USER MOD reduce.3.24.130724 H: found=0, std=0, add=1581, rem=0, adj=76 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 290 GLN : amide:sc= -2.89 K(o=-1.4,f=-7.8!) USER MOD Set 1.2: B 297 THR OG1 : rot 151:sc= 1.53 USER MOD Set 2.1: B 237 GLN : amide:sc= 1.14 K(o=3.1,f=2.3) USER MOD Set 2.2: B 286 TYR OH : rot -4:sc= 1.98 USER MOD Set 3.1: A 36 TYR OH : rot 49:sc= 1.77 USER MOD Set 3.2: A 89 GLN : amide:sc= -0.212 K(o=1.7,f=-0.2) USER MOD Set 3.3: B 236 TYR OH : rot 108:sc= 1.23 USER MOD Set 3.4: B 289 GLN : amide:sc= -1.06 K(o=1.7,f=0.26) USER MOD Set 4.1: B 230 SER OG : rot -96:sc= 0.0703 USER MOD Set 4.2: B 231 ASN : amide:sc= 0.188 X(o=0.26,f=0) USER MOD Set 5.1: B 207 SER OG : rot 180:sc=-0.00625 USER MOD Set 5.2: B 224 GLN : amide:sc= -0.117 K(o=-0.12,f=-1.6) USER MOD Set 6.1: B 209 SER OG : rot 65:sc= 0.422 USER MOD Set 6.2: B 300 GLN :FLIP amide:sc= -0.182 F(o=-2!,f=0.24) USER MOD Set 7.1: B 206 GLN : amide:sc= -0.409 K(o=0.85,f=-7.5!) USER MOD Set 7.2: B 302 THR OG1 : rot -94:sc= 1.26 USER MOD Set 8.1: B 203 GLN : amide:sc= 0.804 K(o=1.5,f=0.23) USER MOD Set 8.2: B 205 THR OG1 : rot -158:sc= 0.717 USER MOD Set 9.1: A 27 GLN :FLIP amide:sc= -0.278 F(o=-1.2,f=-0.51) USER MOD Set 9.2: A 93 ASN : amide:sc= -0.235 K(o=-0.51,f=-5.3!) USER MOD Set10.1: A 90 GLN : amide:sc= -5! C(o=-4.8!,f=-7.2!) USER MOD Set10.2: A 97 THR OG1 : rot 92:sc= 0.195 USER MOD Set11.1: A 37 GLN : amide:sc= 2.08 K(o=5.2,f=-1.9) USER MOD Set11.2: A 42 LYS NZ :NH3+ -177:sc= 1.25 (180deg=0) USER MOD Set11.3: A 86 TYR OH : rot 1:sc= 1.89 USER MOD Set12.1: A 30 SER OG : rot 180:sc= 0 USER MOD Set12.2: A 31 ASN : amide:sc= -0.0875 X(o=-0.088,f=0) USER MOD Set13.1: A 9 SER OG : rot 180:sc= 0.0787 USER MOD Set13.2: A 100 GLN :FLIP amide:sc= -0.449 F(o=-2.4!,f=-0.37) USER MOD Set14.1: A 6 GLN : amide:sc= -0.123 K(o=0.82,f=-6.7!) USER MOD Set14.2: A 102 THR OG1 : rot -79:sc= 0.947 USER MOD Single : A 1 ASP N :NH3+ -104:sc= 0.124 (180deg=0) USER MOD Single : A 3 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 4 MET CE :methyl -140:sc= -0.639 (180deg=-5.14!) USER MOD Single : A 5 THR OG1 : rot 180:sc= 0 USER MOD Single : A 7 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 180:sc= -0.129 USER MOD Single : A 14 SER OG : rot -62:sc= 0.316 USER MOD Single : A 20 THR OG1 : rot 180:sc= 0 USER MOD Single : A 22 THR OG1 : rot -2:sc= 1.26 USER MOD Single : A 24 GLN : amide:sc= -0.221 K(o=-0.22,f=-1.1) USER MOD Single : A 26 SER OG : rot 180:sc= 0 USER MOD Single : A 32 TYR OH : rot 180:sc= 0 USER MOD Single : A 34 ASN :FLIP amide:sc= -0.584 F(o=-3.9!,f=-0.58) USER MOD Single : A 38 GLN : amide:sc= -0.38 X(o=-0.38,f=-0.31) USER MOD Single : A 39 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 45 LYS NZ :NH3+ -179:sc= 1.11 (180deg=1.11) USER MOD Single : A 49 TYR OH : rot 180:sc= 0 USER MOD Single : A 52 SER OG : rot -31:sc= 0.386 USER MOD Single : A 53 ASN :FLIP amide:sc= -0.346 F(o=-0.97,f=-0.35) 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=-0.00622 USER MOD Single : A 67 SER OG : rot 180:sc= 0 USER MOD Single : A 69 THR OG1 : rot 69:sc= 0.812 USER MOD Single : A 72 THR OG1 : rot 180:sc= -0.564 USER MOD Single : A 74 THR OG1 : rot 41:sc= 1.05 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= -0.203 X(o=-0.2,f=-0.017) USER MOD Single : A 85 THR OG1 : rot 180:sc= 0 USER MOD Single : A 87 HIS : no HE2:sc= -1.29 K(o=-1.3,f=-2.4) USER MOD Single : A 91 TYR OH : rot 59:sc= 0.408 USER MOD Single : A 96 TYR OH : rot 30:sc= -0.0348 USER MOD Single : A 103 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 107 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 204 MET CE :methyl -133:sc= -1.28 (180deg=-4.89!) USER MOD Single : B 210 SER OG : rot 180:sc= 0 USER MOD Single : B 212 SER OG : rot 180:sc= -0.578 USER MOD Single : B 214 SER OG : rot -66:sc= 0.537 USER MOD Single : B 220 THR OG1 : rot 180:sc= 0 USER MOD Single : B 222 THR OG1 : rot 180:sc= 0 USER MOD Single : B 226 SER OG : rot 180:sc= 0 USER MOD Single : B 227 GLN :FLIP amide:sc= -0.224 F(o=-0.84,f=-0.22) USER MOD Single : B 232 TYR OH : rot 180:sc= 0 USER MOD Single : B 234 ASN :FLIP amide:sc= -0.349 F(o=-3.8!,f=-0.35) USER MOD Single : B 238 GLN : amide:sc= -0.467 X(o=-0.47,f=-0.48) USER MOD Single : B 239 LYS NZ :NH3+ -148:sc= 1.46 (180deg=0.229) USER MOD Single : B 245 LYS NZ :NH3+ -178:sc= 0.192 (180deg=0.0841) USER MOD Single : B 249 TYR OH : rot 180:sc= 0 USER MOD Single : B 252 SER OG : rot 180:sc= 0 USER MOD Single : B 253 ASN : amide:sc= -0.411 X(o=-0.41,f=-0.22) 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 -5:sc= 0.3 USER MOD Single : B 265 SER OG : rot 180:sc= -0.019 USER MOD Single : B 267 SER OG : rot 36:sc= 0.185 USER MOD Single : B 269 THR OG1 : rot 180:sc= 0 USER MOD Single : B 272 THR OG1 : rot 180:sc= 0 USER MOD Single : B 274 THR OG1 : rot 34:sc= 0.485 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= -0.0503 K(o=-0.05,f=-0.57) USER MOD Single : B 285 THR OG1 : rot 180:sc= 0 USER MOD Single : B 287 HIS :FLIP no HE2:sc= -0.799 F(o=-1.4,f=-0.8) USER MOD Single : B 291 TYR OH : rot -34:sc= 0.693 USER MOD Single : B 293 ASN : amide:sc= 0.00261 K(o=0.0026,f=-1.9) USER MOD Single : B 296 TYR OH : rot -58:sc= -0.0173 USER MOD Single : B 303 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 307 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD ----------------------------------------------------------------- ATOM 1 N ASP A 1 2.178 2.227 16.039 1.00 63.52 N ATOM 2 CA ASP A 1 2.713 2.060 14.684 1.00 53.02 C ATOM 3 C ASP A 1 3.767 1.001 14.731 1.00 30.04 C ATOM 4 O ASP A 1 4.451 0.850 15.739 1.00 73.01 O ATOM 5 CB ASP A 1 3.349 3.360 14.174 1.00 54.10 C ATOM 6 CG ASP A 1 4.578 3.759 14.969 1.00 64.35 C ATOM 7 OD1 ASP A 1 4.433 4.414 16.007 1.00 3.22 O ATOM 8 OD2 ASP A 1 5.713 3.401 14.562 1.00 55.21 O ATOM 0 H1 ASP A 1 1.245 1.771 16.103 1.00 63.52 H new ATOM 0 H2 ASP A 1 2.825 1.788 16.724 1.00 63.52 H new ATOM 0 H3 ASP A 1 2.083 3.240 16.252 1.00 63.52 H new ATOM 0 HA ASP A 1 1.899 1.788 14.012 1.00 53.02 H new ATOM 0 HB2 ASP A 1 3.622 3.240 13.126 1.00 54.10 H new ATOM 0 HB3 ASP A 1 2.614 4.163 14.222 1.00 54.10 H new ATOM 13 N ILE A 2 3.899 0.255 13.687 1.00 64.51 N ATOM 14 CA ILE A 2 4.906 -0.764 13.646 1.00 11.24 C ATOM 15 C ILE A 2 6.068 -0.297 12.804 1.00 21.13 C ATOM 16 O ILE A 2 5.954 -0.127 11.599 1.00 74.12 O ATOM 17 CB ILE A 2 4.327 -2.106 13.150 1.00 62.22 C ATOM 18 CG1 ILE A 2 3.183 -2.540 14.091 1.00 72.32 C ATOM 19 CG2 ILE A 2 5.422 -3.178 13.100 1.00 4.42 C ATOM 20 CD1 ILE A 2 2.413 -3.754 13.630 1.00 43.10 C ATOM 0 H ILE A 2 3.325 0.327 12.847 1.00 64.51 H new ATOM 0 HA ILE A 2 5.272 -0.943 14.657 1.00 11.24 H new ATOM 0 HB ILE A 2 3.936 -1.981 12.140 1.00 62.22 H new ATOM 0 HG12 ILE A 2 3.600 -2.744 15.077 1.00 72.32 H new ATOM 0 HG13 ILE A 2 2.488 -1.708 14.204 1.00 72.32 H new ATOM 0 HG21 ILE A 2 4.996 -4.117 12.748 1.00 4.42 H new ATOM 0 HG22 ILE A 2 6.211 -2.860 12.419 1.00 4.42 H new ATOM 0 HG23 ILE A 2 5.838 -3.320 14.097 1.00 4.42 H new ATOM 0 HD11 ILE A 2 1.630 -3.984 14.353 1.00 43.10 H new ATOM 0 HD12 ILE A 2 1.962 -3.551 12.659 1.00 43.10 H new ATOM 0 HD13 ILE A 2 3.090 -4.604 13.545 1.00 43.10 H new ATOM 32 N GLN A 3 7.175 -0.084 13.455 1.00 1.15 N ATOM 33 CA GLN A 3 8.356 0.411 12.809 1.00 21.21 C ATOM 34 C GLN A 3 9.034 -0.709 12.059 1.00 32.31 C ATOM 35 O GLN A 3 9.380 -1.738 12.639 1.00 13.12 O ATOM 36 CB GLN A 3 9.309 0.974 13.855 1.00 43.32 C ATOM 37 CG GLN A 3 10.556 1.576 13.279 1.00 75.43 C ATOM 38 CD GLN A 3 11.465 2.137 14.344 1.00 12.33 C ATOM 39 OE1 GLN A 3 11.371 3.307 14.704 1.00 10.22 O ATOM 40 NE2 GLN A 3 12.335 1.315 14.870 1.00 61.22 N ATOM 0 H GLN A 3 7.284 -0.250 14.455 1.00 1.15 H new ATOM 0 HA GLN A 3 8.080 1.198 12.107 1.00 21.21 H new ATOM 0 HB2 GLN A 3 8.786 1.733 14.438 1.00 43.32 H new ATOM 0 HB3 GLN A 3 9.587 0.178 14.545 1.00 43.32 H new ATOM 0 HG2 GLN A 3 11.093 0.818 12.709 1.00 75.43 H new ATOM 0 HG3 GLN A 3 10.286 2.368 12.581 1.00 75.43 H new ATOM 0 HE21 GLN A 3 12.385 0.349 14.546 1.00 61.22 H new ATOM 0 HE22 GLN A 3 12.964 1.640 15.605 1.00 61.22 H new ATOM 49 N MET A 4 9.197 -0.515 10.781 1.00 31.21 N ATOM 50 CA MET A 4 9.829 -1.488 9.940 1.00 45.41 C ATOM 51 C MET A 4 11.244 -0.999 9.625 1.00 43.31 C ATOM 52 O MET A 4 11.437 0.113 9.133 1.00 0.54 O ATOM 53 CB MET A 4 9.016 -1.675 8.650 1.00 15.12 C ATOM 54 CG MET A 4 7.533 -2.014 8.872 1.00 52.31 C ATOM 55 SD MET A 4 7.252 -3.535 9.816 1.00 4.44 S ATOM 56 CE MET A 4 7.955 -4.764 8.725 1.00 44.01 C ATOM 0 H MET A 4 8.893 0.327 10.292 1.00 31.21 H new ATOM 0 HA MET A 4 9.879 -2.453 10.445 1.00 45.41 H new ATOM 0 HB2 MET A 4 9.082 -0.762 8.059 1.00 15.12 H new ATOM 0 HB3 MET A 4 9.473 -2.470 8.060 1.00 15.12 H new ATOM 0 HG2 MET A 4 7.056 -1.183 9.392 1.00 52.31 H new ATOM 0 HG3 MET A 4 7.044 -2.106 7.902 1.00 52.31 H new ATOM 0 HE1 MET A 4 7.324 -5.653 8.724 1.00 44.01 H new ATOM 0 HE2 MET A 4 8.016 -4.361 7.714 1.00 44.01 H new ATOM 0 HE3 MET A 4 8.954 -5.028 9.071 1.00 44.01 H new ATOM 66 N THR A 5 12.216 -1.785 9.946 1.00 1.15 N ATOM 67 CA THR A 5 13.592 -1.408 9.738 1.00 12.44 C ATOM 68 C THR A 5 14.173 -2.156 8.537 1.00 72.45 C ATOM 69 O THR A 5 14.156 -3.379 8.504 1.00 40.11 O ATOM 70 CB THR A 5 14.407 -1.721 11.006 1.00 41.42 C ATOM 71 OG1 THR A 5 13.758 -1.085 12.123 1.00 74.54 O ATOM 72 CG2 THR A 5 15.833 -1.190 10.889 1.00 34.51 C ATOM 0 H THR A 5 12.089 -2.708 10.360 1.00 1.15 H new ATOM 0 HA THR A 5 13.643 -0.339 9.533 1.00 12.44 H new ATOM 0 HB THR A 5 14.457 -2.801 11.142 1.00 41.42 H new ATOM 0 HG1 THR A 5 14.260 -1.273 12.943 1.00 74.54 H new ATOM 0 HG21 THR A 5 16.385 -1.426 11.799 1.00 34.51 H new ATOM 0 HG22 THR A 5 16.326 -1.655 10.035 1.00 34.51 H new ATOM 0 HG23 THR A 5 15.808 -0.109 10.749 1.00 34.51 H new ATOM 80 N GLN A 6 14.668 -1.417 7.555 1.00 72.33 N ATOM 81 CA GLN A 6 15.241 -2.012 6.370 1.00 73.01 C ATOM 82 C GLN A 6 16.718 -1.856 6.297 1.00 2.24 C ATOM 83 O GLN A 6 17.250 -0.750 6.345 1.00 24.21 O ATOM 84 CB GLN A 6 14.597 -1.505 5.099 1.00 34.23 C ATOM 85 CG GLN A 6 13.240 -2.069 4.863 1.00 71.12 C ATOM 86 CD GLN A 6 12.627 -1.587 3.589 1.00 74.10 C ATOM 87 OE1 GLN A 6 11.905 -0.591 3.563 1.00 34.15 O ATOM 88 NE2 GLN A 6 12.936 -2.253 2.521 1.00 73.21 N ATOM 0 H GLN A 6 14.681 -0.397 7.562 1.00 72.33 H new ATOM 0 HA GLN A 6 15.027 -3.077 6.456 1.00 73.01 H new ATOM 0 HB2 GLN A 6 14.529 -0.418 5.143 1.00 34.23 H new ATOM 0 HB3 GLN A 6 15.238 -1.750 4.252 1.00 34.23 H new ATOM 0 HG2 GLN A 6 13.302 -3.157 4.842 1.00 71.12 H new ATOM 0 HG3 GLN A 6 12.591 -1.803 5.697 1.00 71.12 H new ATOM 0 HE21 GLN A 6 13.538 -3.074 2.588 1.00 73.21 H new ATOM 0 HE22 GLN A 6 12.577 -1.957 1.613 1.00 73.21 H new ATOM 97 N SER A 7 17.366 -2.963 6.186 1.00 11.45 N ATOM 98 CA SER A 7 18.776 -3.032 6.045 1.00 51.11 C ATOM 99 C SER A 7 19.080 -4.129 5.037 1.00 44.32 C ATOM 100 O SER A 7 18.463 -5.205 5.089 1.00 71.32 O ATOM 101 CB SER A 7 19.420 -3.334 7.391 1.00 61.23 C ATOM 102 OG SER A 7 19.071 -2.338 8.352 1.00 2.31 O ATOM 0 H SER A 7 16.912 -3.876 6.191 1.00 11.45 H new ATOM 0 HA SER A 7 19.180 -2.082 5.695 1.00 51.11 H new ATOM 0 HB2 SER A 7 19.098 -4.314 7.742 1.00 61.23 H new ATOM 0 HB3 SER A 7 20.504 -3.376 7.280 1.00 61.23 H new ATOM 0 HG SER A 7 19.493 -2.550 9.211 1.00 2.31 H new ATOM 108 N PRO A 8 19.971 -3.888 4.085 1.00 54.24 N ATOM 109 CA PRO A 8 20.702 -2.610 3.940 1.00 11.34 C ATOM 110 C PRO A 8 19.783 -1.456 3.497 1.00 3.22 C ATOM 111 O PRO A 8 18.733 -1.691 2.915 1.00 21.34 O ATOM 112 CB PRO A 8 21.729 -2.920 2.846 1.00 2.25 C ATOM 113 CG PRO A 8 21.107 -4.011 2.051 1.00 5.30 C ATOM 114 CD PRO A 8 20.343 -4.849 3.030 1.00 22.50 C ATOM 0 HA PRO A 8 21.140 -2.280 4.882 