N ATOM 2946 CA GLN B 289 -1.886 6.860 1.934 1.00 1.44 C ATOM 2947 C GLN B 289 -1.290 7.786 0.897 1.00 4.50 C ATOM 2948 O GLN B 289 -1.820 7.894 -0.213 1.00 42.12 O ATOM 2949 CB GLN B 289 -1.299 5.419 1.844 1.00 71.11 C ATOM 2950 CG GLN B 289 -1.294 4.725 0.472 1.00 73.43 C ATOM 2951 CD GLN B 289 -0.114 5.107 -0.444 1.00 75.34 C ATOM 2952 OE1 GLN B 289 -0.178 6.031 -1.240 1.00 72.30 O ATOM 2953 NE2 GLN B 289 0.968 4.380 -0.328 1.00 61.22 N ATOM 0 H GLN B 289 -3.649 6.800 0.813 1.00 72.25 H new ATOM 0 HA GLN B 289 -1.625 7.232 2.925 1.00 1.44 H new ATOM 0 HB2 GLN B 289 -0.271 5.454 2.204 1.00 71.11 H new ATOM 0 HB3 GLN B 289 -1.857 4.788 2.535 1.00 71.11 H new ATOM 0 HG2 GLN B 289 -1.280 3.646 0.627 1.00 73.43 H new ATOM 0 HG3 GLN B 289 -2.226 4.962 -0.042 1.00 73.43 H new ATOM 0 HE21 GLN B 289 0.998 3.613 0.344 1.00 61.22 H new ATOM 0 HE22 GLN B 289 1.782 4.580 -0.910 1.00 61.22 H new ATOM 2962 N GLN B 290 -0.271 8.501 1.256 1.00 43.20 N ATOM 2963 CA GLN B 290 0.398 9.379 0.321 1.00 20.00 C ATOM 2964 C GLN B 290 1.610 8.724 -0.311 1.00 14.11 C ATOM 2965 O GLN B 290 2.188 7.819 0.259 1.00 41.23 O ATOM 2966 CB GLN B 290 0.747 10.746 0.952 1.00 43.20 C ATOM 2967 CG GLN B 290 1.248 10.737 2.410 1.00 40.23 C ATOM 2968 CD GLN B 290 2.432 9.853 2.686 1.00 24.35 C ATOM 2969 OE1 GLN B 290 2.265 8.711 3.005 1.00 4.33 O ATOM 2970 NE2 GLN B 290 3.625 10.390 2.611 1.00 43.23 N ATOM 0 H GLN B 290 0.126 8.500 2.196 1.00 43.20 H new ATOM 0 HA GLN B 290 -0.312 9.574 -0.483 1.00 20.00 H new ATOM 0 HB2 GLN B 290 1.511 11.219 0.334 1.00 43.20 H new ATOM 0 HB3 GLN B 290 -0.140 11.378 0.902 1.00 43.20 H new ATOM 0 HG2 GLN B 290 1.506 11.758 2.693 1.00 40.23 H new ATOM 0 HG3 GLN B 290 0.427 10.425 3.055 1.00 40.23 H new ATOM 0 HE21 GLN B 290 3.728 11.367 2.336 1.00 43.23 H new ATOM 0 HE22 GLN B 290 4.450 9.831 2.828 1.00 43.23 H new ATOM 2979 N TYR B 291 1.983 9.156 -1.509 1.00 31.23 N ATOM 2980 CA TYR B 291 3.187 8.613 -2.109 1.00 42.35 C ATOM 2981 C TYR B 291 4.062 9.686 -2.738 1.00 13.53 C ATOM 2982 O TYR B 291 4.922 9.398 -3.572 1.00 10.24 O ATOM 2983 CB TYR B 291 2.927 7.438 -3.067 1.00 63.33 C ATOM 2984 CG TYR B 291 2.212 7.738 -4.367 1.00 3.34 C ATOM 2985 CD1 TYR B 291 0.846 7.903 -4.415 1.00 42.24 C ATOM 2986 CD2 TYR B 291 2.922 7.822 -5.558 1.00 71.13 C ATOM 2987 CE1 TYR B 291 0.199 8.149 -5.610 1.00 54.11 C ATOM 2988 CE2 TYR B 291 