1.00 11.34 H new ATOM 0 HB2 PRO A 8 21.929 -2.044 2.229 1.00 2.25 H new ATOM 0 HB3 PRO A 8 22.682 -3.233 3.273 1.00 2.25 H new ATOM 0 HG2 PRO A 8 20.447 -3.607 1.284 1.00 5.30 H new ATOM 0 HG3 PRO A 8 21.866 -4.603 1.539 1.00 5.30 H new ATOM 0 HD2 PRO A 8 19.464 -5.302 2.571 1.00 22.50 H new ATOM 0 HD3 PRO A 8 20.952 -5.662 3.424 1.00 22.50 H new ATOM 122 N SER A 9 20.151 -0.232 3.843 1.00 15.34 N ATOM 123 CA SER A 9 19.424 0.956 3.399 1.00 21.03 C ATOM 124 C SER A 9 19.522 1.070 1.868 1.00 24.44 C ATOM 125 O SER A 9 18.666 1.668 1.208 1.00 4.54 O ATOM 126 CB SER A 9 20.006 2.221 4.078 1.00 24.24 C ATOM 127 OG SER A 9 19.357 3.413 3.630 1.00 11.31 O ATOM 0 H SER A 9 20.956 -0.031 4.436 1.00 15.34 H new ATOM 0 HA SER A 9 18.375 0.869 3.683 1.00 21.03 H new ATOM 0 HB2 SER A 9 19.899 2.134 5.159 1.00 24.24 H new ATOM 0 HB3 SER A 9 21.073 2.288 3.867 1.00 24.24 H new ATOM 0 HG SER A 9 19.750 4.189 4.081 1.00 11.31 H new ATOM 133 N SER A 10 20.560 0.478 1.319 1.00 22.54 N ATOM 134 CA SER A 10 20.776 0.461 -0.102 1.00 71.32 C ATOM 135 C SER A 10 21.737 -0.674 -0.469 1.00 63.15 C ATOM 136 O SER A 10 22.723 -0.931 0.255 1.00 11.44 O ATOM 137 CB SER A 10 21.307 1.827 -0.577 1.00 24.51 C ATOM 138 OG SER A 10 22.459 2.237 0.175 1.00 50.30 O ATOM 0 H SER A 10 21.280 -0.007 1.854 1.00 22.54 H new ATOM 0 HA SER A 10 19.829 0.279 -0.610 1.00 71.32 H new ATOM 0 HB2 SER A 10 21.564 1.770 -1.635 1.00 24.51 H new ATOM 0 HB3 SER A 10 20.522 2.577 -0.479 1.00 24.51 H new ATOM 0 HG SER A 10 22.771 3.106 -0.153 1.00 50.30 H new ATOM 144 N LEU A 11 21.464 -1.343 -1.558 1.00 15.13 N ATOM 145 CA LEU A 11 22.276 -2.457 -1.996 1.00 32.21 C ATOM 146 C LEU A 11 22.460 -2.417 -3.492 1.00 73.43 C ATOM 147 O LEU A 11 21.516 -2.166 -4.230 1.00 20.32 O ATOM 148 CB LEU A 11 21.624 -3.794 -1.602 1.00 30.40 C ATOM 149 CG LEU A 11 22.369 -5.068 -2.041 1.00 60.10 C ATOM 150 CD1 LEU A 11 23.749 -5.148 -1.407 1.00 30.01 C ATOM 151 CD2 LEU A 11 21.557 -6.306 -1.717 1.00 25.41 C ATOM 0 H LEU A 11 20.674 -1.135 -2.169 1.00 15.13 H new ATOM 0 HA LEU A 11 23.247 -2.376 -1.508 1.00 32.21 H new ATOM 0 HB2 LEU A 11 21.516 -3.816 -0.518 1.00 30.40 H new ATOM 0 HB3 LEU A 11 20.619 -3.822 -2.023 1.00 30.40 H new ATOM 0 HG LEU A 11 22.501 -5.018 -3.122 1.00 60.10 H new ATOM 0 HD11 LEU A 11 24.249 -6.059 -1.737 1.00 30.01 H new ATOM 0 HD12 LEU A 11 24.338 -4.282 -1.707 1.00 30.01 H new ATOM 0 HD13 LEU A 11 23.651 -5.161 -0.322 1.00 30.01 H new ATOM 0 HD21 LEU A 11 22.103 -7.193 -2.036 1.00 25.41 H new ATOM 0 HD22 LEU A 11 21.381 -6.355 -0.642 1.00 25.41 H new ATOM 0 HD23 LEU A 11 20.601 -6.261 -2.239 1.00 25.41 H new ATOM 163 N SER A 12 23.666 -2.637 -3.928 1.00 32.52 N ATOM 164 CA SER A 12 23.958 -2.730 -5.315 1.00 64.11 C ATOM 165 C SER A 12 24.257 -4.186 -5.652 1.00 23.41 C ATOM 166 O SER A 12 25.154 -4.797 -5.067 1.00 3.22 O ATOM 167 CB SER A 12 25.145 -1.844 -5.662 1.00 34.34 C ATOM 168 OG SER A 12 24.907 -0.505 -5.247 1.00 12.25 O ATOM 0 H SER A 12 24.476 -2.757 -3.320 1.00 32.52 H new ATOM 0 HA SER A 12 23.103 -2.389 -5.899 1.00 64.11 H new ATOM 0 HB2 SER A 12 26.044 -2.226 -5.179 1.00 34.34 H new ATOM 0 HB3 SER A 12 25.324 -1.871 -6.737 1.00 34.34 H new ATOM 0 HG SER A 12 25.681 0.051 -5.476 1.00 12.25 H new ATOM 174 N ALA A 13 23.499 -4.736 -6.545 1.00 15.31 N ATOM 175 CA ALA A 13 23.689 -6.113 -6.976 1.00 22.05 C ATOM 176 C ALA A 13 23.861 -6.148 -8.484 1.00 72.01 C ATOM 177 O ALA A 13 23.410 -5.257 -9.157 1.00 4.33 O ATOM 178 CB ALA A 13 22.518 -6.976 -6.532 1.00 13.14 C ATOM 0 H ALA A 13 22.726 -4.256 -7.006 1.00 15.31 H new ATOM 0 HA ALA A 13 24.588 -6.519 -6.513 1.00 22.05 H new ATOM 0 HB1 ALA A 13 22.677 -8.002 -6.863 1.00 13.14 H new ATOM 0 HB2 ALA A 13 22.440 -6.953 -5.445 1.00 13.14 H new ATOM 0 HB3 ALA A 13 21.597 -6.592 -6.970 1.00 13.14 H new ATOM 184 N SER A 14 24.537 -7.137 -8.999 1.00 31.40 N ATOM 185 CA SER A 14 24.787 -7.221 -10.429 1.00 22.44 C ATOM 186 C SER A 14 23.554 -7.742 -11.189 1.00 10.02 C ATOM 187 O SER A 14 22.636 -8.322 -10.590 1.00 73.15 O ATOM 188 CB SER A 14 25.995 -8.102 -10.682 1.00 0.02 C ATOM 189 OG SER A 14 27.138 -7.597 -9.993 1.00 43.11 O ATOM 0 H SER A 14 24.931 -7.905 -8.455 1.00 31.40 H new ATOM 0 HA SER A 14 24.992 -6.219 -10.805 1.00 22.44 H new ATOM 0 HB2 SER A 14 25.785 -9.120 -10.352 1.00 0.02 H new ATOM 0 HB3 SER A 14 26.200 -8.149 -11.752 1.00 0.02 H new ATOM 0 HG SER A 14 27.357 -6.705 -10.333 1.00 43.11 H new ATOM 195 N VAL A 15 23.533 -7.531 -12.507 1.00 13.41 N ATOM 196 CA VAL A 15 22.420 -7.963 -13.343 1.00 74.04 C ATOM 197 C VAL A 15 22.275 -9.469 -13.303 1.00 63.31 C ATOM 198 O VAL A 15 23.196 -10.215 -13.650 1.00 35.20 O ATOM 199 CB VAL A 15 22.579 -7.503 -14.822 1.00 54.10 C ATOM 200 CG1 VAL A 15 21.420 -8.006 -15.684 1.00 53.13 C ATOM 201 CG2 VAL A 15 22.644 -6.004 -14.892 1.00 72.32 C ATOM 0 H VAL A 15 24.281 -7.060 -13.017 1.00 13.41 H new ATOM 0 HA VAL A 15 21.524 -7.494 -12.936 1.00 74.04 H new ATOM 0 HB VAL A 15 23.506 -7.927 -15.208 1.00 54.10 H new ATOM 0 HG11 VAL A 15 21.558 -7.669 -16.712 1.00 53.13 H new ATOM 0 HG12 VAL A 15 21.394 -9.095 -15.659 1.00 53.13 H new ATOM 0 HG13 VAL A 15 20.481 -7.612 -15.296 1.00 53.13 H new ATOM 0 HG21 VAL A 15 22.755 -5.693 -15.931 1.00 72.32 H new ATOM 0 HG22 VAL A 15 21.727 -5.581 -14.483 1.00 72.32 H new ATOM 0 HG23 VAL A 15 23.497 -5.649 -14.314 1.00 72.32 H new ATOM 211 N GLY A 16 21.137 -9.893 -12.879 1.00 24.01 N ATOM 212 CA GLY A 16 20.836 -11.293 -12.810 1.00 34.14 C ATOM 213 C GLY A 16 21.116 -11.889 -11.456 1.00 61.10 C ATOM 214 O GLY A 16 20.723 -13.022 -11.191 1.00 41.25 O ATOM 0 H GLY A 16 20.381 -9.283 -12.568 1.00 24.01 H new ATOM 0 HA2 GLY A 16 19.786 -11.446 -13.058 1.00 34.14 H new ATOM 0 HA3 GLY A 16 21.421 -11.822 -13.562 1.00 34.14 H new ATOM 218 N ASP A 17 21.775 -11.137 -10.600 1.00 12.42 N ATOM 219 CA ASP A 17 22.103 -11.612 -9.265 1.00 64.11 C ATOM 220 C ASP A 17 20.934 -11.540 -8.341 1.00 73.41 C ATOM 221 O ASP A 17 19.980 -10.786 -8.578 1.00 33.51 O ATOM 222 CB ASP A 17 23.334 -10.920 -8.664 1.00 50.41 C ATOM 223 CG ASP A 17 24.638 -11.515 -9.148 1.00 64.45 C ATOM 224 OD1 ASP A 17 25.110 -11.168 -10.248 1.00 71.13 O ATOM 225 OD2 ASP A 17 25.211 -12.376 -8.424 1.00 52.41 O ATOM 0 H ASP A 17 22.097 -10.190 -10.802 1.00 12.42 H new ATOM 0 HA ASP A 17 22.367 -12.663 -9.384 1.00 64.11 H new ATOM 0 HB2 ASP A 17 23.308 -9.860 -8.916 1.00 50.41 H new ATOM 0 HB3 ASP A 17 23.290 -10.990 -7.577 1.00 50.41 H new ATOM 230 N ARG A 18 20.988 -12.327 -7.304 1.00 51.54 N ATOM 231 CA ARG A 18 19.915 -12.406 -6.371 1.00 2.33 C ATOM 232 C ARG A 18 20.088 -11.347 -5.297 1.00 14.51 C ATOM 233 O ARG A 18 21.105 -11.301 -4.602 1.00 41.45 O ATOM 234 CB ARG A 18 19.823 -13.810 -5.757 1.00 34.11 C ATOM 235 CG ARG A 18 18.617 -13.997 -4.856 1.00 45.22 C ATOM 236 CD ARG A 18 18.548 -15.390 -4.250 1.00 64.53 C ATOM 237 NE ARG A 18 19.704 -15.699 -3.399 1.00 32.21 N ATOM 238 CZ ARG A 18 19.795 -16.769 -2.593 1.00 42.11 C ATOM 239 NH1 ARG A 18 18.768 -17.619 -2.484 1.00 64.35 N ATOM 240 NH2 ARG A 18 20.904 -16.975 -1.888 1.00 0.13 N ATOM 0 H ARG A 18 21.781 -12.930 -7.087 1.00 51.54 H new ATOM 0 HA ARG A 18 18.978 -12.219 -6.896 1.00 2.33 H new ATOM 0 HB2 ARG A 18 19.786 -14.547 -6.559 1.00 34.11 H new ATOM 0 HB3 ARG A 18 20.729 -14.008 -5.184 1.00 34.11 H new ATOM 0 HG2 ARG A 18 18.649 -13.258 -4.055 1.00 45.22 H new ATOM 0 HG3 ARG A 18 17.708 -13.809 -5.428 1.00 45.22 H new ATOM 0 HD2 ARG A 18 17.635 -15.480 -3.661 1.00 64.53 H new ATOM 0 HD3 ARG A 18 18.485 -16.127 -5.051 1.00 64.53 H new ATOM 0 HE ARG A 18 20.494 -15.055 -3.422 1.00 32.21 H new ATOM 0 HH11 ARG A 18 17.912 -17.455 -3.014 1.00 64.35 H new ATOM 0 HH12 ARG A 18 18.841 -18.431 -1.871 1.00 64.35 H new ATOM 0 HH21 ARG A 18 21.683 -16.321 -1.960 1.00 0.13 H new ATOM 0 HH22 ARG A 18 20.975 -17.787 -1.275 1.00 0.13 H new ATOM 254 N VAL A 19 19.108 -10.503 -5.182 1.00 61.34 N ATOM 255 CA VAL A 19 19.100 -9.418 -4.223 1.00 22.30 C ATOM 256 C VAL A 19 18.623 -9.924 -2.869 1.00 1.32 C ATOM 257 O VAL A 19 17.780 -10.821 -2.805 1.00 24.34 O ATOM 258 CB VAL A 19 18.149 -8.294 -4.705 1.00 63.50 C ATOM 259 CG1 VAL A 19 18.121 -7.121 -3.741 1.00 1.13 C ATOM 260 CG2 VAL A 19 18.537 -7.838 -6.091 1.00 12.00 C ATOM 0 H VAL A 19 18.269 -10.542 -5.761 1.00 61.34 H new ATOM 0 HA VAL A 19 20.113 -9.027 -4.131 1.00 22.30 H new ATOM 0 HB VAL A 19 17.141 -8.707 -4.738 1.00 63.50 H new ATOM 0 HG11 VAL A 19 17.442 -6.356 -4.118 1.00 1.13 H new ATOM 0 HG12 VAL A 19 17.778 -7.461 -2.764 1.00 1.13 H new ATOM 0 HG13 VAL A 19 19.123 -6.702 -3.648 1.00 1.13 H new ATOM 0 HG21 VAL A 19 17.860 -7.048 -6.417 1.00 12.00 H new ATOM 0 HG22 VAL A 19 19.558 -7.458 -6.076 1.00 12.00 H new ATOM 0 HG23 VAL A 19 18.473 -8.679 -6.782 1.00 12.00 H new ATOM 270 N THR A 20 19.164 -9.373 -1.809 1.00 12.41 N ATOM 271 CA THR A 20 18.753 -9.719 -0.486 1.00 61.02 C ATOM 272 C THR A 20 18.429 -8.436 0.297 1.00 45.31 C ATOM 273 O THR A 20 19.292 -7.581 0.491 1.00 2.54 O ATOM 274 CB THR A 20 19.882 -10.484 0.226 1.00 42.42 C ATOM 275 OG1 THR A 20 20.271 -11.620 -0.576 1.00 51.51 O ATOM 276 CG2 THR A 20 19.430 -10.971 1.592 1.00 3.55 C ATOM 0 H THR A 20 19.903 -8.671 -1.849 1.00 12.41 H new ATOM 0 HA THR A 20 17.867 -10.352 -0.536 1.00 61.02 H new ATOM 0 HB THR A 20 20.727 -9.808 0.358 1.00 42.42 H new ATOM 0 HG1 THR A 20 20.991 -12.108 -0.125 1.00 51.51 H new ATOM 0 HG21 THR A 20 20.246 -11.509 2.075 1.00 3.55 H new ATOM 0 HG22 THR A 20 19.144 -10.117 2.206 1.00 3.55 H new ATOM 0 HG23 THR A 20 18.575 -11.637 1.476 1.00 3.55 H new ATOM 284 N ILE A 21 17.195 -8.303 0.713 1.00 2.23 N ATOM 285 CA ILE A 21 16.757 -7.165 1.498 1.00 40.44 C ATOM 286 C ILE A 21 16.070 -7.679 2.755 1.00 71.45 C ATOM 287 O ILE A 21 15.141 -8.468 2.668 1.00 33.02 O ATOM 288 CB ILE A 21 15.750 -6.273 0.690 1.00 51.32 C ATOM 289 CG1 ILE A 21 16.426 -5.680 -0.563 1.00 73.31 C ATOM 290 CG2 ILE A 21 15.192 -5.167 1.579 1.00 0.31 C ATOM 291 CD1 ILE A 21 15.510 -4.882 -1.489 1.00 25.02 C ATOM 0 H ILE A 21 16.459 -8.981 0.518 1.00 2.23 H new ATOM 0 HA ILE A 21 17.625 -6.557 1.751 1.00 40.44 H new ATOM 0 HB ILE A 21 14.922 -6.900 0.359 1.00 51.32 H new ATOM 0 HG12 ILE A 21 17.242 -5.033 -0.242 1.00 73.31 H new ATOM 0 HG13 ILE A 21 16.871 -6.495 -1.134 1.00 73.31 H new ATOM 0 HG21 ILE A 21 14.495 -4.556 1.005 1.00 0.31 H new ATOM 0 HG22 ILE A 21 14.672 -5.610 2.428 1.00 0.31 H new ATOM 0 HG23 ILE A 21 16.010 -4.543 1.940 1.00 0.31 H new ATOM 0 HD11 ILE A 21 16.085 -4.510 -2.337 1.00 25.02 H new ATOM 0 HD12 ILE A 21 14.707 -5.525 -1.849 1.00 25.02 H new ATOM 0 HD13 ILE A 21 15.084 -4.040 -0.943 1.00 25.02 H new ATOM 303 N THR A 22 16.512 -7.250 3.904 1.00 32.23 N ATOM 304 CA THR A 22 15.897 -7.703 5.122 1.00 45.52 C ATOM 305 C THR A 22 15.158 -6.577 5.817 1.00 45.32 C ATOM 306 O THR A 22 15.615 -5.422 5.817 1.00 23.34 O ATOM 307 CB THR A 22 16.912 -8.375 6.085 1.00 34.33 C ATOM 308 OG1 THR A 22 18.015 -7.496 6.350 1.00 53.33 O ATOM 309 CG2 THR A 22 17.437 -9.679 5.503 1.00 12.41 C ATOM 0 H THR A 22 17.285 -6.596 4.024 1.00 32.23 H new ATOM 0 HA THR A 22 15.172 -8.466 4.839 1.00 45.52 H new ATOM 0 HB THR A 22 16.389 -8.589 7.017 1.00 34.33 H new ATOM 0 HG1 THR A 22 17.904 -6.668 5.838 1.00 53.33 H new ATOM 0 HG21 THR A 22 18.146 -10.128 6.198 1.00 12.41 H new ATOM 0 HG22 THR A 22 16.606 -10.365 5.339 1.00 12.41 H new ATOM 0 HG23 THR A 22 17.936 -9.479 4.555 1.00 12.41 H new ATOM 317 N CYS A 23 14.028 -6.900 6.376 1.00 64.02 N ATOM 318 CA CYS A 23 13.235 -5.941 7.088 1.00 55.45 C ATOM 319 C CYS A 23 12.851 -6.524 8.430 1.00 24.35 C ATOM 320 O CYS A 23 12.481 -7.703 8.517 1.00 64.53 O ATOM 321 CB CYS A 23 11.977 -5.570 6.272 1.00 33.50 C ATOM 322 SG CYS A 23 10.854 -4.386 7.102 