2.291 8.061 -6.750 1.00 11.54 C ATOM 2989 CZ TYR B 291 0.931 8.225 -6.782 1.00 30.34 C ATOM 2990 OH TYR B 291 0.301 8.459 -7.998 1.00 43.31 O ATOM 0 H TYR B 291 1.489 9.854 -2.064 1.00 31.23 H new ATOM 0 HA TYR B 291 3.752 8.191 -1.278 1.00 42.35 H new ATOM 0 HB2 TYR B 291 3.888 6.983 -3.309 1.00 63.33 H new ATOM 0 HB3 TYR B 291 2.346 6.689 -2.529 1.00 63.33 H new ATOM 0 HD1 TYR B 291 0.271 7.839 -3.503 1.00 42.24 H new ATOM 0 HD2 TYR B 291 3.995 7.696 -5.544 1.00 71.13 H new ATOM 0 HE1 TYR B 291 -0.873 8.281 -5.630 1.00 54.11 H new ATOM 0 HE2 TYR B 291 2.865 8.120 -7.663 1.00 11.54 H new ATOM 0 HH TYR B 291 -0.233 9.278 -7.937 1.00 43.31 H new ATOM 3000 N ASP B 292 3.889 10.909 -2.284 1.00 41.43 N ATOM 3001 CA ASP B 292 4.724 12.009 -2.762 1.00 64.51 C ATOM 3002 C ASP B 292 6.140 11.938 -2.157 1.00 24.21 C ATOM 3003 O ASP B 292 7.133 12.020 -2.878 1.00 22.44 O ATOM 3004 CB ASP B 292 4.061 13.397 -2.517 1.00 75.41 C ATOM 3005 CG ASP B 292 4.986 14.570 -2.830 1.00 11.40 C ATOM 3006 OD1 ASP B 292 5.749 14.984 -1.937 1.00 60.22 O ATOM 3007 OD2 ASP B 292 4.935 15.110 -3.957 1.00 22.41 O ATOM 0 H ASP B 292 3.188 11.173 -1.592 1.00 41.43 H new ATOM 0 HA ASP B 292 4.821 11.895 -3.842 1.00 64.51 H new ATOM 0 HB2 ASP B 292 3.164 13.477 -3.130 1.00 75.41 H new ATOM 0 HB3 ASP B 292 3.743 13.462 -1.477 1.00 75.41 H new ATOM 3012 N ASN B 293 6.231 11.714 -0.854 1.00 52.13 N ATOM 3013 CA ASN B 293 7.539 11.702 -0.174 1.00 61.01 C ATOM 3014 C ASN B 293 7.544 10.692 0.974 1.00 23.43 C ATOM 3015 O ASN B 293 6.521 10.506 1.640 1.00 32.15 O ATOM 3016 CB ASN B 293 7.884 13.105 0.365 1.00 73.41 C ATOM 3017 CG ASN B 293 9.280 13.174 0.978 1.00 65.42 C ATOM 3018 OD1 ASN B 293 10.196 12.462 0.554 1.00 71.10 O ATOM 3019 ND2 ASN B 293 9.455 14.009 1.970 1.00 45.34 N ATOM 0 H ASN B 293 5.432 11.539 -0.244 1.00 52.13 H new ATOM 0 HA ASN B 293 8.293 11.408 -0.904 1.00 61.01 H new ATOM 0 HB2 ASN B 293 7.812 13.829 -0.446 1.00 73.41 H new ATOM 0 HB3 ASN B 293 7.148 13.393 1.115 1.00 73.41 H new ATOM 0 HD21 ASN B 293 10.369 14.086 2.417 1.00 45.34 H new ATOM 0 HD22 ASN B 293 8.678 14.583 2.297 1.00 45.34 H new ATOM 3026 N LEU B 294 8.691 10.055 1.202 1.00 13.44 N ATOM 3027 CA LEU B 294 8.856 9.071 2.261 1.00 22.44 C ATOM 3028 C LEU B 294 9.159 9.740 3.601 1.00 52.32 C ATOM 3029 O LEU B 294 9.702 10.848 3.643 1.00 32.40 O ATOM 3030 CB LEU B 294 9.992 8.058 