1.00 32.53 S ATOM 0 H CYS A 23 13.630 -7.839 6.351 1.00 64.02 H new ATOM 0 HA CYS A 23 13.812 -5.029 7.242 1.00 55.45 H new ATOM 0 HB2 CYS A 23 12.290 -5.146 5.318 1.00 33.50 H new ATOM 0 HB3 CYS A 23 11.423 -6.482 6.049 1.00 33.50 H new ATOM 327 N GLN A 24 12.971 -5.723 9.465 1.00 55.11 N ATOM 328 CA GLN A 24 12.614 -6.132 10.802 1.00 41.20 C ATOM 329 C GLN A 24 11.428 -5.324 11.290 1.00 74.15 C ATOM 330 O GLN A 24 11.373 -4.109 11.088 1.00 22.42 O ATOM 331 CB GLN A 24 13.781 -5.999 11.812 1.00 12.01 C ATOM 332 CG GLN A 24 14.996 -6.931 11.612 1.00 50.30 C ATOM 333 CD GLN A 24 15.855 -6.639 10.384 1.00 44.21 C ATOM 334 OE1 GLN A 24 15.638 -7.177 9.300 1.00 2.30 O ATOM 335 NE2 GLN A 24 16.841 -5.802 10.559 1.00 30.23 N ATOM 0 H GLN A 24 13.320 -4.767 9.401 1.00 55.11 H new ATOM 0 HA GLN A 24 12.358 -7.190 10.746 1.00 41.20 H new ATOM 0 HB2 GLN A 24 14.137 -4.969 11.784 1.00 12.01 H new ATOM 0 HB3 GLN A 24 13.384 -6.172 12.812 1.00 12.01 H new ATOM 0 HG2 GLN A 24 15.628 -6.870 12.498 1.00 50.30 H new ATOM 0 HG3 GLN A 24 14.637 -7.958 11.546 1.00 50.30 H new ATOM 0 HE21 GLN A 24 16.991 -5.374 11.473 1.00 30.23 H new ATOM 0 HE22 GLN A 24 17.462 -5.575 9.782 1.00 30.23 H new ATOM 344 N ALA A 25 10.495 -5.992 11.917 1.00 41.31 N ATOM 345 CA ALA A 25 9.294 -5.362 12.420 1.00 11.33 C ATOM 346 C ALA A 25 9.416 -5.057 13.912 1.00 15.33 C ATOM 347 O ALA A 25 10.049 -5.810 14.666 1.00 10.44 O ATOM 348 CB ALA A 25 8.095 -6.260 12.162 1.00 52.13 C ATOM 0 H ALA A 25 10.544 -6.995 12.096 1.00 41.31 H new ATOM 0 HA ALA A 25 9.155 -4.417 11.895 1.00 11.33 H new ATOM 0 HB1 ALA A 25 7.193 -5.781 12.543 1.00 52.13 H new ATOM 0 HB2 ALA A 25 7.991 -6.429 11.090 1.00 52.13 H new ATOM 0 HB3 ALA A 25 8.240 -7.215 12.668 1.00 52.13 H new ATOM 354 N SER A 26 8.828 -3.949 14.324 1.00 3.42 N ATOM 355 CA SER A 26 8.804 -3.521 15.724 1.00 71.34 C ATOM 356 C SER A 26 7.863 -4.403 16.553 1.00 21.55 C ATOM 357 O SER A 26 8.035 -4.565 17.762 1.00 32.44 O ATOM 358 CB SER A 26 8.338 -2.065 15.789 1.00 5.31 C ATOM 359 OG SER A 26 8.298 -1.565 17.113 1.00 0.21 O ATOM 0 H SER A 26 8.346 -3.308 13.694 1.00 3.42 H new ATOM 0 HA SER A 26 9.808 -3.614 16.139 1.00 71.34 H new ATOM 0 HB2 SER A 26 9.007 -1.446 15.191 1.00 5.31 H new ATOM 0 HB3 SER A 26 7.346 -1.985 15.344 1.00 5.31 H new ATOM 0 HG SER A 26 7.996 -0.633 17.102 1.00 0.21 H new ATOM 365 N GLN A 27 6.897 -4.979 15.892 1.00 4.13 N ATOM 366 CA GLN A 27 5.895 -5.788 16.527 1.00 14.00 C ATOM 367 C GLN A 27 5.707 -7.009 15.658 1.00 34.31 C ATOM 368 O GLN A 27 5.978 -6.941 14.458 1.00 51.11 O ATOM 369 CB GLN A 27 4.587 -4.973 16.646 1.00 64.11 C ATOM 370 CG GLN A 27 3.451 -5.665 17.378 1.00 51.23 C ATOM 371 CD GLN A 27 2.203 -4.801 17.483 1.00 13.12 C ATOM 372 OE1 GLN A 27 1.323 -4.928 16.531 1.00 61.05 O flip ATOM 373 NE2 GLN A 27 2.032 -4.036 18.438 1.00 50.11 N flip ATOM 0 H GLN A 27 6.783 -4.898 14.882 1.00 4.13 H new ATOM 0 HA GLN A 27 6.187 -6.090 17.533 1.00 14.00 H new ATOM 0 HB2 GLN A 27 4.808 -4.036 17.157 1.00 64.11 H new ATOM 0 HB3 GLN A 27 4.247 -4.716 15.643 1.00 64.11 H new ATOM 0 HG2 GLN A 27 3.203 -6.592 16.861 1.00 51.23 H new ATOM 0 HG3 GLN A 27 3.783 -5.938 18.380 1.00 51.23 H new ATOM 0 HE21 GLN A 27 2.743 -3.962 19.166 1.00 50.11 H new ATOM 0 HE22 GLN A 27 1.180 -3.479 18.499 1.00 50.11 H new ATOM 382 N ASP A 28 5.288 -8.110 16.236 1.00 34.42 N ATOM 383 CA ASP A 28 5.128 -9.345 15.475 1.00 32.01 C ATOM 384 C ASP A 28 3.936 -9.206 14.542 1.00 42.34 C ATOM 385 O ASP A 28 2.798 -9.010 14.994 1.00 1.15 O ATOM 386 CB ASP A 28 4.926 -10.543 16.414 1.00 42.33 C ATOM 387 CG ASP A 28 4.973 -11.885 15.693 1.00 54.44 C ATOM 388 OD1 ASP A 28 4.010 -12.252 15.011 1.00 71.31 O ATOM 389 OD2 ASP A 28 5.990 -12.604 15.842 1.00 75.41 O ATOM 0 H ASP A 28 5.051 -8.185 17.225 1.00 34.42 H new ATOM 0 HA ASP A 28 6.032 -9.522 14.893 1.00 32.01 H new ATOM 0 HB2 ASP A 28 5.695 -10.525 17.186 1.00 42.33 H new ATOM 0 HB3 ASP A 28 3.965 -10.443 16.919 1.00 42.33 H new ATOM 394 N ILE A 29 4.201 -9.261 13.253 1.00 32.31 N ATOM 395 CA ILE A 29 3.159 -9.115 12.240 1.00 21.42 C ATOM 396 C ILE A 29 2.916 -10.449 11.551 1.00 31.41 C ATOM 397 O ILE A 29 2.160 -10.549 10.576 1.00 53.31 O ATOM 398 CB ILE A 29 3.547 -8.042 11.193 1.00 12.31 C ATOM 399 CG1 ILE A 29 4.840 -8.434 10.460 1.00 21.34 C ATOM 400 CG2 ILE A 29 3.714 -6.696 11.882 1.00 70.50 C ATOM 401 CD1 ILE A 29 5.265 -7.460 9.380 1.00 13.41 C ATOM 0 H ILE A 29 5.136 -9.407 12.873 1.00 32.31 H new ATOM 0 HA ILE A 29 2.244 -8.792 12.736 1.00 21.42 H new ATOM 0 HB ILE A 29 2.751 -7.970 10.452 1.00 12.31 H new ATOM 0 HG12 ILE A 29 5.645 -8.523 11.190 1.00 21.34 H new ATOM 0 HG13 ILE A 29 4.706 -9.419 10.012 1.00 21.34 H new ATOM 0 HG21 ILE A 29 3.987 -5.941 11.145 1.00 70.50 H new ATOM 0 HG22 ILE A 29 2.776 -6.413 12.360 1.00 70.50 H new ATOM 0 HG23 ILE A 29 4.498 -6.768 12.635 1.00 70.50 H new ATOM 0 HD11 ILE A 29 6.185 -7.812 8.914 1.00 13.41 H new ATOM 0 HD12 ILE A 29 4.481 -7.388 8.626 1.00 13.41 H new ATOM 0 HD13 ILE A 29 5.435 -6.478 9.822 1.00 13.41 H new ATOM 413 N SER A 30 3.570 -11.450 12.078 1.00 1.53 N ATOM 414 CA SER A 30 3.501 -12.815 11.613 1.00 70.21 C ATOM 415 C SER A 30 3.951 -12.963 10.137 1.00 34.32 C ATOM 416 O SER A 30 5.138 -13.023 9.865 1.00 53.11 O ATOM 417 CB SER A 30 2.117 -13.449 11.889 1.00 3.23 C ATOM 418 OG SER A 30 2.115 -14.835 11.600 1.00 51.44 O ATOM 0 H SER A 30 4.193 -11.334 12.877 1.00 1.53 H new ATOM 0 HA SER A 30 4.222 -13.385 12.198 1.00 70.21 H new ATOM 0 HB2 SER A 30 1.846 -13.293 12.933 1.00 3.23 H new ATOM 0 HB3 SER A 30 1.360 -12.949 11.285 1.00 3.23 H new ATOM 0 HG SER A 30 1.228 -15.207 11.786 1.00 51.44 H new ATOM 424 N ASN A 31 3.015 -13.048 9.207 1.00 12.40 N ATOM 425 CA ASN A 31 3.356 -13.118 7.781 1.00 13.51 C ATOM 426 C ASN A 31 2.732 -11.974 6.999 1.00 41.03 C ATOM 427 O ASN A 31 2.834 -11.914 5.768 1.00 4.31 O ATOM 428 CB ASN A 31 2.974 -14.478 7.166 1.00 10.23 C ATOM 429 CG ASN A 31 1.497 -14.805 7.278 1.00 10.13 C ATOM 430 OD1 ASN A 31 1.062 -15.398 8.263 1.00 53.11 O ATOM 431 ND2 ASN A 31 0.729 -14.458 6.286 1.00 24.52 N ATOM 0 H ASN A 31 2.015 -13.071 9.404 1.00 12.40 H new ATOM 0 HA ASN A 31 4.439 -13.018 7.711 1.00 13.51 H new ATOM 0 HB2 ASN A 31 3.260 -14.484 6.114 1.00 10.23 H new ATOM 0 HB3 ASN A 31 3.549 -15.263 7.657 1.00 10.23 H new ATOM 0 HD21 ASN A 31 -0.267 -14.677 6.311 1.00 24.52 H new ATOM 0 HD22 ASN A 31 1.123 -13.967 5.484 1.00 24.52 H new ATOM 438 N TYR A 32 2.112 -11.056 7.705 1.00 2.34 N ATOM 439 CA TYR A 32 1.390 -9.988 7.061 1.00 1.03 C ATOM 440 C TYR A 32 2.310 -8.828 6.716 1.00 64.42 C ATOM 441 O TYR A 32 2.451 -7.866 7.487 1.00 41.23 O ATOM 442 CB TYR A 32 0.200 -9.529 7.914 1.00 0.34 C ATOM 443 CG TYR A 32 -0.776 -10.649 8.233 1.00 75.50 C ATOM 444 CD1 TYR A 32 -1.810 -10.964 7.368 1.00 42.43 C ATOM 445 CD2 TYR A 32 -0.648 -11.395 9.397 1.00 0.12 C ATOM 446 CE1 TYR A 32 -2.688 -11.990 7.649 1.00 13.43 C ATOM 447 CE2 TYR A 32 -1.521 -12.419 9.686 1.00 43.51 C ATOM 448 CZ TYR A 32 -2.539 -12.715 8.809 1.00 40.32 C ATOM 449 OH TYR A 32 -3.411 -13.751 9.091 1.00 44.42 O ATOM 0 H TYR A 32 2.094 -11.029 8.724 1.00 2.34 H new ATOM 0 HA TYR A 32 0.991 -10.376 6.124 1.00 1.03 H new ATOM 0 HB2 TYR A 32 0.572 -9.104 8.846 1.00 0.34 H new ATOM 0 HB3 TYR A 32 -0.329 -8.733 7.390 1.00 0.34 H new ATOM 0 HD1 TYR A 32 -1.931 -10.396 6.457 1.00 42.43 H new ATOM 0 HD2 TYR A 32 0.151 -11.168 10.088 1.00 0.12 H new ATOM 0 HE1 TYR A 32 -3.488 -12.223 6.962 1.00 13.43 H new ATOM 0 HE2 TYR A 32 -1.407 -12.988 10.597 1.00 43.51 H new ATOM 0 HH TYR A 32 -3.166 -14.161 9.947 1.00 44.42 H new ATOM 459 N LEU A 33 2.954 -8.936 5.571 1.00 45.34 N ATOM 460 CA LEU A 33 3.897 -7.943 5.123 1.00 61.43 C ATOM 461 C LEU A 33 3.706 -7.633 3.645 1.00 70.13 C ATOM 462 O LEU A 33 3.476 -8.541 2.833 1.00 55.13 O ATOM 463 CB LEU A 33 5.324 -8.439 5.345 1.00 31.52 C ATOM 464 CG LEU A 33 6.428 -7.483 4.909 1.00 51.32 C ATOM 465 CD1 LEU A 33 6.411 -6.229 5.736 1.00 10.22 C ATOM 466 CD2 LEU A 33 7.769 -8.145 4.980 1.00 40.52 C ATOM 0 H LEU A 33 2.835 -9.718 4.927 1.00 45.34 H new ATOM 0 HA LEU A 33 3.724 -7.035 5.700 1.00 61.43 H new ATOM 0 HB2 LEU A 33 5.453 -8.656 6.405 1.00 31.52 H new ATOM 0 HB3 LEU A 33 5.450 -9.380 4.809 1.00 31.52 H new ATOM 0 HG LEU A 33 6.240 -7.208 3.871 1.00 51.32 H new ATOM 0 HD11 LEU A 33 7.208 -5.564 5.405 1.00 10.22 H new ATOM 0 HD12 LEU A 33 5.449 -5.729 5.619 1.00 10.22 H new ATOM 0 HD13 LEU A 33 6.563 -6.483 6.785 1.00 10.22 H new ATOM 0 HD21 LEU A 33 8.539 -7.442 4.664 1.00 40.52 H new ATOM 0 HD22 LEU A 33 7.965 -8.461 6.005 1.00 40.52 H new ATOM 0 HD23 LEU A 33 7.781 -9.015 4.323 1.00 40.52 H new ATOM 478 N ASN A 34 3.808 -6.368 3.309 1.00 11.20 N ATOM 479 CA ASN A 34 3.720 -5.895 1.939 1.00 51.44 C ATOM 480 C ASN A 34 5.080 -5.355 1.509 1.00 11.02 C ATOM 481 O ASN A 34 5.812 -4.782 2.328 1.00 60.32 O ATOM 482 CB ASN A 34 2.702 -4.749 1.822 1.00 42.32 C ATOM 483 CG ASN A 34 1.274 -5.092 2.166 1.00 3.14 C ATOM 484 OD1 ASN A 34 0.900 -6.299 1.967 1.00 41.21 O flip ATOM 485 ND2 ASN A 34 0.522 -4.253 2.633 1.00 23.32 N flip ATOM 0 H ASN A 34 3.957 -5.622 3.989 1.00 11.20 H new ATOM 0 HA ASN A 34 3.408 -6.728 1.309 1.00 51.44 H new ATOM 0 HB2 ASN A 34 3.025 -3.935 2.471 1.00 42.32 H new ATOM 0 HB3 ASN A 34 2.727 -4.371 0.800 1.00 42.32 H new ATOM 0 HD21 ASN A 34 0.851 -3.299 2.780 1.00 23.32 H new ATOM 0 HD22 ASN A 34 -0.436 -4.506 2.877 1.00 23.32 H new ATOM 492 N TRP A 35 5.417 -5.541 0.253 1.00 71.24 N ATOM 493 CA TRP A 35 6.657 -5.013 -0.307 1.00 13.33 C ATOM 494 C TRP A 35 6.357 -4.066 -1.439 1.00 13.11 C ATOM 495 O TRP A 35 5.600 -4.405 -2.312 1.00 62.33 O ATOM 496 CB TRP A 35 7.570 -6.138 -0.807 1.00 61.42 C ATOM 497 CG TRP A 35 8.188 -6.933 0.288 1.00 3.04 C ATOM 498 CD1 TRP A 35 7.771 -8.134 0.804 1.00 1.33 C ATOM 499 CD2 TRP A 35 9.363 -6.564 1.004 1.00 75.12 C ATOM 500 NE1 TRP A 35 8.631 -8.521 1.809 1.00 2.31 N ATOM 501 CE2 TRP A 35 9.616 -7.565 1.949 1.00 0.34 C ATOM 502 CE3 TRP A 35 10.224 -5.466 0.925 1.00 74.43 C ATOM 503 CZ2 TRP A 35 10.710 -7.500 2.824 1.00 3.43 C ATOM 504 CZ3 TRP A 35 11.301 -5.393 1.773 1.00 51.13 C ATOM 505 CH2 TRP A 35 11.544 -6.405 2.718 1.00 55.52 C ATOM 0 H TRP A 35 4.846 -6.060 -0.414 1.00 71.24 H new ATOM 0 HA TRP A 35 7.176 -4.478 0.488 1.00 13.33 H new ATOM 0 HB2 TRP A 35 6.994 -6.805 -1.448 1.00 61.42 H new ATOM 0 HB3 TRP A 35 8.360 -5.707 -1.423 1.00 61.42 H new ATOM 0 HD1 TRP A 35 6.905 -8.689 0.474 1.00 1.33 H new ATOM 0 HE1 TRP A 35 8.552 -9.376 2.360 1.00 2.31 H new ATOM 0 HE3 TRP A 35 10.044 -4.683 0.204 1.00 74.43 H new ATOM 0 HZ2 TRP A 35 10.893 -8.276 3.552 1.00 3.43 H new ATOM 0 HZ3 TRP A 35 11.970 -4.547 1.713 1.00 51.13 H new ATOM 0 HH2 TRP A 35 12.399 -6.324 3.373 1.00 55.52 H new ATOM 516 N TYR A 36 6.970 -2.896 -1.431 1.00 23.24 N ATOM 517 CA TYR A 36 6.727 -1.875 -2.473 1.00 21.11 C ATOM 518 C TYR A 36 7.973 -1.499 -3.239 1.00 52.50 C ATOM 519 O TYR A 36 9.078 -1.541 -2.705 1.00 62.24 O ATOM 520 CB TYR A 36 6.173 -0.573 -1.878 1.00 23.12 C ATOM 521 CG TYR A 36 4.741 -0.596 -1.440 1.00 63.54 C ATOM 522 CD1 TYR A 36 4.306 -1.419 -0.422 1.00 63.32 C ATOM 523 CD2 TYR A 36 3.825 0.257 -2.034 1.00 20.24 C ATOM 524 CE1 TYR A 36 3.003 -1.392 -0.013 1.00 1.34 C ATOM 525 CE2 TYR A 36 2.517 0.284 -1.632 1.00 4.24 C ATOM 526 CZ TYR A 36 2.113 -0.539 -0.620 1.00 61.33 C ATOM 527 OH TYR A 36 0.825 -0.503 -0.198 1.00 21.25 O ATOM 0 H TYR A 36 7.644 -2.615 -0.719 1.00 23.24 H new ATOM 0 HA TYR A 36 6.006 -2.342 -3.144 1.00 21.11 H new ATOM 0 HB2 TYR A 36 6.788 -0.301 -1.020 1.00 23.12 H new ATOM 0 HB3 TYR A 36 6.291 0.218 -2.619 1.00 23.12 H new ATOM 0 HD1 TYR A 36 5.003 -2.091 0.056 1.00 63.32 H new ATOM 0 HD2 TYR A 36 4.149 0.913 -2.829 1.00 20.24 H new ATOM 0 HE1 TYR A 36 2.673 -2.040 0.786 1.00 1.34 H new ATOM 0 HE2 TYR A 36 1.812 0.949 -2.110 1.00 4.24 H new ATOM 0 HH TYR A 36 0.803 -0.413 0.778 1.00 21.25 H new ATOM 537 N GLN A 37 7.759 -1.098 -4.486 1.00 50.42 N ATOM 538 CA GLN A 37 8.797 -0.582 -5.360 1.00 44.44 C ATOM 539 C GLN A 37 8.463 0.860 -5.633 1.00 20.41 C ATOM 540 O GLN A 37 7.389 1.150 -6.152 1.00 64.24 O ATOM 541 CB GLN A 37 8.804 -1.334 -6.710 1.00 52.01 C ATOM 542 CG GLN A 37 9.815 -0.801 -7.717 1.00 52.55 C ATOM 543 CD GLN A 37 9.671 -1.439 -9.096 1.00 61.14 C ATOM 544 OE1 GLN A 37 8.913 -0.942 -9.946 1.00 70.31 O ATOM 545 NE2 GLN A 37 10.393 -2.507 -9.340 1.00 15.11 N ATOM 0 H GLN A 37 6.838 -1.124 -4.924 1.00 50.42 H new ATOM 0 HA GLN A 37 9.771 -0.703 -4.887 1.00 44.44 H new ATOM 0 HB2 GLN A 37 9.013 -2.388 -6.525 1.00 52.01 H new ATOM 0 HB3 GLN A 37 7.808 -1.279 -7.149 1.00 52.01 H new ATOM 0 HG2 GLN A 37 9.696 0.279 -7.807 1.00 52.55 H new ATOM 0 HG3 GLN A 37 10.823 -0.980 -7.342 1.00 52.55 H new ATOM 0 HE21 GLN A 37 11.004 -2.886 -8.616 1.00 15.11 H new ATOM 0 HE22 GLN A 37 10.343 -2.958 -10.253 1.00 15.11 H new ATOM 554 N GLN A 38 9.336 1.753 -5.266 1.00 63.02 N ATOM 555 CA GLN A 38 9.123 3.155 -5.501 1.00 10.45 C ATOM 556 C GLN A 38 10.193 3.627 -6.465 1.00 33.40 C ATOM 557 O GLN A 38 11.386 3.643 -6.148 1.00 12.14 O ATOM 558 CB GLN A 38 9.162 3.917 -4.158 1.00 64.42 C ATOM 559 CG GLN A 38 8.667 5.388 -4.145 1.00 55.35 C ATOM 560 CD GLN A 38 9.526 6.388 -4.905 1.00 74.15 C ATOM 561 OE1 GLN A 38 10.467 6.951 -4.352 1.00 64.54 O ATOM 562 NE2 GLN A 38 9.176 6.671 -6.134 1.00 32.51 N ATOM 0 H GLN A 38 10.214 1.532 -4.796 1.00 63.02 H new ATOM 0 HA GLN A 38 8.145 3.345 -5.943 1.00 10.45 H new ATOM 0 HB2 GLN A 38 8.566 3.357 -3.438 1.00 64.42 H new ATOM 0 HB3 GLN A 38 10.190 3.907 -3.797 1.00 64.42 H new ATOM 0 HG2 GLN A 38 7.660 5.415 -4.560 1.00 55.35 H new ATOM 0 HG3 GLN A 38 8.593 5.716 -3.108 1.00 55.35 H new ATOM 0 HE21 GLN A 38 8.389 6.185 -6.565 1.00 32.51 H new ATOM 0 HE22 GLN A 38 9.690 7.377 -6.661 1.00 32.51 H new ATOM 571 N LYS A 39 9.748 3.955 -7.629 1.00 50.43 N ATOM 572 CA LYS A 39 10.541 4.412 -8.720 1.00 23.44 C ATOM 573 C LYS A 39 10.156 5.861 -9.047 1.00 33.11 C ATOM 574 O LYS A 39 8.980 6.159 -9.186 1.00 21.33 O ATOM 575 CB LYS A 39 10.240 3.456 -9.902 1.00 13.14 C ATOM 576 CG LYS A 39 10.318 4.046 -11.296 1.00 73.44 C ATOM 577 CD LYS A 39 11.670 4.450 -11.743 1.00 24.53 C ATOM 578 CE LYS A 39 12.573 3.239 -11.981 1.00 4.52 C ATOM 579 NZ LYS A 39 13.911 3.625 -12.468 1.00 64.22 N ATOM 0 H LYS A 39 8.756 3.908 -7.860 1.00 50.43 H new ATOM 0 HA LYS A 39 11.608 4.405 -8.497 1.00 23.44 H new ATOM 0 HB2 LYS A 39 10.937 2.619 -9.848 1.00 13.14 H new ATOM 0 HB3 LYS A 39 9.239 3.047 -9.762 1.00 13.14 H new ATOM 0 HG2 LYS A 39 9.924 3.316 -12.003 1.00 73.44 H new ATOM 0 HG3 LYS A 39 9.665 4.917 -11.340 1.00 73.44 H new ATOM 0 HD2 LYS A 39 11.591 5.031 -12.662 1.00 24.53 H new ATOM 0 HD3 LYS A 39 12.122 5.099 -10.993 1.00 24.53 H new ATOM 0 HE2 LYS A 39 12.675 2.677 -11.053 1.00 4.52 H new ATOM 0 HE3 LYS A 39 12.103 2.575 -12.706 1.00 4.52 H new ATOM 0 HZ1 LYS A 39 14.487 2.771 -12.615 1.00 64.22 H new ATOM 0 HZ2 LYS A 39 13.818 4.139 -13.367 1.00 64.22 H new ATOM 0 HZ3 LYS A 39 14.373 4.237 -11.766 1.00 64.22 H new ATOM 593 N PRO A 40 11.129 6.790 -9.097 1.00 30.45 N ATOM 594 CA PRO A 40 10.871 8.181 -9.499 1.00 61.34 C ATOM 595 C PRO A 40 10.286 8.228 -10.920 1.00 52.11 C ATOM 596 O PRO A 40 10.886 7.701 -11.870 1.00 0.14 O ATOM 597 CB PRO A 40 12.265 8.822 -9.470 1.00 21.32 C ATOM 598 CG PRO A 40 13.045 7.974 -8.529 1.00 32.41 C ATOM 599 CD PRO A 40 12.544 6.578 -8.737 1.00 64.01 C ATOM 0 HA PRO A 40 10.154 8.689 -8.854 1.00 61.34 H new ATOM 0 HB2 PRO A 40 12.717 8.834 -10.462 1.00 21.32 H new ATOM 0 HB3 PRO A 40 12.219 9.856 -9.128 1.00 21.32 H new ATOM 0 HG2 PRO A 40 14.113 8.042 -8.734 1.00 32.41 H new ATOM 0 HG3 PRO A 40 12.897 8.294 -7.498 1.00 32.41 H new ATOM 0 HD2 PRO A 40 13.091 6.066 -9.529 1.00 64.01 H new ATOM 0 HD3 PRO A 40 12.646 5.973 -7.836 1.00 64.01 H new ATOM 607 N GLY A 41 9.128 8.832 -11.062 1.00 10.23 N ATOM 608 CA GLY A 41 8.457 8.859 -12.349 1.00 11.14 C ATOM 609 C GLY A 41 7.450 7.729 -12.463 1.00 1.14 C ATOM 610 O GLY A 41 6.800 7.546 -13.502 1.00 44.41 O ATOM 0 H GLY A 41 8.631 9.309 -10.310 1.00 10.23 H new ATOM 0 HA2 GLY A 41 7.951 9.816 -12.479 1.00 11.14 H new ATOM 0 HA3 GLY A 41 9.193 8.776 -13.148 1.00 11.14 H new ATOM 614 N LYS A 42 7.321 6.981 -11.395 1.00 24.11 N ATOM 615 CA LYS A 42 6.389 5.909 -11.294 1.00 45.43 C ATOM 616 C LYS A 42 5.736 6.047 -9.930 1.00 33.34 C ATOM 617 O LYS A 42 6.168 6.882 -9.127 1.00 0.45 O ATOM 618 CB LYS A 42 7.115 4.604 -11.353 1.00 60.14 C ATOM 619 CG LYS A 42 6.250 3.388 -11.616 1.00 13.43 C ATOM 620 CD LYS A 42 7.126 2.186 -11.735 1.00 2.35 C ATOM 621 CE LYS A 42 6.352 0.900 -11.948 1.00 32.45 C ATOM 622 NZ LYS A 42 7.267 -0.276 -12.069 1.00 21.21 N ATOM 0 H LYS A 42 7.882 7.113 -10.554 1.00 24.11 H new ATOM 0 HA LYS A 42 5.659 5.939 -12.103 1.00 45.43 H new ATOM 0 HB2 LYS A 42 7.873 4.665 -12.134 1.00 60.14 H new ATOM 0 HB3 LYS A 42 7.640 4.457 -10.409 1.00 60.14 H new ATOM 0 HG2 LYS A 42 5.534 3.253 -10.806 1.00 13.43 H new ATOM 0 HG3 LYS A 42 5.674 3.526 -12.531 1.00 13.43 H new ATOM 0 HD2 LYS A 42 7.816 2.329 -12.566 1.00 2.35 H new ATOM 0 HD3 LYS A 42 7.729 2.094 -10.832 1.00 2.35 H new ATOM 0 HE2 LYS A 42 5.666 0.745 -11.115 1.00 32.45 H new ATOM 0 HE3 LYS A 42 5.745 0.984 -12.849 1.00 32.45 H new ATOM 0 HZ1 LYS A 42 6.709 -1.131 -12.265 1.00 21.21 H new ATOM 0 HZ2 LYS A 42 7.938 -0.115 -12.847 1.00 21.21 H new ATOM 0 HZ3 LYS A 42 7.791 -0.401 -11.180 1.00 21.21 H new ATOM 636 N ALA A 43 4.724 5.307 -9.653 1.00 21.10 N ATOM 637 CA ALA A 43 4.133 5.348 -8.347 1.00 33.41 C ATOM 638 C ALA A 43 4.484 4.072 -7.602 1.00 11.23 C ATOM 639 O ALA A 43 4.547 3.004 -8.220 1.00 24.44 O ATOM 640 CB ALA A 43 2.649 5.508 -8.461 1.00 23.21 C ATOM 0 H ALA A 43 4.281 4.662 -10.307 1.00 21.10 H new ATOM 0 HA ALA A 43 4.523 6.201 -7.791 1.00 33.41 H new ATOM 0 HB1 ALA A 43 2.209 5.538 -7.464 1.00 23.21 H new ATOM 0 HB2 ALA A 43 2.422 6.436 -8.986 1.00 23.21 H new ATOM 0 HB3 ALA A 43 2.234 4.667 -9.016 1.00 23.21 H new ATOM 646 N PRO A 44 4.798 4.154 -6.287 1.00 5.15 N ATOM 647 CA PRO A 44 5.102 2.974 -5.492 1.00 14.12 C ATOM 648 C PRO A 44 3.953 1.959 -5.525 1.00 41.11 C ATOM 649 O PRO A 44 2.838 2.234 -5.071 1.00 42.24 O ATOM 650 CB PRO A 44 5.325 3.518 -4.055 1.00 63.23 C ATOM 651 CG PRO A 44 4.801 4.910 -4.086 1.00 42.44 C ATOM 652 CD PRO A 44 4.911 5.384 -5.508 1.00 53.24 C ATOM 0 HA PRO A 44 5.972 2.440 -5.874 1.00 14.12 H new ATOM 0 HB2 PRO A 44 4.797 2.914 -3.318 1.00 63.23 H new ATOM 0 HB3 PRO A 44 6.381 3.499 -3.785 1.00 63.23 H new ATOM 0 HG2 PRO A 44 3.765 4.941 -3.747 1.00 42.44 H new ATOM 0 HG3 PRO A 44 5.374 5.554 -3.419 1.00 42.44 H new ATOM 0 HD2 PRO A 44 4.120 6.091 -5.758 1.00 53.24 H new ATOM 0 HD3 PRO A 44 5.860 5.889 -5.691 1.00 53.24 H new ATOM 660 N LYS A 45 4.247 0.814 -6.069 1.00 51.23 N ATOM 661 CA LYS A 45 3.311 -0.275 -6.185 1.00 73.45 C ATOM 662 C LYS A 45 3.876 -1.448 -5.480 1.00 1.54 C ATOM 663 O LYS A 45 5.095 -1.699 -5.559 1.00 63.23 O ATOM 664 CB LYS A 45 3.014 -0.640 -7.649 1.00 34.42 C ATOM 665 CG LYS A 45 2.067 -1.844 -7.782 1.00 32.13 C ATOM 666 CD LYS A 45 1.779 -2.223 -9.226 1.00 42.13 C ATOM 667 CE LYS A 45 0.964 -3.523 -9.293 1.00 30.13 C ATOM 668 NZ LYS A 45 -0.333 -3.424 -8.586 1.00 52.34 N ATOM 0 H LYS A 45 5.167 0.603 -6.455 1.00 51.23 H new ATOM 0 HA LYS A 45 2.366 0.034 -5.739 1.00 73.45 H new ATOM 0 HB2 LYS A 45 2.573 0.221 -8.151 1.00 34.42 H new ATOM 0 HB3 LYS A 45 3.951 -0.862 -8.161 1.00 34.42 H new ATOM 0 HG2 LYS A 45 2.504 -2.700 -7.269 1.00 32.13 H new ATOM 0 HG3 LYS A 45 1.127 -1.616 -7.279 1.00 32.13 H new ATOM 0 HD2 LYS A 45 1.231 -1.418 -9.716 1.00 42.13 H new ATOM 0 HD3 LYS A 45 2.716 -2.347 -9.769 1.00 42.13 H new ATOM 0 HE2 LYS A 45 0.785 -3.781 -10.337 1.00 30.13 H new ATOM 0 HE3 LYS A 45 1.548 -4.335 -8.860 1.00 30.13 H new ATOM 0 HZ1 LYS A 45 -0.833 -4.334 -8.649 1.00 52.34 H new ATOM 0 HZ2 LYS A 45 -0.167 -3.189 -7.587 1.00 52.34 H new ATOM 0 HZ3 LYS A 45 -0.912 -2.680 -9.025 1.00 52.34 H new ATOM 682 N LEU A 46 3.055 -2.128 -4.746 1.00 2.35 N ATOM 683 CA LEU A 46 3.507 -3.252 -4.049 1.00 12.50 C ATOM 684 C LEU A 46 3.704 -4.443 -4.983 1.00 33.45 C ATOM 685 O LEU A 46 2.954 -4.639 -5.950 1.00 4.20 O ATOM 686 CB LEU A 46 2.639 -3.547 -2.804 1.00 4.12 C ATOM 687 CG LEU A 46 1.241 -4.129 -2.978 1.00 30.43 C ATOM 688 CD1 LEU A 46 1.329 -5.591 -3.263 1.00 55.42 C ATOM 689 CD2 LEU A 46 0.406 -3.860 -1.752 1.00 12.23 C ATOM 0 H LEU A 46 2.066 -1.910 -4.624 1.00 2.35 H new ATOM 0 HA LEU A 46 4.497 -3.033 -3.649 1.00 12.50 H new ATOM 0 HB2 LEU A 46 3.201 -4.234 -2.171 1.00 4.12 H new ATOM 0 HB3 LEU A 46 2.537 -2.614 -2.250 1.00 4.12 H new ATOM 0 HG LEU A 46 0.755 -3.646 -3.826 1.00 30.43 H new ATOM 0 HD11 LEU A 46 0.326 -5.999 -3.386 1.00 55.42 H new ATOM 0 HD12 LEU A 46 1.900 -5.750 -4.178 1.00 55.42 H new ATOM 0 HD13 LEU A 46 1.826 -6.094 -2.434 1.00 55.42 H new ATOM 0 HD21 LEU A 46 -0.590 -4.281 -1.890 1.00 12.23 H new ATOM 0 HD22 LEU A 46 0.877 -4.320 -0.883 1.00 12.23 H new ATOM 0 HD23 LEU A 46 0.326 -2.784 -1.595 1.00 12.23 H new ATOM 701 N LEU A 47 4.732 -5.190 -4.704 1.00 24.41 N ATOM 702 CA LEU A 47 5.085 -6.364 -5.462 1.00 35.21 C ATOM 703 C LEU A 47 4.494 -7.553 -4.781 1.00 4.44 C ATOM 704 O LEU A 47 4.073 -8.515 -5.409 1.00 62.12 O ATOM 705 CB LEU A 47 6.623 -6.576 -5.497 1.00 2.54 C ATOM 706 CG LEU A 47 7.507 -5.454 -6.034 1.00 62.25 C ATOM 707 CD1 LEU A 47 7.041 -4.952 -7.393 1.00 3.53 C ATOM 708 CD2 LEU A 47 7.646 -4.346 -5.029 1.00 51.11 C ATOM 0 H LEU A 47 5.365 -4.999 -3.927 1.00 24.41 H new ATOM 0 HA LEU A 47 4.715 -6.238 -6.479 1.00 35.21 H new ATOM 0 HB2 LEU A 47 6.949 -6.796 -4.480 1.00 2.54 H new ATOM 0 HB3 LEU A 47 6.820 -7.466 -6.094 1.00 2.54 H new ATOM 0 HG LEU A 47 8.501 -5.871 -6.194 1.00 62.25 H new ATOM 0 HD11 LEU A 47 7.702 -4.154 -7.732 1.00 3.53 H new ATOM 0 HD12 LEU A 47 7.063 -5.772 -8.111 1.00 3.53 H new ATOM 0 HD13 LEU A 47 6.024 -4.570 -7.310 1.00 3.53 H new ATOM 0 HD21 LEU A 47 8.281 -3.561 -5.439 1.00 51.11 H new ATOM 0 HD22 LEU A 47 6.662 -3.935 -4.802 1.00 51.11 H new ATOM 0 HD23 LEU A 47 8.096 -4.737 -4.116 1.00 51.11 H new ATOM 720 N ILE A 48 4.451 -7.465 -3.478 1.00 34.31 N ATOM 721 CA ILE A 48 4.038 -8.552 -2.651 1.00 64.21 C ATOM 722 C ILE A 48 3.083 -8.029 -1.624 1.00 14.15 C ATOM 723 O ILE A 48 3.295 -6.950 -1.071 1.00 70.35 O ATOM 724 CB ILE A 48 5.272 -9.179 -1.936 1.00 42.44 C ATOM 725 CG1 ILE A 48 6.277 -9.678 -2.973 1.00 53.54 C ATOM 726 CG2 ILE A 48 4.858 -10.304 -1.001 1.00 22.04 C ATOM 727 CD1 ILE A 48 7.522 -10.284 -2.404 1.00 2.43 C ATOM 0 H ILE A 48 4.706 -6.623 -2.961 1.00 34.31 H new ATOM 0 HA ILE A 48 3.559 -9.317 -3.262 1.00 64.21 H new ATOM 0 HB ILE A 48 5.745 -8.407 -1.329 1.00 42.44 H new ATOM 0 HG12 ILE A 48 5.787 -10.418 -3.606 1.00 53.54 H new ATOM 0 HG13 ILE A 48 6.558 -8.844 -3.616 1.00 53.54 H new ATOM 0 HG21 ILE A 48 5.742 -10.720 -0.518 1.00 22.04 H new ATOM 0 HG22 ILE A 48 4.179 -9.915 -0.242 1.00 22.04 H new ATOM 0 HG23 ILE A 48 4.355 -11.085 -1.572 1.00 22.04 H new ATOM 0 HD11 ILE A 48 8.173 -10.608 -3.216 1.00 2.43 H new ATOM 0 HD12 ILE A 48 8.042 -9.544 -1.796 1.00 2.43 H new ATOM 0 HD13 ILE A 48 7.259 -11.142 -1.785 1.00 2.43 H new ATOM 739 N TYR A 49 2.060 -8.784 -1.347 1.00 32.04 N ATOM 740 CA TYR A 49 1.054 -8.353 -0.411 1.00 62.52 C ATOM 741 C TYR A 49 0.949 -9.261 0.790 1.00 71.32 C ATOM 742 O TYR A 49 0.218 -8.978 1.699 1.00 63.42 O ATOM 743 CB TYR A 49 -0.316 -8.146 -1.080 1.00 