1.932 1.00 14.42 C ATOM 3031 CG LEU B 294 9.722 6.981 0.865 1.00 12.12 C ATOM 3032 CD1 LEU B 294 9.501 7.551 -0.503 1.00 43.42 C ATOM 3033 CD2 LEU B 294 10.832 5.962 0.834 1.00 34.42 C ATOM 0 H LEU B 294 9.535 10.211 0.651 1.00 13.44 H new ATOM 0 HA LEU B 294 7.911 8.533 2.333 1.00 22.44 H new ATOM 0 HB2 LEU B 294 10.865 8.629 1.615 1.00 14.42 H new ATOM 0 HB3 LEU B 294 10.262 7.549 2.857 1.00 14.42 H new ATOM 0 HG LEU B 294 8.793 6.491 1.157 1.00 12.12 H new ATOM 0 HD11 LEU B 294 9.316 6.741 -1.209 1.00 43.42 H new ATOM 0 HD12 LEU B 294 8.640 8.219 -0.484 1.00 43.42 H new ATOM 0 HD13 LEU B 294 10.386 8.107 -0.813 1.00 43.42 H new ATOM 0 HD21 LEU B 294 10.617 5.213 0.072 1.00 34.42 H new ATOM 0 HD22 LEU B 294 11.774 6.457 0.600 1.00 34.42 H new ATOM 0 HD23 LEU B 294 10.909 5.478 1.808 1.00 34.42 H new ATOM 3045 N PRO B 295 8.795 9.082 4.720 1.00 73.34 N ATOM 3046 CA PRO B 295 8.082 7.798 4.700 1.00 75.21 C ATOM 3047 C PRO B 295 6.600 7.963 4.368 1.00 65.41 C ATOM 3048 O PRO B 295 6.005 9.030 4.597 1.00 54.51 O ATOM 3049 CB PRO B 295 8.243 7.276 6.127 1.00 24.15 C ATOM 3050 CG PRO B 295 8.397 8.498 6.961 1.00 0.12 C ATOM 3051 CD PRO B 295 9.078 9.528 6.094 1.00 54.24 C ATOM 0 HA PRO B 295 8.478 7.128 3.937 1.00 75.21 H new ATOM 0 HB2 PRO B 295 7.375 6.693 6.436 1.00 24.15 H new ATOM 0 HB3 PRO B 295 9.113 6.625 6.215 1.00 24.15 H new ATOM 0 HG2 PRO B 295 7.427 8.859 7.302 1.00 0.12 H new ATOM 0 HG3 PRO B 295 8.990 8.288 7.851 1.00 0.12 H new ATOM 0 HD2 PRO B 295 8.684 10.528 6.278 1.00 54.24 H new ATOM 0 HD3 PRO B 295 10.150 9.567 6.288 1.00 54.24 H new ATOM 3059 N TYR B 296 6.014 6.926 3.821 1.00 14.11 N ATOM 3060 CA TYR B 296 4.618 6.958 3.509 1.00 53.34 C ATOM 3061 C TYR B 296 3.862 6.403 4.673 1.00 40.43 C ATOM 3062 O TYR B 296 4.281 5.396 5.267 1.00 45.03 O ATOM 3063 CB TYR B 296 4.283 6.150 2.264 1.00 62.13 C ATOM 3064 CG TYR B 296 5.052 6.527 1.024 1.00 1.15 C ATOM 3065 CD1 TYR B 296 5.219 7.843 0.667 1.00 2.42 C ATOM 3066 CD2 TYR B 296 5.581 5.555 0.190 1.00 25.54 C ATOM 3067 CE1 TYR B 296 5.886 8.181 -0.474 1.00 42.20 C ATOM 3068 CE2 TYR B 296 6.247 5.891 -0.947 1.00 13.22 C ATOM 3069 CZ TYR B 296 6.394 7.206 -1.277 1.00 43.45 C ATOM 3070 OH TYR B 296 7.057 7.544 -2.424 1.00 42.24 O ATOM 0 H TYR B 296 6.487 6.053 3.585 1.00 14.11 H new ATOM 0 HA TYR B 296 4.339 7.992 3.309 1.00 53.34 H new ATOM 0 HB2 TYR B 296 