44.11 C ATOM 744 CG TYR A 49 -0.839 -9.346 -1.815 1.00 20.44 C ATOM 745 CD1 TYR A 49 -1.414 -10.407 -1.133 1.00 24.11 C ATOM 746 CD2 TYR A 49 -0.759 -9.415 -3.189 1.00 71.04 C ATOM 747 CE1 TYR A 49 -1.895 -11.502 -1.799 1.00 71.20 C ATOM 748 CE2 TYR A 49 -1.240 -10.517 -3.868 1.00 65.13 C ATOM 749 CZ TYR A 49 -1.806 -11.557 -3.168 1.00 12.31 C ATOM 750 OH TYR A 49 -2.299 -12.653 -3.842 1.00 2.41 O ATOM 0 H TYR A 49 1.897 -9.704 -1.755 1.00 32.04 H new ATOM 0 HA TYR A 49 1.385 -7.381 -0.045 1.00 62.52 H new ATOM 0 HB2 TYR A 49 -1.039 -7.860 -0.316 1.00 44.11 H new ATOM 0 HB3 TYR A 49 -0.243 -7.312 -1.778 1.00 44.11 H new ATOM 0 HD1 TYR A 49 -1.484 -10.369 -0.056 1.00 24.11 H new ATOM 0 HD2 TYR A 49 -0.316 -8.599 -3.740 1.00 71.04 H new ATOM 0 HE1 TYR A 49 -2.342 -12.318 -1.251 1.00 71.20 H new ATOM 0 HE2 TYR A 49 -1.172 -10.562 -4.945 1.00 65.13 H new ATOM 0 HH TYR A 49 -2.159 -12.535 -4.805 1.00 2.41 H new ATOM 760 N ASP A 50 1.662 -10.353 0.779 1.00 2.32 N ATOM 761 CA ASP A 50 1.690 -11.232 1.940 1.00 24.03 C ATOM 762 C ASP A 50 2.908 -12.065 1.904 1.00 10.22 C ATOM 763 O ASP A 50 2.874 -13.139 1.333 1.00 53.40 O ATOM 764 CB ASP A 50 0.473 -12.150 2.001 1.00 40.45 C ATOM 765 CG ASP A 50 0.438 -13.006 3.257 1.00 43.35 C ATOM 766 OD1 ASP A 50 0.992 -14.128 3.255 1.00 24.25 O ATOM 767 OD2 ASP A 50 -0.167 -12.571 4.249 1.00 51.42 O ATOM 0 H ASP A 50 2.231 -10.663 -0.009 1.00 2.32 H new ATOM 0 HA ASP A 50 1.681 -10.595 2.825 1.00 24.03 H new ATOM 0 HB2 ASP A 50 -0.433 -11.546 1.954 1.00 40.45 H new ATOM 0 HB3 ASP A 50 0.470 -12.799 1.125 1.00 40.45 H new ATOM 772 N ALA A 51 4.006 -11.512 2.419 1.00 40.00 N ATOM 773 CA ALA A 51 5.328 -12.181 2.535 1.00 4.22 C ATOM 774 C ALA A 51 5.872 -12.754 1.208 1.00 2.15 C ATOM 775 O ALA A 51 6.838 -12.243 0.668 1.00 14.14 O ATOM 776 CB ALA A 51 5.336 -13.233 3.640 1.00 22.53 C ATOM 0 H ALA A 51 4.014 -10.559 2.781 1.00 40.00 H new ATOM 0 HA ALA A 51 6.021 -11.386 2.812 1.00 4.22 H new ATOM 0 HB1 ALA A 51 6.320 -13.699 3.692 1.00 22.53 H new ATOM 0 HB2 ALA A 51 5.108 -12.759 4.595 1.00 22.53 H new ATOM 0 HB3 ALA A 51 4.586 -13.994 3.424 1.00 22.53 H new ATOM 782 N SER A 52 5.229 -13.784 0.694 1.00 74.03 N ATOM 783 CA SER A 52 5.671 -14.453 -0.507 1.00 44.12 C ATOM 784 C SER A 52 4.596 -14.374 -1.623 1.00 42.41 C ATOM 785 O SER A 52 4.815 -14.854 -2.741 1.00 2.30 O ATOM 786 CB SER A 52 6.047 -15.921 -0.177 1.00 54.02 C ATOM 787 OG SER A 52 6.525 -16.630 -1.318 1.00 11.40 O ATOM 0 H SER A 52 4.382 -14.180 1.102 1.00 74.03 H new ATOM 0 HA SER A 52 6.558 -13.946 -0.888 1.00 44.12 H new ATOM 0 HB2 SER A 52 6.811 -15.931 0.600 1.00 54.02 H new ATOM 0 HB3 SER A 52 5.175 -16.434 0.227 1.00 54.02 H new ATOM 0 HG SER A 52 6.086 -16.287 -2.124 1.00 11.40 H new ATOM 793 N ASN A 53 3.448 -13.772 -1.313 1.00 41.24 N ATOM 794 CA ASN A 53 2.355 -13.632 -2.290 1.00 43.41 C ATOM 795 C ASN A 53 2.552 -12.426 -3.195 1.00 31.11 C ATOM 796 O ASN A 53 2.383 -11.274 -2.757 1.00 23.55 O ATOM 797 CB ASN A 53 0.980 -13.526 -1.603 1.00 22.33 C ATOM 798 CG ASN A 53 0.498 -14.809 -0.941 1.00 41.35 C ATOM 799 OD1 ASN A 53 0.817 -15.000 0.312 1.00 31.52 O flip ATOM 800 ND2 ASN A 53 -0.179 -15.618 -1.569 1.00 63.22 N flip ATOM 0 H ASN A 53 3.246 -13.372 -0.397 1.00 41.24 H new ATOM 0 HA ASN A 53 2.379 -14.537 -2.897 1.00 43.41 H new ATOM 0 HB2 ASN A 53 1.025 -12.740 -0.850 1.00 22.33 H new ATOM 0 HB3 ASN A 53 0.242 -13.216 -2.343 1.00 22.33 H new ATOM 0 HD21 ASN A 53 -0.411 -15.439 -2.546 1.00 63.22 H new ATOM 0 HD22 ASN A 53 -0.510 -16.469 -1.114 1.00 63.22 H new ATOM 807 N LEU A 54 2.898 -12.688 -4.443 1.00 70.12 N ATOM 808 CA LEU A 54 3.090 -11.645 -5.460 1.00 34.30 C ATOM 809 C LEU A 54 1.764 -11.074 -5.913 1.00 32.01 C ATOM 810 O LEU A 54 0.761 -11.805 -6.051 1.00 52.24 O ATOM 811 CB LEU A 54 3.864 -12.177 -6.697 1.00 3.03 C ATOM 812 CG LEU A 54 5.388 -12.383 -6.593 1.00 0.10 C ATOM 813 CD1 LEU A 54 6.100 -11.063 -6.425 1.00 3.32 C ATOM 814 CD2 LEU A 54 5.766 -13.334 -5.484 1.00 34.42 C ATOM 0 H LEU A 54 3.057 -13.634 -4.791 1.00 70.12 H new ATOM 0 HA LEU A 54 3.682 -10.859 -4.990 1.00 34.30 H new ATOM 0 HB2 LEU A 54 3.421 -13.133 -6.976 1.00 3.03 H new ATOM 0 HB3 LEU A 54 3.681 -11.488 -7.521 1.00 3.03 H new ATOM 0 HG LEU A 54 5.709 -12.838 -7.530 1.00 0.10 H new ATOM 0 HD11 LEU A 54 7.174 -11.235 -6.354 1.00 3.32 H new ATOM 0 HD12 LEU A 54 5.891 -10.425 -7.284 1.00 3.32 H new ATOM 0 HD13 LEU A 54 5.750 -10.574 -5.516 1.00 3.32 H new ATOM 0 HD21 LEU A 54 6.850 -13.445 -5.453 1.00 34.42 H new ATOM 0 HD22 LEU A 54 5.414 -12.939 -4.531 1.00 34.42 H new ATOM 0 HD23 LEU A 54 5.307 -14.306 -5.666 1.00 34.42 H new ATOM 826 N GLU A 55 1.757 -9.783 -6.144 1.00 50.11 N ATOM 827 CA GLU A 55 0.583 -9.081 -6.609 1.00 70.44 C ATOM 828 C GLU A 55 0.424 -9.423 -8.100 1.00 31.42 C ATOM 829 O GLU A 55 1.395 -9.832 -8.756 1.00 25.14 O ATOM 830 CB GLU A 55 0.786 -7.562 -6.384 1.00 40.13 C ATOM 831 CG GLU A 55 -0.488 -6.728 -6.109 1.00 41.44 C ATOM 832 CD GLU A 55 -1.497 -6.698 -7.219 1.00 4.24 C ATOM 833 OE1 GLU A 55 -2.343 -7.615 -7.287 1.00 64.13 O ATOM 834 OE2 GLU A 55 -1.482 -5.743 -8.016 1.00 44.12 O ATOM 0 H GLU A 55 2.573 -9.184 -6.014 1.00 50.11 H new ATOM 0 HA GLU A 55 -0.318 -9.373 -6.070 1.00 70.44 H new ATOM 0 HB2 GLU A 55 1.468 -7.430 -5.544 1.00 40.13 H new ATOM 0 HB3 GLU A 55 1.280 -7.150 -7.264 1.00 40.13 H new ATOM 0 HG2 GLU A 55 -0.971 -7.120 -5.214 1.00 41.44 H new ATOM 0 HG3 GLU A 55 -0.189 -5.704 -5.887 1.00 41.44 H new ATOM 841 N THR A 56 -0.752 -9.290 -8.612 1.00 53.30 N ATOM 842 CA THR A 56 -1.045 -9.642 -9.968 1.00 20.32 C ATOM 843 C THR A 56 -0.335 -8.688 -10.943 1.00 12.40 C ATOM 844 O THR A 56 -0.385 -7.468 -10.786 1.00 61.43 O ATOM 845 CB THR A 56 -2.564 -9.632 -10.191 1.00 1.32 C ATOM 846 OG1 THR A 56 -3.176 -10.506 -9.219 1.00 0.41 O ATOM 847 CG2 THR A 56 -2.913 -10.121 -11.584 1.00 20.41 C ATOM 0 H THR A 56 -1.553 -8.928 -8.095 1.00 53.30 H new ATOM 0 HA THR A 56 -0.673 -10.648 -10.162 1.00 20.32 H new ATOM 0 HB THR A 56 -2.930 -8.611 -10.082 1.00 1.32 H new ATOM 0 HG1 THR A 56 -4.148 -10.509 -9.348 1.00 0.41 H new ATOM 0 HG21 THR A 56 -3.995 -10.104 -11.715 1.00 20.41 H new ATOM 0 HG22 THR A 56 -2.447 -9.471 -12.325 1.00 20.41 H new ATOM 0 HG23 THR A 56 -2.548 -11.140 -11.714 1.00 20.41 H new ATOM 855 N GLY A 57 0.356 -9.257 -11.913 1.00 62.44 N ATOM 856 CA GLY A 57 1.080 -8.466 -12.875 1.00 61.40 C ATOM 857 C GLY A 57 2.535 -8.341 -12.497 1.00 62.15 C ATOM 858 O GLY A 57 3.391 -8.053 -13.340 1.00 12.41 O ATOM 0 H GLY A 57 0.428 -10.265 -12.051 1.00 62.44 H new ATOM 0 HA2 GLY A 57 0.996 -8.922 -13.861 1.00 61.40 H new ATOM 0 HA3 GLY A 57 0.633 -7.474 -12.944 1.00 61.40 H new ATOM 862 N VAL A 58 2.820 -8.564 -11.234 1.00 5.10 N ATOM 863 CA VAL A 58 4.161 -8.485 -10.728 1.00 15.21 C ATOM 864 C VAL A 58 4.945 -9.751 -11.101 1.00 55.44 C ATOM 865 O VAL A 58 4.521 -10.877 -10.776 1.00 50.04 O ATOM 866 CB VAL A 58 4.161 -8.283 -9.200 1.00 0.33 C ATOM 867 CG1 VAL A 58 5.576 -8.186 -8.669 1.00 0.42 C ATOM 868 CG2 VAL A 58 3.368 -7.036 -8.840 1.00 43.01 C ATOM 0 H VAL A 58 2.122 -8.806 -10.531 1.00 5.10 H new ATOM 0 HA VAL A 58 4.648 -7.623 -11.184 1.00 15.21 H new ATOM 0 HB VAL A 58 3.687 -9.148 -8.736 1.00 0.33 H new ATOM 0 HG11 VAL A 58 5.550 -8.044 -7.589 1.00 0.42 H new ATOM 0 HG12 VAL A 58 6.116 -9.104 -8.901 1.00 0.42 H new ATOM 0 HG13 VAL A 58 6.082 -7.340 -9.134 1.00 0.42 H new ATOM 0 HG21 VAL A 58 3.373 -6.901 -7.758 1.00 43.01 H new ATOM 0 HG22 VAL A 58 3.821 -6.167 -9.316 1.00 43.01 H new ATOM 0 HG23 VAL A 58 2.340 -7.145 -9.187 1.00 43.01 H new ATOM 878 N PRO A 59 6.072 -9.581 -11.810 1.00 21.04 N ATOM 879 CA PRO A 59 6.904 -10.689 -12.264 1.00 12.12 C ATOM 880 C PRO A 59 7.438 -11.576 -11.136 1.00 32.12 C ATOM 881 O PRO A 59 7.662 -11.125 -10.008 1.00 31.31 O ATOM 882 CB PRO A 59 8.067 -10.029 -12.983 1.00 34.01 C ATOM 883 CG PRO A 59 8.020 -8.588 -12.631 1.00 41.22 C ATOM 884 CD PRO A 59 6.611 -8.279 -12.246 1.00 75.03 C ATOM 0 HA PRO A 59 6.312 -11.358 -12.889 1.00 12.12 H new ATOM 0 HB2 PRO A 59 9.014 -10.472 -12.676 1.00 34.01 H new ATOM 0 HB3 PRO A 59 7.985 -10.167 -14.061 1.00 34.01 H new ATOM 0 HG2 PRO A 59 8.701 -8.369 -11.809 1.00 41.22 H new ATOM 0 HG3 PRO A 59 8.333 -7.974 -13.476 1.00 41.22 H new ATOM 0 HD2 PRO A 59 6.568 -7.540 -11.446 1.00 75.03 H new ATOM 0 HD3 PRO A 59 6.047 -7.873 -13.086 1.00 75.03 H new ATOM 892 N SER A 60 7.671 -12.825 -11.481 1.00 3.15 N ATOM 893 CA SER A 60 8.136 -13.855 -10.571 1.00 34.45 C ATOM 894 C SER A 60 9.592 -13.637 -10.110 1.00 20.13 C ATOM 895 O SER A 60 10.091 -14.364 -9.254 1.00 42.41 O ATOM 896 CB SER A 60 7.970 -15.203 -11.245 1.00 52.43 C ATOM 897 OG SER A 60 6.618 -15.361 -11.669 1.00 33.12 O ATOM 0 H SER A 60 7.538 -13.164 -12.434 1.00 3.15 H new ATOM 0 HA SER A 60 7.533 -13.811 -9.664 1.00 34.45 H new ATOM 0 HB2 SER A 60 8.641 -15.279 -12.100 1.00 52.43 H new ATOM 0 HB3 SER A 60 8.241 -16.002 -10.555 1.00 52.43 H new ATOM 0 HG SER A 60 6.512 -16.232 -12.106 1.00 33.12 H new ATOM 903 N ARG A 61 10.270 -12.635 -10.682 1.00 1.13 N ATOM 904 CA ARG A 61 11.629 -12.293 -10.265 1.00 10.51 C ATOM 905 C ARG A 61 11.672 -11.689 -8.864 1.00 40.53 C ATOM 906 O ARG A 61 12.737 -11.620 -8.252 1.00 45.44 O ATOM 907 CB ARG A 61 12.396 -11.440 -11.322 1.00 43.43 C ATOM 908 CG ARG A 61 11.595 -10.336 -12.010 1.00 53.03 C ATOM 909 CD ARG A 61 12.464 -9.538 -12.997 1.00 44.14 C ATOM 910 NE ARG A 61 11.657 -8.888 -14.065 1.00 71.51 N ATOM 911 CZ ARG A 61 11.991 -7.755 -14.724 1.00 73.54 C ATOM 912 NH1 ARG A 61 12.897 -6.937 -14.239 1.00 54.50 N ATOM 913 NH2 ARG A 61 11.345 -7.415 -15.839 1.00 24.35 N ATOM 0 H ARG A 61 9.899 -12.051 -11.431 1.00 1.13 H new ATOM 0 HA ARG A 61 12.174 -13.235 -10.205 1.00 10.51 H new ATOM 0 HB2 ARG A 61 13.258 -10.984 -10.834 1.00 43.43 H new ATOM 0 HB3 ARG A 61 12.782 -12.112 -12.089 1.00 43.43 H new ATOM 0 HG2 ARG A 61 10.750 -10.775 -12.541 1.00 53.03 H new ATOM 0 HG3 ARG A 61 11.184 -9.662 -11.259 1.00 53.03 H new ATOM 0 HD2 ARG A 61 13.022 -8.776 -12.452 1.00 44.14 H new ATOM 0 HD3 ARG A 61 13.196 -10.204 -13.453 1.00 44.14 H new ATOM 0 HE ARG A 61 10.777 -9.335 -14.322 1.00 71.51 H new ATOM 0 HH11 ARG A 61 13.358 -7.153 -13.355 1.00 54.50 H new ATOM 0 HH12 ARG A 61 13.139 -6.086 -14.746 1.00 54.50 H new ATOM 0 HH21 ARG A 61 10.597 -8.010 -16.197 1.00 24.35 H new ATOM 0 HH22 ARG A 61 11.598 -6.560 -16.335 1.00 24.35 H new ATOM 927 N PHE A 62 10.511 -11.289 -8.355 1.00 1.24 N ATOM 928 CA PHE A 62 10.401 -10.794 -6.990 1.00 72.51 C ATOM 929 C PHE A 62 9.821 -11.899 -6.108 1.00 64.41 C ATOM 930 O PHE A 62 8.989 -12.689 -6.573 1.00 73.20 O ATOM 931 CB PHE A 62 9.451 -9.592 -6.912 1.00 74.13 C ATOM 932 CG PHE A 62 9.820 -8.413 -7.753 1.00 13.21 C ATOM 933 CD1 PHE A 62 10.826 -7.559 -7.366 1.00 51.01 C ATOM 934 CD2 PHE A 62 9.138 -8.146 -8.924 1.00 41.24 C ATOM 935 CE1 PHE A 62 11.151 -6.466 -8.129 1.00 3.22 C ATOM 936 CE2 PHE A 62 9.457 -7.046 -9.689 1.00 32.52 C ATOM 937 CZ PHE A 62 10.465 -6.208 -9.287 1.00 64.15 C ATOM 0 H PHE A 62 9.631 -11.299 -8.871 1.00 1.24 H new ATOM 0 HA PHE A 62 11.394 -10.493 -6.657 1.00 72.51 H new ATOM 0 HB2 PHE A 62 8.453 -9.922 -7.202 1.00 74.13 H new ATOM 0 HB3 PHE A 62 9.390 -9.268 -5.873 1.00 74.13 H new ATOM 0 HD1 PHE A 62 11.366 -7.751 -6.451 1.00 51.01 H new ATOM 0 HD2 PHE A 62 8.346 -8.807 -9.243 1.00 41.24 H new ATOM 0 HE1 PHE A 62 11.948 -5.808 -7.817 1.00 3.22 H new ATOM 0 HE2 PHE A 62 8.916 -6.844 -10.601 1.00 32.52 H new ATOM 0 HZ PHE A 62 10.719 -5.344 -9.883 1.00 64.15 H new ATOM 947 N SER A 63 10.262 -11.969 -4.864 1.00 73.22 N ATOM 948 CA SER A 63 9.703 -12.898 -3.903 1.00 1.40 C ATOM 949 C SER A 63 10.194 -12.518 -2.496 1.00 70.11 C ATOM 950 O SER A 63 11.194 -11.814 -2.354 1.00 43.42 O ATOM 951 CB SER A 63 10.094 -14.355 -4.251 1.00 61.51 C ATOM 952 OG SER A 63 9.394 -15.290 -3.434 1.00 1.32 O ATOM 0 H SER A 63 11.013 -11.386 -4.495 1.00 73.22 H new ATOM 0 HA SER A 63 8.615 -12.838 -3.933 1.00 1.40 H new ATOM 0 HB2 SER A 63 9.875 -14.551 -5.301 1.00 61.51 H new ATOM 0 HB3 SER A 63 11.168 -14.487 -4.119 1.00 61.51 H new ATOM 0 HG SER A 63 9.660 -16.201 -3.678 1.00 1.32 H new ATOM 958 N GLY A 64 9.479 -12.942 -1.476 1.00 72.25 N ATOM 959 CA GLY A 64 9.876 -12.653 -0.129 1.00 54.40 C ATOM 960 C GLY A 64 9.656 -13.840 0.761 1.00 43.11 C ATOM 961 O GLY A 64 8.847 -14.702 0.459 1.00 40.02 O ATOM 0 H GLY A 64 8.621 -13.487 -1.561 1.00 72.25 H new ATOM 0 HA2 GLY A 64 10.928 -12.369 -0.109 1.00 54.40 H new ATOM 0 HA3 GLY A 64 9.308 -11.802 0.247 1.00 54.40 H new ATOM 965 N SER A 65 10.399 -13.916 1.817 1.00 54.04 N ATOM 966 CA SER A 65 10.279 -14.979 2.782 1.00 30.11 C ATOM 967 C SER A 65 10.548 -14.429 4.175 1.00 34.32 C ATOM 968 O SER A 65 11.050 -13.312 4.308 1.00 4.51 O ATOM 969 CB SER A 65 11.244 -16.105 2.431 1.00 71.42 C ATOM 970 OG SER A 65 10.963 -16.599 1.123 1.00 50.54 O ATOM 0 H SER A 65 11.121 -13.233 2.044 1.00 54.04 H new ATOM 0 HA SER A 65 9.268 -15.387 2.765 1.00 30.11 H new ATOM 0 HB2 SER A 65 12.271 -15.743 2.479 1.00 71.42 H new ATOM 0 HB3 SER A 65 11.156 -16.911 3.160 1.00 71.42 H new ATOM 0 HG SER A 65 11.589 -17.321 0.905 1.00 50.54 H new ATOM 976 N GLY A 66 10.191 -15.170 5.190 1.00 50.14 N ATOM 977 CA GLY A 66 10.414 -14.720 6.542 1.00 73.31 C ATOM 978 C GLY A 66 9.177 -14.885 7.368 1.00 23.11 C ATOM 979 O GLY A 66 8.159 -15.366 6.855 1.00 21.20 O ATOM 0 H GLY A 66 9.746 -16.084 5.109 1.00 50.14 H new ATOM 0 HA2 GLY A 66 11.232 -15.285 6.988 1.00 73.31 H new ATOM 0 HA3 GLY A 66 10.716 -13.673 6.536 1.00 73.31 H new ATOM 983 N SER A 67 9.236 -14.483 8.618 1.00 30.52 N ATOM 984 CA SER A 67 8.121 -14.634 9.522 1.00 74.15 C ATOM 985 C SER A 67 8.374 -13.904 10.839 1.00 14.22 C ATOM 986 O SER A 67 9.539 -13.712 11.250 1.00 70.42 O ATOM 987 CB SER A 67 7.859 -16.128 9.789 1.00 55.32 C ATOM 988 OG SER A 67 9.025 -16.771 10.301 1.00 5.22 O ATOM 0 H SER A 67 10.057 -14.043 9.034 1.00 30.52 H new ATOM 0 HA SER A 67 7.242 -14.191 9.053 1.00 74.15 H new ATOM 0 HB2 SER A 67 7.039 -16.235 10.499 1.00 55.32 H new ATOM 0 HB3 SER A 67 7.547 -16.616 8.866 1.00 55.32 H new ATOM 0 HG SER A 67 8.832 -17.718 10.464 1.00 5.22 H new ATOM 994 N GLY A 68 7.298 -13.474 11.464 1.00 30.35 N ATOM 995 CA GLY A 68 7.346 -12.877 12.769 1.00 24.12 C ATOM 996 C GLY A 68 7.833 -11.466 12.750 1.00 21.23 C ATOM 997 O GLY A 68 7.074 -10.533 12.450 1.00 33.44 O ATOM 0 H GLY A 68 6.359 -13.533 11.071 1.00 30.35 H new ATOM 0 HA2 GLY A 68 6.350 -12.905 13.212 1.00 24.12 H new ATOM 0 HA3 GLY A 68 7.997 -13.471 13.410 1.00 24.12 H new ATOM 1001 N THR A 69 9.078 -11.302 13.085 1.00 11.12 N ATOM 1002 CA THR A 69 9.695 -10.004 13.124 1.00 44.42 C ATOM 1003 C THR A 69 10.709 -9.816 12.011 1.00 2.34 C ATOM 1004 O THR A 69 11.049 -8.695 11.672 1.00 72.25 O ATOM 1005 CB THR A 69 10.395 -9.768 14.477 1.00 72.44 C ATOM 1006 OG1 THR A 69 11.341 -10.837 14.733 1.00 74.12 O ATOM 1007 CG2 THR A 69 9.375 -9.699 15.608 1.00 31.32 C ATOM 0 H THR A 69 9.701 -12.068 13.341 1.00 11.12 H new ATOM 0 HA THR A 69 8.892 -9.279 12.988 1.00 44.42 H new ATOM 0 HB THR A 69 10.925 -8.817 14.431 1.00 72.44 H new ATOM 0 HG1 THR A 69 12.087 -10.772 14.101 1.00 74.12 H new ATOM 0 HG21 THR A 69 9.891 -9.532 16.554 1.00 31.32 H new ATOM 0 HG22 THR A 69 8.682 -8.879 15.423 1.00 31.32 H new ATOM 0 HG23 THR A 69 8.822 -10.637 15.657 1.00 31.32 H new ATOM 1015 N ASP A 70 11.190 -10.900 11.439 1.00 32.51 N ATOM 1016 CA ASP A 70 12.239 -10.791 10.432 1.00 0.33 C ATOM 1017 C ASP A 70 11.753 -11.272 9.101 1.00 63.10 C ATOM 1018 O ASP A 70 11.139 -12.338 8.996 1.00 42.31 O ATOM 1019 CB ASP A 70 13.481 -11.591 10.840 1.00 73.01 C ATOM 1020 CG ASP A 70 14.184 -11.056 12.063 1.00 12.21 C ATOM 1021 OD1 ASP A 70 13.689 -11.268 13.207 1.00 23.23 O ATOM 1022 OD2 ASP A 70 15.265 -10.451 11.914 1.00 12.31 O ATOM 0 H ASP A 70 10.883 -11.851 11.644 1.00 32.51 H new ATOM 0 HA ASP A 70 12.507 -9.737 10.355 1.00 0.33 H new ATOM 0 HB2 ASP A 70 13.189 -12.625 11.025 1.00 73.01 H new ATOM 0 HB3 ASP A 70 14.183 -11.602 10.006 1.00 73.01 H new ATOM 1027 N PHE A 71 12.028 -10.496 8.084 1.00 73.20 N ATOM 1028 CA PHE A 71 11.625 -10.812 6.737 1.00 74.31 C ATOM 1029 C PHE A 71 12.750 -10.555 5.773 1.00 61.33 C ATOM 1030 O PHE A 71 13.611 -9.710 6.022 1.00 63.10 O ATOM 1031 CB PHE A 71 10.395 -10.008 6.334 1.00 3.31 C ATOM 1032 CG PHE A 71 9.182 -10.307 7.162 1.00 12.11 C ATOM 1033 CD1 PHE A 71 8.921 -9.591 8.319 1.00 44.50 C ATOM 1034 CD2 PHE A 71 8.302 -11.307 6.783 1.00 51.54 C ATOM 1035 CE1 PHE A 71 7.813 -9.868 9.077 1.00 73.52 C ATOM 1036 CE2 PHE A 71 7.188 -11.585 7.539 1.00 0.53 C ATOM 1037 CZ PHE A 71 6.944 -10.863 8.689 1.00 15.24 C ATOM 0 H PHE A 71 12.542 -9.619 8.168 1.00 73.20 H new ATOM 0 HA PHE A 71 11.370 -11.871 6.703 1.00 74.31 H new ATOM 0 HB2 PHE A 71 10.625 -8.945 6.413 1.00 3.31 H new ATOM 0 HB3 PHE A 71 10.168 -10.209 5.287 1.00 3.31 H new ATOM 0 HD1 PHE A 71 9.597 -8.807 8.627 1.00 44.50 H new ATOM 0 HD2 PHE A 71 8.493 -11.874 5.884 1.00 51.54 H new ATOM 0 HE1 PHE A 71 7.622 -9.306 9.979 1.00 73.52 H new ATOM 0 HE2 PHE A 71 6.507 -12.365 7.234 1.00 0.53 H new ATOM 0 HZ PHE A 71 6.070 -11.079 9.286 1.00 15.24 H new ATOM 1047 N THR A 72 12.752 -11.275 4.693 1.00 72.23 N ATOM 1048 CA THR A 72 13.761 -11.152 3.690 1.00 72.20 C ATOM 1049 C THR A 72 13.130 -11.172 2.298 1.00 62.34 C ATOM 1050 O THR A 72 12.476 -12.133 1.908 1.00 34.05 O ATOM 1051 CB THR A 72 14.784 -12.294 3.828 1.00 4.44 C ATOM 1052 OG1 THR A 72 15.303 -12.277 5.168 1.00 60.21 O ATOM 1053 CG2 THR A 72 15.937 -12.125 2.842 1.00 75.44 C ATOM 0 H THR A 72 12.041 -11.975 4.482 1.00 72.23 H new ATOM 0 HA THR A 72 14.276 -10.201 3.824 1.00 72.20 H new ATOM 0 HB THR A 72 14.289 -13.241 3.612 1.00 4.44 H new ATOM 0 HG1 THR A 72 15.956 -13.000 5.275 1.00 60.21 H new ATOM 0 HG21 THR A 72 16.643 -12.947 2.963 1.00 75.44 H new ATOM 0 HG22 THR A 72 15.548 -12.128 1.824 1.00 75.44 H new ATOM 0 HG23 THR A 72 16.444 -11.179 3.034 1.00 75.44 H new ATOM 1061 N PHE A 73 13.312 -10.103 1.601 1.00 73.20 N ATOM 1062 CA PHE A 73 12.850 -9.937 0.253 1.00 5.02 C ATOM 1063 C PHE A 73 13.993 -10.254 -0.668 1.00 0.53 C ATOM 1064 O PHE A 73 15.125 -9.803 -0.438 1.00 40.12 O ATOM 1065 CB PHE A 73 12.392 -8.496 0.071 1.00 71.21 C ATOM 1066 CG PHE A 73 12.054 -8.067 -1.323 1.00 73.04 C ATOM 1067 CD1 PHE A 73 10.802 -8.295 -1.870 1.00 3.44 C ATOM 1068 CD2 PHE A 73 12.994 -7.405 -2.073 1.00 44.43 C ATOM 1069 CE1 PHE A 73 10.514 -7.864 -3.150 1.00 63.31 C ATOM 1070 CE2 PHE A 73 12.716 -6.971 -3.335 1.00 20.51 C ATOM 1071 CZ PHE A 73 11.479 -7.199 -3.879 1.00 65.50 C ATOM 0 H PHE A 73 13.805 -9.286 1.962 1.00 73.20 H new ATOM 0 HA PHE A 73 12.013 -10.599 0.032 1.00 5.02 H new ATOM 0 HB2 PHE A 73 11.515 -8.336 0.698 1.00 71.21 H new ATOM 0 HB3 PHE A 73 13.177 -7.840 0.448 1.00 71.21 H new ATOM 0 HD1 PHE A 73 10.049 -8.811 -1.294 1.00 3.44 H new ATOM 0 HD2 PHE A 73 13.973 -7.224 -1.655 1.00 44.43 H new ATOM 0 HE1 PHE A 73 9.539 -8.046 -3.578 1.00 63.31 H new ATOM 0 HE2 PHE A 73 13.470 -6.448 -3.905 1.00 20.51 H new ATOM 0 HZ PHE A 73 11.259 -6.858 -4.880 1.00 65.50 H new ATOM 1081 N THR A 74 13.735 -11.026 -1.665 1.00 24.44 N ATOM 1082 CA THR A 74 14.754 -11.404 -2.551 1.00 4.55 C ATOM 1083 C THR A 74 14.315 -11.226 -4.009 1.00 33.25 C ATOM 1084 O THR A 74 13.166 -11.511 -4.374 1.00 41.54 O ATOM 1085 CB THR A 74 15.226 -12.867 -2.273 1.00 60.44 C ATOM 1086 OG1 THR A 74 16.360 -13.163 -3.063 1.00 4.24 O ATOM 1087 CG2 THR A 74 14.132 -13.885 -2.581 1.00 44.25 C ATOM 0 H THR A 74 12.813 -11.406 -1.880 1.00 24.44 H new ATOM 0 HA THR A 74 15.605 -10.744 -2.382 1.00 4.55 H new ATOM 0 HB THR A 74 15.471 -12.935 -1.213 1.00 60.44 H new ATOM 0 HG1 THR A 74 16.961 -12.389 -3.076 1.00 4.24 H new ATOM 0 HG21 THR A 74 14.501 -14.890 -2.374 1.00 44.25 H new ATOM 0 HG22 THR A 74 13.261 -13.683 -1.958 1.00 44.25 H new ATOM 0 HG23 THR A 74 13.851 -13.811 -3.632 1.00 44.25 H new ATOM 1095 N ILE A 75 15.194 -10.707 -4.814 1.00 44.31 N ATOM 1096 CA ILE A 75 14.955 -10.650 -6.225 1.00 35.21 C ATOM 1097 C ILE A 75 15.907 -11.624 -6.856 1.00 41.45 C ATOM 1098 O ILE A 75 17.109 -11.429 -6.807 1.00 30.21 O ATOM 1099 CB ILE A 75 15.171 -9.227 -6.804 1.00 1.41 C ATOM 1100 CG1 ILE A 75 14.189 -8.255 -6.167 1.00 64.34 C ATOM 1101 CG2 ILE A 75 15.026 -9.216 -8.327 1.00 35.43 C ATOM 1102 CD1 ILE A 75 14.331 -6.832 -6.646 1.00 72.41 C ATOM 0 H ILE A 75 16.087 -10.315 -4.516 1.00 44.31 H new ATOM 0 HA ILE A 75 13.916 -10.903 -6.437 1.00 35.21 H new ATOM 0 HB ILE A 75 16.188 -8.913 -6.569 1.00 1.41 H new ATOM 0 HG12 ILE A 75 13.174 -8.596 -6.370 1.00 64.34 H new ATOM 0 HG13 ILE A 75 14.322 -8.278 -5.085 1.00 64.34 H new ATOM 0 HG21 ILE A 75 15.183 -8.204 -8.700 1.00 35.43 H new ATOM 0 HG22 ILE A 75 15.766 -9.884 -8.768 1.00 35.43 H new ATOM 0 HG23 ILE A 75 14.025 -9.552 -8.600 1.00 35.43 H new ATOM 0 HD11 ILE A 75 13.595 -6.204 -6.144 1.00 72.41 H new ATOM 0 HD12 ILE A 75 15.333 -6.470 -6.418 1.00 72.41 H new ATOM 0 HD13 ILE A 75 14.167 -6.793 -7.723 1.00 72.41 H new ATOM 1114 N SER A 76 15.374 -12.676 -7.413 1.00 41.42 N ATOM 1115 CA SER A 76 16.188 -13.722 -7.979 1.00 64.12 C ATOM 1116 C SER A 76 16.804 -13.281 -9.303 1.00 4.42 C ATOM 1117 O SER A 76 17.982 -13.536 -9.572 1.00 14.11 O ATOM 1118 CB SER A 76 15.364 -15.004 -8.146 1.00 71.34 C ATOM 1119 OG SER A 76 16.142 -16.062 -8.688 1.00 50.41 O ATOM 0 H SER A 76 14.369 -12.835 -7.489 1.00 41.42 H new ATOM 0 HA SER A 76 17.008 -13.932 -7.293 1.00 64.12 H new ATOM 0 HB2 SER A 76 14.962 -15.307 -7.179 1.00 71.34 H new ATOM 0 HB3 SER A 76 14.513 -14.807 -8.798 1.00 71.34 H new ATOM 0 HG SER A 76 15.586 -16.864 -8.779 1.00 50.41 H new ATOM 1125 N SER A 77 16.027 -12.612 -10.115 1.00 23.35 N ATOM 1126 CA SER A 77 16.517 -12.138 -11.368 1.00 74.44 C ATOM 1127 C SER A 77 16.503 -10.627 -11.392 1.00 53.40 C ATOM 1128 O SER A 77 15.487 -10.025 -11.714 1.00 10.13 O ATOM 1129 CB SER A 77 15.706 -12.715 -12.527 1.00 73.20 C ATOM 1130 OG SER A 77 15.702 -14.145 -12.481 1.00 24.05 O ATOM 0 H SER A 77 15.051 -12.386 -9.924 1.00 23.35 H new ATOM 0 HA SER A 77 17.546 -12.476 -11.489 1.00 74.44 H new ATOM 0 HB2 SER A 77 14.683 -12.342 -12.482 1.00 73.20 H new ATOM 0 HB3 SER A 77 16.127 -12.378 -13.474 1.00 73.20 H new ATOM 0 HG SER A 77 15.176 -14.495 -13.230 1.00 24.05 H new ATOM 1136 N LEU A 78 17.600 -10.017 -10.993 1.00 33.10 N ATOM 1137 CA LEU A 78 17.666 -8.572 -10.974 1.00 3.13 C ATOM 1138 C LEU A 78 17.936 -8.042 -12.360 1.00 32.33 C ATOM 1139 O LEU A 78 18.930 -8.397 -12.981 1.00 25.41 O ATOM 1140 CB LEU A 78 18.774 -8.104 -10.038 1.00 61.35 C ATOM 1141 CG LEU A 78 18.920 -6.590 -9.889 1.00 71.44 C ATOM 1142 CD1 LEU A 78 17.644 -5.991 -9.343 1.00 15.25 C ATOM 1143 CD2 LEU A 78 20.083 -6.262 -8.987 1.00 62.23 C ATOM 0 H LEU A 78 18.447 -10.492 -10.682 1.00 33.10 H new ATOM 0 HA LEU A 78 16.707 -8.193 -10.620 1.00 3.13 H new ATOM 0 HB2 LEU A 78 18.596 -8.532 -9.052 1.00 61.35 H new ATOM 0 HB3 LEU A 78 19.721 -8.509 -10.395 1.00 61.35 H new ATOM 0 HG LEU A 78 19.112 -6.160 -10.872 1.00 71.44 H new ATOM 0 HD11 LEU A 78 17.763 -4.912 -9.242 1.00 15.25 H new ATOM 0 HD12 LEU A 78 16.821 -6.203 -10.026 1.00 15.25 H new ATOM 0 HD13 LEU A 78 17.427 -6.425 -8.367 1.00 15.25 H new ATOM 0 HD21 LEU A 78 20.175 -5.180 -8.890 1.00 62.23 H new ATOM 0 HD22 LEU A 78 19.916 -6.701 -8.004 1.00 62.23 H new ATOM 0 HD23 LEU A 78 21.000 -6.667 -9.414 1.00 62.23 H new ATOM 1155 N GLN A 79 17.076 -7.205 -12.831 1.00 61.23 N ATOM 1156 CA GLN A 79 17.227 -6.572 -14.113 1.00 72.15 C ATOM 1157 C GLN A 79 17.257 -5.063 -13.879 1.00 24.23 C ATOM 1158 O GLN A 79 16.784 -4.605 -12.848 1.00 45.32 O ATOM 1159 CB GLN A 79 16.047 -6.935 -15.032 1.00 53.33 C ATOM 1160 CG GLN A 79 15.845 -8.434 -15.296 1.00 2.05 C ATOM 1161 CD GLN A 79 17.018 -9.102 -15.997 1.00 64.42 C ATOM 1162 OE1 GLN A 79 17.084 -9.139 -17.221 1.00 1.50 O ATOM 1163 NE2 GLN A 79 17.930 -9.646 -15.244 1.00 53.41 N ATOM 0 H GLN A 79 16.229 -6.931 -12.333 1.00 61.23 H new ATOM 0 HA GLN A 79 18.145 -6.908 -14.595 1.00 72.15 H new ATOM 0 HB2 GLN A 79 15.133 -6.536 -14.593 1.00 53.33 H new ATOM 0 HB3 GLN A 79 16.188 -6.432 -15.989 1.00 53.33 H new ATOM 0 HG2 GLN A 79 15.667 -8.939 -14.347 1.00 2.05 H new ATOM 0 HG3 GLN A 79 14.949 -8.568 -15.902 1.00 2.05 H new ATOM 0 HE21 GLN A 79 17.848 -9.599 -14.228 1.00 53.41 H new ATOM 0 HE22 GLN A 79 18.727 -10.119 -15.670 1.00 53.41 H new ATOM 1172 N PRO A 80 17.837 -4.264 -14.805 1.00 55.32 N ATOM 1173 CA PRO A 80 17.890 -2.788 -14.674 1.00 73.01 C ATOM 1174 C PRO A 80 16.522 -2.156 -14.348 1.00 34.40 C ATOM 1175 O PRO A 80 16.445 -1.138 -13.669 1.00 54.41 O ATOM 1176 CB PRO A 80 18.400 -2.323 -16.031 1.00 74.22 C ATOM 1177 CG PRO A 80 19.188 -3.476 -16.551 1.00 34.10 C ATOM 1178 CD PRO A 80 18.507 -4.719 -16.042 1.00 72.50 C ATOM 0 HA PRO A 80 18.526 -2.485 -13.843 1.00 73.01 H new ATOM 0 HB2 PRO A 80 17.576 -2.072 -16.699 1.00 74.22 H new ATOM 0 HB3 PRO A 80 19.018 -1.430 -15.938 1.00 74.22 H new ATOM 0 HG2 PRO A 80 19.217 -3.467 -17.641 1.00 34.10 H new ATOM 0 HG3 PRO A 80 20.220 -3.429 -16.205 1.00 34.10 H new ATOM 0 HD2 PRO A 80 17.791 -5.109 -16.766 1.00 72.50 H new ATOM 0 HD3 PRO A 80 19.224 -5.515 -15.841 1.00 72.50 H new ATOM 1186 N GLU A 81 15.456 -2.787 -14.824 1.00 24.11 N ATOM 1187 CA GLU A 81 14.083 -2.316 -14.602 1.00 55.01 C ATOM 1188 C GLU A 81 13.697 -2.356 -13.122 1.00 2.24 C ATOM 1189 O GLU A 81 12.764 -1.681 -12.697 1.00 21.13 O ATOM 1190 CB GLU A 81 13.099 -3.201 -15.341 1.00 63.12 C ATOM 1191 CG GLU A 81 13.338 -3.341 -16.816 1.00 31.50 C ATOM 1192 CD GLU A 81 12.281 -4.182 -17.451 1.00 63.13 C ATOM 1193 OE1 GLU A 81 12.397 -5.422 -17.422 1.00 12.45 O ATOM 1194 OE2 GLU A 81 11.306 -3.623 -17.973 1.00 3.21 O ATOM 0 H GLU A 81 15.513 -3.642 -15.377 1.00 24.11 H new ATOM 0 HA GLU A 81 14.046 -1.289 -14.965 1.00 55.01 H new ATOM 0 HB2 GLU A 81 13.121 -4.194 -14.891 1.00 63.12 H new ATOM 0 HB3 GLU A 81 12.095 -2.804 -15.189 1.00 63.12 H new ATOM 0 HG2 GLU A 81 13.352 -2.355 -17.281 1.00 31.50 H new ATOM 0 HG3 GLU A 81 14.317 -3.789 -16.989 1.00 31.50 H new ATOM 1201 N ASP A 82 14.408 -3.143 -12.358 1.00 71.41 N ATOM 1202 CA ASP A 82 14.083 -3.379 -10.957 1.00 72.22 C ATOM 1203 C ASP A 82 14.835 -2.429 -10.060 1.00 24.52 C ATOM 1204 O ASP A 82 14.882 -2.608 -8.847 1.00 11.14 O ATOM 1205 CB ASP A 82 14.453 -4.811 -10.581 1.00 23.44 C ATOM 1206 CG ASP A 82 13.768 -5.846 -11.430 1.00 61.32 C ATOM 1207 OD1 ASP A 82 12.535 -5.872 -11.472 1.00 4.31 O ATOM 1208 OD2 ASP A 82 14.473 -6.613 -12.127 1.00 2.53 O ATOM 0 H ASP A 82 15.235 -3.645 -12.682 1.00 71.41 H new ATOM 0 HA ASP A 82 13.013 -3.217 -10.824 1.00 72.22 H new ATOM 0 HB2 ASP A 82 15.532 -4.935 -10.670 1.00 23.44 H new ATOM 0 HB3 ASP A 82 14.197 -4.982 -9.535 1.00 23.44 H new ATOM 1213 N ILE A 83 15.415 -1.425 -10.638 1.00 0.20 N ATOM 1214 CA ILE A 83 16.190 -0.490 -9.880 1.00 73.43 C ATOM 1215 C ILE A 83 15.360 0.661 -9.387 1.00 32.43 C ATOM 1216 O ILE A 83 15.049 1.609 -10.121 1.00 14.40 O ATOM 1217 CB ILE A 83 17.451 -0.061 -10.645 1.00 0.21 C ATOM 1218 CG1 ILE A 83 18.270 -1.321 -10.934 1.00 4.40 C ATOM 1219 CG2 ILE A 83 18.269 0.983 -9.891 1.00 61.42 C ATOM 1220 CD1 ILE A 83 18.541 -2.179 -9.697 1.00 40.23 C ATOM 0 H ILE A 83 15.367 -1.230 -11.638 1.00 0.20 H new ATOM 0 HA ILE A 83 16.541 -0.995 -8.980 1.00 73.43 H new ATOM 0 HB ILE A 83 17.161 0.424 -11.577 1.00 0.21 H new ATOM 0 HG12 ILE A 83 17.743 -1.923 -11.674 1.00 4.40 H new ATOM 0 HG13 ILE A 83 19.222 -1.030 -11.379 1.00 4.40 H new ATOM 0 HG21 ILE A 83 19.148 1.249 -10.478 1.00 61.42 H new ATOM 0 HG22 ILE A 83 17.660 1.872 -9.725 1.00 61.42 H new ATOM 0 HG23 ILE A 83 18.584 0.575 -8.931 1.00 61.42 H new ATOM 0 HD11 ILE A 83 19.126 -3.053 -9.982 1.00 40.23 H new ATOM 0 HD12 ILE A 83 19.096 -1.594 -8.963 1.00 40.23 H new ATOM 0 HD13 ILE A 83 17.594 -2.501 -9.263 1.00 40.23 H new ATOM 1232 N ALA A 84 14.977 0.543 -8.138 1.00 22.23 N ATOM 1233 CA ALA A 84 14.141 1.491 -7.468 1.00 71.22 C ATOM 1234 C ALA A 84 14.285 1.274 -5.977 1.00 53.43 C ATOM 1235 O ALA A 84 15.163 0.522 -5.541 1.00 4.25 O ATOM 1236 CB ALA A 84 12.697 1.287 -7.898 1.00 75.43 C ATOM 0 H ALA A 84 15.251 -0.243 -7.548 1.00 22.23 H new ATOM 0 HA ALA A 84 14.434 2.510 -7.721 1.00 71.22 H new ATOM 0 HB1 ALA A 84 12.060 2.009 -7.388 1.00 75.43 H new ATOM 0 HB2 ALA A 84 12.615 1.428 -8.976 1.00 75.43 H new ATOM 0 HB3 ALA A 84 12.380 0.277 -7.639 1.00 75.43 H new ATOM 1242 N THR A 85 13.464 1.913 -5.198 1.00 64.02 N ATOM 1243 CA THR A 85 13.525 1.747 -3.776 1.00 4.41 C ATOM 1244 C THR A 85 12.461 0.738 -3.315 1.00 31.23 C ATOM 1245 O THR A 85 11.281 0.887 -3.619 1.00 30.23 O ATOM 1246 CB THR A 85 13.325 3.100 -3.082 1.00 21.02 C ATOM 1247 OG1 THR A 85 14.248 4.035 -3.648 1.00 14.44 O ATOM 1248 CG2 THR A 85 13.577 2.990 -1.582 1.00 32.43 C ATOM 0 H THR A 85 12.742 2.556 -5.524 1.00 64.02 H new ATOM 0 HA THR A 85 14.507 1.359 -3.504 1.00 4.41 H new ATOM 0 HB THR A 85 12.296 3.429 -3.230 1.00 21.02 H new ATOM 0 HG1 THR A 85 14.134 4.908 -3.218 1.00 14.44 H new ATOM 0 HG21 THR A 85 13.428 3.964 -1.116 1.00 32.43 H new ATOM 0 HG22 THR A 85 12.883 2.270 -1.148 1.00 32.43 H new ATOM 0 HG23 THR A 85 14.600 2.657 -1.408 1.00 32.43 H new ATOM 1256 N TYR A 86 12.888 -0.259 -2.587 1.00 11.24 N ATOM 1257 CA TYR A 86 12.026 -1.306 -2.085 1.00 11.35 C ATOM 1258 C TYR A 86 11.726 -1.099 -0.632 1.00 70.22 C ATOM 1259 O TYR A 86 12.607 -0.832 0.164 1.00 22.32 O ATOM 1260 CB TYR A 86 12.618 -2.680 -2.382 1.00 43.14 C ATOM 1261 CG TYR A 86 12.612 -2.949 -3.862 1.00 73.21 C ATOM 1262 CD1 TYR A 86 13.684 -2.588 -4.686 1.00 63.51 C ATOM 1263 CD2 TYR A 86 11.501 -3.527 -4.452 1.00 71.22 C ATOM 1264 CE1 TYR A 86 13.626 -2.808 -6.029 1.00 45.34 C ATOM 1265 CE2 TYR A 86 11.448 -3.738 -5.803 1.00 0.31 C ATOM 1266 CZ TYR A 86 12.509 -3.377 -6.584 1.00 2.11 C ATOM 1267 OH TYR A 86 12.448 -3.572 -7.925 1.00 64.31 O ATOM 0 H TYR A 86 13.865 -0.372 -2.318 1.00 11.24 H new ATOM 0 HA TYR A 86 11.070 -1.259 -2.607 1.00 11.35 H new ATOM 0 HB2 TYR A 86 13.638 -2.733 -2.001 1.00 43.14 H new ATOM 0 HB3 TYR A 86 12.044 -3.449 -1.865 1.00 43.14 H new ATOM 0 HD1 TYR A 86 14.563 -2.132 -4.254 1.00 63.51 H new ATOM 0 HD2 TYR A 86 10.662 -3.816 -3.836 1.00 71.22 H new ATOM 0 HE1 TYR A 86 14.461 -2.534 -6.657 1.00 45.34 H new ATOM 0 HE2 TYR A 86 10.573 -4.187 -6.249 1.00 0.31 H new ATOM 0 HH TYR A 86 13.284 -3.270 -8.338 1.00 64.31 H new ATOM 1277 N HIS A 87 10.464 -1.191 -0.304 1.00 3.33 N ATOM 1278 CA HIS A 87 9.979 -0.860 1.027 1.00 11.31 C ATOM 1279 C HIS A 87 9.202 -2.005 1.586 1.00 24.54 C ATOM 1280 O HIS A 87 8.563 -2.738 0.844 1.00 60.51 O ATOM 1281 CB HIS A 87 8.991 0.307 0.962 1.00 44.41 C ATOM 1282 CG HIS A 87 9.450 1.553 0.293 1.00 71.31 C ATOM 1283 ND1 HIS A 87 9.413 2.773 0.902 1.00 74.32 N ATOM 1284 CD2 HIS A 87 9.837 1.790 -0.983 1.00 10.11 C ATOM 1285 CE1 HIS A 87 9.744 3.692 0.030 1.00 60.14 C ATOM 1286 NE2 HIS A 87 10.010 3.130 -1.106 1.00 33.51 N ATOM 0 H HIS A 87 9.735 -1.498 -0.948 1.00 3.33 H new ATOM 0 HA HIS A 87 10.850 -0.617 1.636 1.00 11.31 H new ATOM 0 HB2 HIS A 87 8.093 -0.039 0.450 1.00 44.41 H new ATOM 0 HB3 HIS A 87 8.700 0.559 1.982 1.00 44.41 H new ATOM 0 HD1 HIS A 87 9.168 2.942 1.878 1.00 74.32 H new ATOM 0 HD2 HIS A 87 9.981 1.051 -1.757 1.00 10.11 H new ATOM 0 HE1 HIS A 87 9.788 4.753 0.227 1.00 60.14 H new ATOM 1295 N CYS A 88 9.234 -2.135 2.867 1.00 73.52 N ATOM 1296 CA CYS A 88 8.424 -3.095 3.554 1.00 52.24 C ATOM 1297 C CYS A 88 7.394 -2.323 4.375 1.00 73.53 C ATOM 1298 O CYS A 88 7.726 -1.288 4.957 1.00 73.34 O ATOM 1299 CB CYS A 88 9.314 -3.972 4.464 1.00 24.42 C ATOM 1300 SG CYS A 88 10.309 -3.036 5.673 1.00 54.24 S ATOM 0 H CYS A 88 9.828 -1.575 3.478 1.00 73.52 H new ATOM 0 HA CYS A 88 7.917 -3.756 2.852 1.00 52.24 H new ATOM 0 HB2 CYS A 88 8.680 -4.677 5.002 1.00 24.42 H new ATOM 0 HB3 CYS A 88 9.985 -4.560 3.838 1.00 24.42 H new ATOM 1305 N GLN A 89 6.154 -2.760 4.366 1.00 50.21 N ATOM 1306 CA GLN A 89 5.141 -2.135 5.201 1.00 4.10 C ATOM 1307 C GLN A 89 4.314 -3.239 5.830 1.00 72.51 C ATOM 1308 O GLN A 89 4.043 -4.264 5.177 1.00 45.14 O ATOM 1309 CB GLN A 89 4.199 -1.175 4.433 1.00 61.43 C ATOM 1310 CG GLN A 89 3.143 -1.857 3.594 1.00 52.43 C ATOM 1311 CD GLN A 89 1.916 -1.002 3.375 1.00 44.52 C ATOM 1312 OE1 GLN A 89 1.814 -0.255 2.432 1.00 14.22 O ATOM 1313 NE2 GLN A 89 0.973 -1.115 4.267 1.00 70.03 N ATOM 0 H GLN A 89 5.821 -3.538 3.797 1.00 50.21 H new ATOM 0 HA GLN A 89 5.658 -1.526 5.942 1.00 4.10 H new ATOM 0 HB2 GLN A 89 3.705 -0.521 5.152 1.00 61.43 H new ATOM 0 HB3 GLN A 89 4.802 -0.538 3.785 1.00 61.43 H new ATOM 0 HG2 GLN A 89 3.571 -2.122 2.627 1.00 52.43 H new ATOM 0 HG3 GLN A 89 2.848 -2.788 4.078 1.00 52.43 H new ATOM 0 HE21 GLN A 89 1.088 -1.755 5.053 1.00 70.03 H new ATOM 0 HE22 GLN A 89 0.119 -0.564 4.179 1.00 70.03 H new ATOM 1322 N GLN A 90 3.934 -3.088 7.060 1.00 4.31 N ATOM 1323 CA GLN A 90 3.157 -4.125 7.681 1.00 34.33 C ATOM 1324 C GLN A 90 1.687 -3.810 7.538 1.00 72.35 C ATOM 1325 O GLN A 90 1.313 -2.648 7.376 1.00 62.04 O ATOM 1326 CB GLN A 90 3.522 -4.309 9.160 1.00 4.42 C ATOM 1327 CG GLN A 90 2.873 -3.357 10.188 1.00 2.41 C ATOM 1328 CD GLN A 90 3.089 -1.862 9.983 1.00 54.11 C ATOM 1329 OE1 GLN A 90 4.077 -1.423 9.425 1.00 11.22 O ATOM 1330 NE2 GLN A 90 2.155 -1.075 10.485 1.00 52.13 N ATOM 0 H GLN A 90 4.140 -2.279 7.646 1.00 4.31 H new ATOM 0 HA GLN A 90 3.383 -5.064 7.175 1.00 34.33 H new ATOM 0 HB2 GLN A 90 3.267 -5.330 9.443 1.00 4.42 H new ATOM 0 HB3 GLN A 90 4.604 -4.213 9.252 1.00 4.42 H new ATOM 0 HG2 GLN A 90 1.800 -3.546 10.193 1.00 2.41 H new ATOM 0 HG3 GLN A 90 3.248 -3.621 11.177 1.00 2.41 H new ATOM 0 HE21 GLN A 90 1.340 -1.480 10.946 1.00 52.13 H new ATOM 0 HE22 GLN A 90 2.248 -0.062 10.412 1.00 52.13 H new ATOM 1339 N TYR A 91 0.855 -4.817 7.562 1.00 24.35 N ATOM 1340 CA TYR A 91 -0.566 -4.566 7.520 1.00 4.45 C ATOM 1341 C TYR A 91 -1.288 -5.392 8.566 1.00 65.04 C ATOM 1342 O TYR A 91 -2.501 -5.573 8.511 1.00 24.01 O ATOM 1343 CB TYR A 91 -1.157 -4.774 6.118 1.00 61.42 C ATOM 1344 CG TYR A 91 -1.162 -6.187 5.600 1.00 70.44 C ATOM 1345 CD1 TYR A 91 -0.067 -6.719 4.973 1.00 63.32 C ATOM 1346 CD2 TYR A 91 -2.295 -6.967 5.713 1.00 3.34 C ATOM 1347 CE1 TYR A 91 -0.093 -7.997 4.472 1.00 63.31 C ATOM 1348 CE2 TYR A 91 -2.338 -8.242 5.227 1.00 65.41 C ATOM 1349 CZ TYR A 91 -1.245 -8.760 4.603 1.00 23.33 C ATOM 1350 OH TYR A 91 -1.307 -10.038 4.103 1.00 31.40 O ATOM 0 H TYR A 91 1.125 -5.799 7.609 1.00 24.35 H new ATOM 0 HA TYR A 91 -0.718 -3.513 7.759 1.00 4.45 H new ATOM 0 HB2 TYR A 91 -2.183 -4.407 6.121 1.00 61.42 H new ATOM 0 HB3 TYR A 91 -0.599 -4.154 5.416 1.00 61.42 H new ATOM 0 HD1 TYR A 91 0.829 -6.125 4.871 1.00 63.32 H new ATOM 0 HD2 TYR A 91 -3.169 -6.559 6.198 1.00 3.34 H new ATOM 0 HE1 TYR A 91 0.777 -8.406 3.979 1.00 63.31 H new ATOM 0 HE2 TYR A 91 -3.233 -8.836 5.337 1.00 65.41 H new ATOM 0 HH TYR A 91 -0.608 -10.586 4.518 1.00 31.40 H new ATOM 1360 N ASP A 92 -0.542 -5.855 9.545 1.00 14.01 N ATOM 1361 CA ASP A 92 -1.135 -6.631 10.620 1.00 33.32 C ATOM 1362 C ASP A 92 -1.878 -5.734 11.606 1.00 52.41 C ATOM 1363 O ASP A 92 -2.943 -6.100 12.112 1.00 34.41 O ATOM 