4.462 5.096 2.476 1.00 62.13 H new ATOM 0 HB3 TYR B 296 3.218 6.257 2.057 1.00 62.13 H new ATOM 0 HD1 TYR B 296 4.817 8.621 1.299 1.00 2.42 H new ATOM 0 HD2 TYR B 296 5.462 4.513 0.447 1.00 25.54 H new ATOM 0 HE1 TYR B 296 6.011 9.220 -0.740 1.00 42.20 H new ATOM 0 HE2 TYR B 296 6.657 5.122 -1.584 1.00 13.22 H new ATOM 0 HH TYR B 296 7.356 6.730 -2.881 1.00 42.24 H new ATOM 3080 N THR B 297 2.788 7.034 5.013 1.00 60.20 N ATOM 3081 CA THR B 297 2.010 6.611 6.127 1.00 64.03 C ATOM 3082 C THR B 297 0.557 6.428 5.690 1.00 71.41 C ATOM 3083 O THR B 297 0.154 6.896 4.620 1.00 32.11 O ATOM 3084 CB THR B 297 2.076 7.649 7.295 1.00 71.52 C ATOM 3085 OG1 THR B 297 1.374 8.856 6.936 1.00 2.03 O ATOM 3086 CG2 THR B 297 3.524 8.014 7.620 1.00 61.33 C ATOM 0 H THR B 297 2.426 7.855 4.528 1.00 60.20 H new ATOM 0 HA THR B 297 2.416 5.666 6.489 1.00 64.03 H new ATOM 0 HB THR B 297 1.610 7.190 8.167 1.00 71.52 H new ATOM 0 HG1 THR B 297 2.017 9.529 6.628 1.00 2.03 H new ATOM 0 HG21 THR B 297 3.543 8.737 8.435 1.00 61.33 H new ATOM 0 HG22 THR B 297 4.067 7.117 7.918 1.00 61.33 H new ATOM 0 HG23 THR B 297 3.996 8.448 6.739 1.00 61.33 H new ATOM 3094 N PHE B 298 -0.204 5.759 6.503 1.00 23.24 N ATOM 3095 CA PHE B 298 -1.612 5.560 6.256 1.00 34.15 C ATOM 3096 C PHE B 298 -2.405 6.375 7.235 1.00 71.32 C ATOM 3097 O PHE B 298 -2.030 6.488 8.407 1.00 73.14 O ATOM 3098 CB PHE B 298 -1.993 4.088 6.408 1.00 43.32 C ATOM 3099 CG PHE B 298 -1.691 3.184 5.240 1.00 51.32 C ATOM 3100 CD1 PHE B 298 -0.448 3.148 4.628 1.00 11.20 C ATOM 3101 CD2 PHE B 298 -2.685 2.367 4.760 1.00 2.33 C ATOM 3102 CE1 PHE B 298 -0.219 2.303 3.554 1.00 74.34 C ATOM 3103 CE2 PHE B 298 -2.475 1.529 3.702 1.00 52.35 C ATOM 3104 CZ PHE B 298 -1.238 1.490 3.091 1.00 64.53 C ATOM 0 H PHE B 298 0.132 5.330 7.365 1.00 23.24 H new ATOM 0 HA PHE B 298 -1.831 5.872 5.235 1.00 34.15 H new ATOM 0 HB2 PHE B 298 -1.480 3.693 7.285 1.00 43.32 H new ATOM 0 HB3 PHE B 298 -3.062 4.033 6.613 1.00 43.32 H new ATOM 0 HD1 PHE B 298 0.347 3.783 4.991 1.00 11.20 H new ATOM 0 HD2 PHE B 298 -3.657 2.388 5.231 1.00 2.33 H new ATOM 0 HE1 PHE B 298 0.751 2.279 3.080 1.00 74.34 H new ATOM 0 HE2 PHE B 298 -3.275 0.898 3.344 1.00 52.35 H new ATOM 0 HZ PHE B 298 -1.066 0.828 2.255 1.00 64.53 H new ATOM 3114 N GLY B 299 -3.487 6.942 6.769 1.00 44.45 N ATOM 3115 CA GLY B 299 -4.325 7.754 7.611 1.00 24.32 C ATOM 3116 C GLY B 299 -5.236 6.951 8.491 1.00 32.33 C ATOM 3117 O GLY B 299 -6.446 7.031 8.351 1.00 0.52 O ATOM 0 H GLY B 299 -3.810 6.855 5.805 1.00 44.45 H new ATOM 0 HA2 GLY B 299 -3.696 8.389 8.234 1.00 24.32 H new ATOM 0 HA3 GLY B 299 -4.925 8.415 6.986 1.00 24.32 H new ATOM 3121 N GLN B 300 -4.642 6.174 9.394 1.00 3.12 N ATOM 3122 CA GLN B 300 -5.363 5.325 10.343 1.00 12.03 C ATOM 3123 C GLN B 300 -6.237 4.280 9.627 1.00 74.34 C ATOM 3124 O GLN B 300 -5.790 3.173 9.348 1.00 2.22 O ATOM 3125 CB GLN B 300 -6.191 6.174 11.336 1.00 64.00 C ATOM 3126 CG GLN B 300 -6.989 5.372 12.357 1.00 33.21 C ATOM 3127 CD GLN B 300 -7.816 6.245 13.285 1.00 0.11 C ATOM 3128 OE1 GLN B 300 -8.263 7.374 12.791 1.00 43.10 O flip ATOM 3129 NE2 GLN B 300 -8.060 5.892 14.446 1.00 74.30 N flip ATOM 0 H GLN B 300 -3.628 6.115 9.489 1.00 3.12 H new ATOM 0 HA GLN B 300 -4.618 4.776 10.919 1.00 12.03 H new ATOM 0 HB2 GLN B 300 -5.516 6.844 11.869 1.00 64.00 H new ATOM 0 HB3 GLN B 300 -6.880 6.800 10.769 1.00 64.00 H new ATOM 0 HG2 GLN B 300 -7.650 4.682 11.832 1.00 33.21 H new ATOM 0 HG3 GLN B 300 -6.304 4.767 12.951 1.00 33.21 H new ATOM 0 HE21 GLN B 300 -7.695 5.006 14.797 1.00 74.30 H new ATOM 0 HE22 GLN B 300 -8.626 6.487 15.052 1.00 74.30 H new ATOM 3138 N GLY B 301 -7.433 4.668 9.269 1.00 50.21 N ATOM 3139 CA GLY B 301 -8.354 3.780 8.650 1.00 64.55 C ATOM 3140 C GLY B 301 -9.763 4.090 9.063 1.00 10.12 C ATOM 3141 O GLY B 301 -10.025 4.330 10.238 1.00 11.22 O ATOM 0 H GLY B 301 -7.788 5.615 9.404 1.00 50.21 H new ATOM 0 HA2 GLY B 301 -8.264 3.855 7.566 1.00 64.55 H new ATOM 0 HA3 GLY B 301 -8.110 2.752 8.919 1.00 64.55 H new ATOM 3145 N THR B 302 -10.654 4.095 8.119 1.00 21.33 N ATOM 3146 CA THR B 302 -12.039 4.332 8.394 1.00 50.01 C ATOM 3147 C THR B 302 -12.788 3.012 8.376 1.00 13.21 C ATOM 3148 O THR B 302 -12.722 2.249 7.396 1.00 55.42 O ATOM 3149 CB THR B 302 -12.655 5.304 7.360 1.00 34.21 C ATOM 3150 OG1 THR B 302 -11.966 6.559 7.412 1.00 12.22 O ATOM 3151 CG2 THR B 302 -14.145 5.525 7.615 1.00 52.52 C ATOM 0 H THR B 302 -10.441 3.935 7.134 1.00 21.33 H new ATOM 0 HA THR B 302 -12.124 4.791 9.379 1.00 50.01 H new ATOM 0 HB THR B 302 -12.546 4.859 6.371 1.00 34.21 H new ATOM 0 HG1 THR B 302 -12.517 7.215 7.888 1.00 12.22 H new ATOM 0 HG21 THR B 302 -14.544 6.213 6.869 1.00 52.52 H new ATOM 0 HG22 THR B 302 -14.671 4.573 7.548 1.00 52.52 H new ATOM 0 HG23 THR B 302 -14.285 5.947 8.610 1.00 52.52 H new ATOM 3159 N LYS B 303 -13.470 2.742 9.460 1.00 73.40 N ATOM 3160 CA LYS B 303 -14.247 1.539 9.618 1.00 10.05 C ATOM 3161 C LYS B 303 -15.579 1.817 8.915 1.00 44.13 C ATOM 3162 O LYS B 303 -16.349 2.681 9.343 1.00 11.52 O ATOM 3163 CB LYS B 303 -14.475 1.321 11.129 1.00 0.22 C ATOM 3164 CG LYS B 303 -14.728 -0.115 11.668 1.00 70.31 C ATOM 3165 CD LYS B 303 -15.916 -0.867 11.079 1.00 65.32 C ATOM 3166 CE LYS B 303 -15.556 -1.615 9.807 1.00 24.30 C ATOM 3167 NZ LYS B 303 -16.688 -2.433 9.304 1.00 30.04 N ATOM 0 H LYS B 303 -13.501 3.361 10.270 1.00 73.40 H new ATOM 0 HA LYS B 303 -13.764 0.654 9.203 1.00 10.05 H new ATOM 0 HB2 LYS B 303 -13.603 1.716 11.651 1.00 0.22 H new ATOM 0 HB3 LYS B 303 -15.327 1.934 11.422 1.00 0.22 H new ATOM 0 HG2 LYS B 303 -13.830 -0.707 11.493 1.00 70.31 H new ATOM 0 HG3 LYS B 303 -14.865 -0.054 12.748 1.00 70.31 H new ATOM 0 HD2 LYS B 303 -16.297 -1.573 11.817 1.00 65.32 H new ATOM 0 HD3 LYS B 303 -16.720 -0.162 10.867 1.00 65.32 H new ATOM 0 HE2 LYS B 303 -15.255 -0.902 9.040 1.00 24.30 H new ATOM 0 HE3 LYS B 303 -14.698 -2.260 9.996 1.00 24.30 H new ATOM 0 HZ1 LYS B 303 -16.321 -3.300 8.863 1.00 30.04 H new ATOM 0 HZ2 LYS B 303 -17.313 -2.685 10.096 1.00 30.04 H new ATOM 0 HZ3 LYS B 303 -17.225 -1.887 8.600 1.00 30.04 H new ATOM 3181 N LEU B 304 -15.827 1.127 7.844 1.00 61.10 N ATOM 3182 CA LEU B 304 -17.009 1.386 7.046 1.00 63.44 C ATOM 3183 C LEU B 304 -18.060 0.361 7.392 1.00 44.00 C ATOM 3184 O LEU B 304 -17.776 -0.838 7.438 1.00 4.41 O ATOM 3185 CB LEU B 304 -16.632 1.329 5.542 1.00 43.21 C ATOM 3186 CG LEU B 304 -17.663 1.838 4.498 1.00 65.40 C ATOM 3187 CD1 LEU B 304 -18.882 0.946 4.392 1.00 33.21 C ATOM 3188 CD2 LEU B 304 -18.081 3.261 4.822 1.00 40.42 C ATOM 0 H LEU B 304 -15.232 0.377 7.493 1.00 61.10 H new ATOM 0 HA LEU B 304 -17.410 2.378 7.256 1.00 63.44 H new ATOM 0 HB2 LEU B 304 -15.715 1.903 5.409 1.00 43.21 H new ATOM 0 HB3 LEU B 304 -16.398 0.293 5.298 1.00 43.21 H new ATOM 0 HG LEU B 304 -17.167 1.814 3.527 1.00 65.40 H new ATOM 0 HD11 LEU B 304 -19.566 1.352 3.647 1.00 33.21 H new ATOM 0 HD12 LEU B 304 -18.575 -0.056 4.094 1.00 33.21 H new ATOM 0 HD13 LEU B 304 -19.384 0.899 5.359 1.00 33.21 H new ATOM 0 HD21 LEU B 304 -18.804 3.605 4.082 1.00 40.42 H new ATOM 0 HD22 LEU B 304 -18.534 3.290 5.813 1.00 40.42 H new ATOM 0 HD23 LEU B 304 -17.206 3.910 4.804 1.00 40.42 H new ATOM 3200 N GLU B 305 -19.256 0.817 7.663 1.00 50.12 N ATOM 3201 CA GLU B 305 -20.322 -0.062 8.046 1.00 22.12 C ATOM 3202 C GLU B 305 -21.586 0.279 7.288 1.00 1.21 C ATOM 3203 O GLU B 305 -21.771 1.412 6.851 1.00 53.12 O ATOM 3204 CB GLU B 305 -20.599 0.079 9.538 1.00 73.14 C ATOM 3205 CG GLU B 305 -19.369 -0.025 10.402 1.00 13.20 C ATOM 3206 CD GLU B 305 -19.698 -0.081 11.853 1.00 55.23 C ATOM 3207 OE1 GLU B 305 -19.895 -1.194 12.363 1.00 51.54 O ATOM 3208 OE2 GLU B 305 -19.777 0.972 12.501 1.00 64.10 O ATOM 0 H GLU B 305 -19.514 1.803 7.624 1.00 50.12 H new ATOM 0 HA GLU B 305 -20.021 -1.084 7.815 1.00 22.12 H new ATOM 0 HB2 GLU B 305 -21.077 1.042 9.719 1.00 73.14 H new ATOM 0 HB3 GLU B 305 -21.309 -0.691 9.840 1.00 73.14 H new ATOM 0 HG2 GLU B 305 -18.808 -0.917 10.125 1.00 13.20 H new ATOM 0 HG3 GLU B 305 -18.721 0.831 10.212 1.00 13.20 H new ATOM 3215 N ILE B 306 -22.433 -0.693 7.123 1.00 25.21 N ATOM 3216 CA ILE B 306 -23.730 -0.482 6.545 1.00 44.14 C ATOM 3217 C ILE B 306 -24.765 -0.441 7.638 1.00 12.52 C ATOM 3218 O ILE B 306 -24.921 -1.399 8.393 1.00 74.22 O ATOM 3219 CB ILE B 306 -24.077 -1.522 5.433 1.00 44.12 C ATOM 3220 CG1 ILE B 306 -23.339 -1.150 4.136 1.00 22.24 C ATOM 3221 CG2 ILE B 306 -25.589 -1.618 5.187 1.00 54.21 C ATOM 3222 CD1 ILE B 306 -23.493 -2.154 3.029 1.00 33.14 C ATOM 0 H ILE B 306 -22.244 -1.660 7.386 1.00 25.21 H new ATOM 0 HA ILE B 306 -23.723 0.481 6.035 1.00 44.14 H new ATOM 0 HB ILE B 306 -23.748 -2.504 5.772 1.00 44.12 H new ATOM 0 HG12 ILE B 306 -23.704 -0.184 3.788 1.00 22.24 H new ATOM 0 HG13 ILE B 306 -22.278 -1.029 4.357 1.00 22.24 H new ATOM 0 HG21 ILE B 306 -25.785 -2.353 4.406 1.00 54.21 H new ATOM 0 HG22 ILE B 306 -26.089 -1.924 6.106 1.00 54.21 H new ATOM 0 HG23 ILE B 306 -25.969 -0.646 4.874 1.00 54.21 H new ATOM 0 HD11 ILE B 306 -22.942 -1.815 2.151 1.00 33.14 H new ATOM 0 HD12 ILE B 306 -23.101 -3.117 3.354 1.00 33.14 H new ATOM 0 HD13 ILE B 306 -24.548 -2.259 2.777 1.00 33.14 H new ATOM 3234 N LYS B 307 -25.440 0.675 7.744 1.00 4.54 N ATOM 3235 CA LYS B 307 -26.405 0.867 8.784 1.00 50.23 C ATOM 3236 C LYS B 307 -27.753 0.362 8.350 1.00 65.11 C ATOM 3237 O LYS B 307 -28.135 0.487 7.182 1.00 74.43 O ATOM 3238 CB LYS B 307 -26.513 2.336 9.198 1.00 24.14 C ATOM 3239 CG LYS B 307 -27.021 3.235 8.127 1.00 72.32 C ATOM 3240 CD LYS B 307 -27.186 4.635 8.618 1.00 42.42 C ATOM 3241 CE LYS B 307 -27.803 5.460 7.546 1.00 4.14 C ATOM 3242 NZ LYS B 307 -27.998 6.859 7.945 1.00 3.42 N ATOM 0 H LYS B 307 -25.334 1.469 7.113 1.00 4.54 H new ATOM 0 HA LYS B 307 -26.064 0.298 9.649 1.00 50.23 H new ATOM 0 HB2 LYS B 307 -27.172 2.411 10.063 1.00 24.14 H new ATOM 0 HB3 LYS B 307 -25.531 2.686 9.515 1.00 24.14 H new ATOM 0 HG2 LYS B 307 -26.331 3.223 7.284 1.00 72.32 H new ATOM 0 HG3 LYS B 307 -27.978 2.862 7.761 1.00 72.32 H new ATOM 0 HD2 LYS B 307 -27.812 4.649 9.510 1.00 42.42 H new ATOM 0 HD3 LYS B 307 -26.219 5.050 8.901 1.00 42.42 H new ATOM 0 HE2 LYS B 307 -27.172 5.425 6.658 1.00 4.14 H new ATOM 0 HE3 LYS B 307 -28.765 5.028 7.270 1.00 4.14 H new ATOM 0 HZ1 LYS B 307 -28.431 7.387 7.160 1.00 3.42 H new ATOM 0 HZ2 LYS B 307 -28.623 6.899 8.775 1.00 3.42 H new ATOM 0 HZ3 LYS B 307 -27.079 7.284 8.182 1.00 3.42 H new ATOM 3256 N ARG B 308 -28.442 -0.210 9.270 1.00 22.32 N ATOM 3257 CA ARG B 308 -29.751 -0.705 9.063 1.00 2.33 C ATOM 3258 C ARG B 308 -30.400 -0.849 10.409 1.00 13.33 C ATOM 3259 O ARG B 308 -31.112 0.084 10.822 1.00 38.18 O ATOM 3260 CB ARG B 308 -29.713 -2.030 8.306 1.00 71.12 C ATOM 3261 CG ARG B 308 -31.075 -2.607 7.995 1.00 74.42 C ATOM 3262 CD ARG B 308 -30.944 -3.844 7.132 1.00 22.01 C ATOM 3263 NE ARG B 308 -30.308 -3.537 5.838 1.00 55.21 N ATOM 3264 CZ ARG B 308 -29.440 -4.331 5.194 1.00 25.42 C ATOM 3265 NH1 ARG B 308 -29.067 -5.485 5.718 1.00 15.25 N ATOM 3266 NH2 ARG B 308 -28.947 -3.956 4.025 1.00 11.40 N ATOM 3267 OXT ARG B 308 -30.137 -1.855 11.103 1.00 38.18 O ATOM 0 H ARG B 308 -28.097 -0.350 10.219 1.00 22.32 H new ATOM 0 HA ARG B 308 -30.332 -0.016 8.449 1.00 2.33 H new ATOM 0 HB2 ARG B 308 -29.170 -1.886 7.372 1.00 71.12 H new ATOM 0 HB3 ARG B 308 -29.150 -2.755 8.894 1.00 71.12 H new ATOM 0 HG2 ARG B 308 -31.591 -2.857 8.922 1.00 74.42 H new ATOM 0 HG3 ARG B 308 -31.683 -1.862 7.482 1.00 74.42 H new ATOM 0 HD2 ARG B 308 -30.355 -4.595 7.659 1.00 22.01 H new ATOM 0 HD3 ARG B 308 -31.930 -4.275 6.960 1.00 22.01 H new ATOM 0 HE ARG B 308 -30.547 -2.649 5.397 1.00 55.21 H new ATOM 0 HH11 ARG B 308 -29.440 -5.780 6.621 1.00 15.25 H new ATOM 0 HH12 ARG B 308 -28.406 -6.081 5.220 1.00 15.25 H new ATOM 0 HH21 ARG B 308 -29.227 -3.065 3.616 1.00 11.40 H new ATOM 0 HH22 ARG B 308 -28.287 -4.558 3.533 1.00 11.40 H new