1364 CB ASP A 92 -0.093 -7.508 11.351 1.00 73.53 C ATOM 1365 CG ASP A 92 -0.703 -8.264 12.517 1.00 53.34 C ATOM 1366 OD1 ASP A 92 -1.319 -9.322 12.297 1.00 34.31 O ATOM 1367 OD2 ASP A 92 -0.603 -7.792 13.665 1.00 32.34 O ATOM 0 H ASP A 92 0.465 -5.712 9.622 1.00 14.01 H new ATOM 0 HA ASP A 92 -1.858 -7.305 10.160 1.00 33.32 H new ATOM 0 HB2 ASP A 92 0.342 -8.217 10.647 1.00 73.53 H new ATOM 0 HB3 ASP A 92 0.720 -6.879 11.713 1.00 73.53 H new ATOM 1372 N ASN A 93 -1.348 -4.552 11.857 1.00 1.12 N ATOM 1373 CA ASN A 93 -1.967 -3.660 12.828 1.00 43.02 C ATOM 1374 C ASN A 93 -1.776 -2.204 12.380 1.00 11.33 C ATOM 1375 O ASN A 93 -0.711 -1.847 11.844 1.00 12.41 O ATOM 1376 CB ASN A 93 -1.328 -3.922 14.223 1.00 42.12 C ATOM 1377 CG ASN A 93 -2.010 -3.224 15.404 1.00 53.05 C ATOM 1378 OD1 ASN A 93 -2.558 -2.153 15.285 1.00 62.33 O ATOM 1379 ND2 ASN A 93 -1.995 -3.864 16.550 1.00 51.42 N ATOM 0 H ASN A 93 -0.505 -4.188 11.413 1.00 1.12 H new ATOM 0 HA ASN A 93 -3.039 -3.847 12.897 1.00 43.02 H new ATOM 0 HB2 ASN A 93 -1.330 -4.996 14.408 1.00 42.12 H new ATOM 0 HB3 ASN A 93 -0.285 -3.607 14.190 1.00 42.12 H new ATOM 0 HD21 ASN A 93 -2.453 -3.459 17.366 1.00 51.42 H new ATOM 0 HD22 ASN A 93 -1.526 -4.767 16.624 1.00 51.42 H new ATOM 1386 N LEU A 94 -2.812 -1.394 12.577 1.00 15.12 N ATOM 1387 CA LEU A 94 -2.824 0.023 12.212 1.00 24.51 C ATOM 1388 C LEU A 94 -2.249 0.906 13.314 1.00 3.44 C ATOM 1389 O LEU A 94 -2.320 0.563 14.489 1.00 43.22 O ATOM 1390 CB LEU A 94 -4.256 0.479 11.854 1.00 13.14 C ATOM 1391 CG LEU A 94 -4.744 0.131 10.447 1.00 10.22 C ATOM 1392 CD1 LEU A 94 -6.225 0.348 10.329 1.00 43.01 C ATOM 1393 CD2 LEU A 94 -4.052 1.024 9.434 1.00 75.40 C ATOM 0 H LEU A 94 -3.684 -1.708 13.003 1.00 15.12 H new ATOM 0 HA LEU A 94 -2.184 0.134 11.337 1.00 24.51 H new ATOM 0 HB2 LEU A 94 -4.946 0.039 12.574 1.00 13.14 H new ATOM 0 HB3 LEU A 94 -4.312 1.560 11.978 1.00 13.14 H new ATOM 0 HG LEU A 94 -4.513 -0.917 10.257 1.00 10.22 H new ATOM 0 HD11 LEU A 94 -6.551 0.094 9.320 1.00 43.01 H new ATOM 0 HD12 LEU A 94 -6.744 -0.286 11.048 1.00 43.01 H new ATOM 0 HD13 LEU A 94 -6.457 1.393 10.533 1.00 43.01 H new ATOM 0 HD21 LEU A 94 -4.400 0.775 8.432 1.00 75.40 H new ATOM 0 HD22 LEU A 94 -4.284 2.067 9.650 1.00 75.40 H new ATOM 0 HD23 LEU A 94 -2.974 0.872 9.491 1.00 75.40 H new ATOM 1405 N PRO A 95 -1.668 2.063 12.952 1.00 74.31 N ATOM 1406 CA PRO A 95 -1.535 2.495 11.554 1.00 44.15 C ATOM 1407 C PRO A 95 -0.429 1.740 10.812 1.00 73.22 C ATOM 1408 O PRO A 95 0.585 1.338 11.410 1.00 70.24 O ATOM 1409 CB PRO A 95 -1.178 3.973 11.675 1.00 1.03 C ATOM 1410 CG PRO A 95 -0.481 4.083 12.984 1.00 62.52 C ATOM 1411 CD PRO A 95 -1.116 3.060 13.888 1.00 64.13 C ATOM 0 HA PRO A 95 -2.443 2.304 10.981 1.00 44.15 H new ATOM 0 HB2 PRO A 95 -0.535 4.294 10.855 1.00 1.03 H new ATOM 0 HB3 PRO A 95 -2.069 4.600 11.646 1.00 1.03 H new ATOM 0 HG2 PRO A 95 0.587 3.894 12.873 1.00 62.52 H new ATOM 0 HG3 PRO A 95 -0.586 5.086 13.397 1.00 62.52 H new ATOM 0 HD2 PRO A 95 -0.386 2.614 14.564 1.00 64.13 H new ATOM 0 HD3 PRO A 95 -1.896 3.502 14.508 1.00 64.13 H new ATOM 1419 N TYR A 96 -0.625 1.537 9.522 1.00 50.54 N ATOM 1420 CA TYR A 96 0.355 0.854 8.728 1.00 44.03 C ATOM 1421 C TYR A 96 1.410 1.851 8.345 1.00 75.21 C ATOM 1422 O TYR A 96 1.092 2.989 7.981 1.00 74.32 O ATOM 1423 CB TYR A 96 -0.249 0.228 7.464 1.00 61.41 C ATOM 1424 CG TYR A 96 -1.435 -0.692 7.690 1.00 33.52 C ATOM 1425 CD1 TYR A 96 -1.515 -1.521 8.797 1.00 40.33 C ATOM 1426 CD2 TYR A 96 -2.487 -0.711 6.786 1.00 41.52 C ATOM 1427 CE1 TYR A 96 -2.614 -2.344 8.988 1.00 12.53 C ATOM 1428 CE2 TYR A 96 -3.577 -1.523 6.969 1.00 50.05 C ATOM 1429 CZ TYR A 96 -3.641 -2.335 8.065 1.00 72.33 C ATOM 1430 OH TYR A 96 -4.731 -3.142 8.237 1.00 22.01 O ATOM 0 H TYR A 96 -1.455 1.838 9.011 1.00 50.54 H new ATOM 0 HA TYR A 96 0.773 0.036 9.315 1.00 44.03 H new ATOM 0 HB2 TYR A 96 -0.557 1.031 6.794 1.00 61.41 H new ATOM 0 HB3 TYR A 96 0.531 -0.334 6.950 1.00 61.41 H new ATOM 0 HD1 TYR A 96 -0.712 -1.526 9.519 1.00 40.33 H new ATOM 0 HD2 TYR A 96 -2.447 -0.071 5.917 1.00 41.52 H new ATOM 0 HE1 TYR A 96 -2.667 -2.988 9.853 1.00 12.53 H new ATOM 0 HE2 TYR A 96 -4.382 -1.520 6.249 1.00 50.05 H new ATOM 0 HH TYR A 96 -4.886 -3.283 9.194 1.00 22.01 H new ATOM 1440 N THR A 97 2.633 1.461 8.452 1.00 34.21 N ATOM 1441 CA THR A 97 3.720 2.329 8.156 1.00 15.25 C ATOM 1442 C THR A 97 4.748 1.619 7.299 1.00 24.24 C ATOM 1443 O THR A 97 4.691 0.402 7.135 1.00 21.45 O ATOM 1444 CB THR A 97 4.355 2.901 9.458 1.00 54.43 C ATOM 1445 OG1 THR A 97 4.558 1.852 10.419 1.00 43.42 O ATOM 1446 CG2 THR A 97 3.475 3.982 10.077 1.00 40.22 C ATOM 0 H THR A 97 2.909 0.525 8.749 1.00 34.21 H new ATOM 0 HA THR A 97 3.337 3.176 7.587 1.00 15.25 H new ATOM 0 HB THR A 97 5.314 3.343 9.187 1.00 54.43 H new ATOM 0 HG1 THR A 97 5.459 1.481 10.313 1.00 43.42 H new ATOM 0 HG21 THR A 97 3.947 4.360 10.984 1.00 40.22 H new ATOM 0 HG22 THR A 97 3.348 4.799 9.366 1.00 40.22 H new ATOM 0 HG23 THR A 97 2.500 3.561 10.324 1.00 40.22 H new ATOM 1454 N PHE A 98 5.666 2.368 6.771 1.00 22.34 N ATOM 1455 CA PHE A 98 6.692 1.844 5.904 1.00 74.15 C ATOM 1456 C PHE A 98 8.015 1.844 6.568 1.00 41.52 C ATOM 1457 O PHE A 98 8.272 2.637 7.478 1.00 22.12 O ATOM 1458 CB PHE A 98 6.826 2.698 4.647 1.00 71.54 C ATOM 1459 CG PHE A 98 5.861 2.425 3.546 1.00 32.31 C ATOM 1460 CD1 PHE A 98 4.515 2.269 3.779 1.00 54.43 C ATOM 1461 CD2 PHE A 98 6.327 2.322 2.257 1.00 44.13 C ATOM 1462 CE1 PHE A 98 3.656 2.016 2.741 1.00 75.14 C ATOM 1463 CE2 PHE A 98 5.484 2.072 1.214 1.00 60.12 C ATOM 1464 CZ PHE A 98 4.140 1.915 1.451 1.00 54.45 C ATOM 0 H PHE A 98 5.730 3.374 6.928 1.00 22.34 H new ATOM 0 HA PHE A 98 6.394 0.826 5.655 1.00 74.15 H new ATOM 0 HB2 PHE A 98 6.727 3.745 4.935 1.00 71.54 H new ATOM 0 HB3 PHE A 98 7.835 2.570 4.255 1.00 71.54 H new ATOM 0 HD1 PHE A 98 4.132 2.346 4.786 1.00 54.43 H new ATOM 0 HD2 PHE A 98 7.383 2.442 2.066 1.00 44.13 H new ATOM 0 HE1 PHE A 98 2.600 1.896 2.932 1.00 75.14 H new ATOM 0 HE2 PHE A 98 5.871 1.998 0.208 1.00 60.12 H new ATOM 0 HZ PHE A 98 3.465 1.714 0.633 1.00 54.45 H new ATOM 1474 N GLY A 99 8.846 0.949 6.117 1.00 62.21 N ATOM 1475 CA GLY A 99 10.191 0.916 6.540 1.00 53.42 C ATOM 1476 C GLY A 99 10.984 2.027 5.910 1.00 52.43 C ATOM 1477 O GLY A 99 10.481 2.736 5.015 1.00 42.13 O ATOM 0 H GLY A 99 8.596 0.225 5.444 1.00 62.21 H new ATOM 0 HA2 GLY A 99 10.236 1.003 7.626 1.00 53.42 H new ATOM 0 HA3 GLY A 99 10.634 -0.045 6.279 1.00 53.42 H new ATOM 1481 N GLN A 100 12.213 2.168 6.352 1.00 41.35 N ATOM 1482 CA GLN A 100 13.123 3.214 5.893 1.00 3.22 C ATOM 1483 C GLN A 100 13.318 3.185 4.351 1.00 75.14 C ATOM 1484 O GLN A 100 13.492 4.227 3.722 1.00 74.23 O ATOM 1485 CB GLN A 100 14.453 3.118 6.714 1.00 54.40 C ATOM 1486 CG GLN A 100 15.564 4.136 6.402 1.00 23.23 C ATOM 1487 CD GLN A 100 16.351 3.834 5.139 1.00 35.41 C ATOM 1488 OE1 GLN A 100 16.556 2.569 4.858 1.00 34.21 O flip ATOM 1489 NE2 GLN A 100 16.828 4.739 4.455 1.00 22.42 N flip ATOM 0 H GLN A 100 12.624 1.552 7.054 1.00 41.35 H new ATOM 0 HA GLN A 100 12.689 4.196 6.082 1.00 3.22 H new ATOM 0 HB2 GLN A 100 14.202 3.210 7.771 1.00 54.40 H new ATOM 0 HB3 GLN A 100 14.864 2.119 6.570 1.00 54.40 H new ATOM 0 HG2 GLN A 100 15.118 5.126 6.310 1.00 23.23 H new ATOM 0 HG3 GLN A 100 16.253 4.174 7.245 1.00 23.23 H new ATOM 0 HE21 GLN A 100 16.649 5.713 4.701 1.00 22.42 H new ATOM 0 HE22 GLN A 100 17.402 4.515 3.642 1.00 22.42 H new ATOM 1498 N GLY A 101 13.240 2.007 3.762 1.00 33.33 N ATOM 1499 CA GLY A 101 13.361 1.893 2.321 1.00 64.33 C ATOM 1500 C GLY A 101 14.759 1.519 1.879 1.00 62.20 C ATOM 1501 O GLY A 101 15.726 2.177 2.235 1.00 13.22 O ATOM 0 H GLY A 101 13.095 1.124 4.252 1.00 33.33 H new ATOM 0 HA2 GLY A 101 12.658 1.143 1.960 1.00 64.33 H new ATOM 0 HA3 GLY A 101 13.080 2.841 1.861 1.00 64.33 H new ATOM 1505 N THR A 102 14.868 0.465 1.125 1.00 75.25 N ATOM 1506 CA THR A 102 16.138 0.054 0.601 1.00 1.41 C ATOM 1507 C THR A 102 16.213 0.453 -0.849 1.00 43.04 C ATOM 1508 O THR A 102 15.352 0.079 -1.647 1.00 51.13 O ATOM 1509 CB THR A 102 16.296 -1.473 0.677 1.00 33.52 C ATOM 1510 OG1 THR A 102 16.148 -1.918 2.034 1.00 31.54 O ATOM 1511 CG2 THR A 102 17.655 -1.918 0.125 1.00 71.32 C ATOM 0 H THR A 102 14.085 -0.131 0.857 1.00 75.25 H new ATOM 0 HA THR A 102 16.924 0.528 1.189 1.00 1.41 H new ATOM 0 HB THR A 102 15.516 -1.924 0.063 1.00 33.52 H new ATOM 0 HG1 THR A 102 16.981 -1.756 2.524 1.00 31.54 H new ATOM 0 HG21 THR A 102 17.737 -3.003 0.192 1.00 71.32 H new ATOM 0 HG22 THR A 102 17.743 -1.611 -0.917 1.00 71.32 H new ATOM 0 HG23 THR A 102 18.453 -1.457 0.707 1.00 71.32 H new ATOM 1519 N LYS A 103 17.205 1.198 -1.195 1.00 50.34 N ATOM 1520 CA LYS A 103 17.384 1.555 -2.557 1.00 52.24 C ATOM 1521 C LYS A 103 18.194 0.477 -3.218 1.00 73.31 C ATOM 1522 O LYS A 103 19.284 0.133 -2.753 1.00 74.23 O ATOM 1523 CB LYS A 103 18.095 2.870 -2.689 1.00 22.20 C ATOM 1524 CG LYS A 103 18.150 3.380 -4.114 1.00 42.35 C ATOM 1525 CD LYS A 103 19.007 4.604 -4.214 1.00 54.42 C ATOM 1526 CE LYS A 103 20.468 4.270 -3.981 1.00 4.23 C ATOM 1527 NZ LYS A 103 21.307 5.477 -4.002 1.00 74.13 N ATOM 0 H LYS A 103 17.904 1.571 -0.553 1.00 50.34 H new ATOM 0 HA LYS A 103 16.408 1.657 -3.032 1.00 52.24 H new ATOM 0 HB2 LYS A 103 17.595 3.610 -2.064 1.00 22.20 H new ATOM 0 HB3 LYS A 103 19.111 2.766 -2.308 1.00 22.20 H new ATOM 0 HG2 LYS A 103 18.544 2.602 -4.767 1.00 42.35 H new ATOM 0 HG3 LYS A 103 17.142 3.608 -4.461 1.00 42.35 H new ATOM 0 HD2 LYS A 103 18.887 5.056 -5.199 1.00 54.42 H new ATOM 0 HD3 LYS A 103 18.679 5.342 -3.482 1.00 54.42 H new ATOM 0 HE2 LYS A 103 20.578 3.766 -3.021 1.00 4.23 H new ATOM 0 HE3 LYS A 103 20.810 3.575 -4.748 1.00 4.23 H new ATOM 0 HZ1 LYS A 103 22.300 5.213 -3.840 1.00 74.13 H new ATOM 0 HZ2 LYS A 103 21.220 5.944 -4.927 1.00 74.13 H new ATOM 0 HZ3 LYS A 103 20.996 6.129 -3.254 1.00 74.13 H new ATOM 1541 N LEU A 104 17.680 -0.059 -4.255 1.00 51.44 N ATOM 1542 CA LEU A 104 18.337 -1.108 -4.943 1.00 61.21 C ATOM 1543 C LEU A 104 19.027 -0.562 -6.180 1.00 70.30 C ATOM 1544 O LEU A 104 18.430 0.193 -6.930 1.00 3.20 O ATOM 1545 CB LEU A 104 17.314 -2.179 -5.294 1.00 0.33 C ATOM 1546 CG LEU A 104 17.828 -3.381 -6.046 1.00 11.11 C ATOM 1547 CD1 LEU A 104 18.987 -4.044 -5.319 1.00 53.33 C ATOM 1548 CD2 LEU A 104 16.718 -4.366 -6.262 1.00 43.22 C ATOM 0 H LEU A 104 16.784 0.217 -4.657 1.00 51.44 H new ATOM 0 HA LEU A 104 19.105 -1.555 -4.312 1.00 61.21 H new ATOM 0 HB2 LEU A 104 16.853 -2.527 -4.369 1.00 0.33 H new ATOM 0 HB3 LEU A 104 16.526 -1.716 -5.888 1.00 0.33 H new ATOM 0 HG LEU A 104 18.198 -3.038 -7.012 1.00 11.11 H new ATOM 0 HD11 LEU A 104 19.330 -4.906 -5.891 1.00 53.33 H new ATOM 0 HD12 LEU A 104 19.804 -3.331 -5.211 1.00 53.33 H new ATOM 0 HD13 LEU A 104 18.658 -4.371 -4.332 1.00 53.33 H new ATOM 0 HD21 LEU A 104 17.099 -5.230 -6.806 1.00 43.22 H new ATOM 0 HD22 LEU A 104 16.325 -4.688 -5.298 1.00 43.22 H new ATOM 0 HD23 LEU A 104 15.922 -3.896 -6.840 1.00 43.22 H new ATOM 1560 N GLU A 105 20.291 -0.916 -6.358 1.00 54.01 N ATOM 1561 CA GLU A 105 21.070 -0.486 -7.502 1.00 33.21 C ATOM 1562 C GLU A 105 21.774 -1.679 -8.132 1.00 13.11 C ATOM 1563 O GLU A 105 21.790 -2.770 -7.554 1.00 2.30 O ATOM 1564 CB GLU A 105 22.118 0.533 -7.095 1.00 51.35 C ATOM 1565 CG GLU A 105 21.548 1.748 -6.438 1.00 71.45 C ATOM 1566 CD GLU A 105 22.578 2.800 -6.210 1.00 45.55 C ATOM 1567 OE1 GLU A 105 23.329 2.706 -5.226 1.00 71.52 O ATOM 1568 OE2 GLU A 105 22.658 3.739 -7.016 1.00 13.23 O ATOM 0 H GLU A 105 20.804 -1.512 -5.709 1.00 54.01 H new ATOM 0 HA GLU A 105 20.385 -0.031 -8.218 1.00 33.21 H new ATOM 0 HB2 GLU A 105 22.827 0.061 -6.414 1.00 51.35 H new ATOM 0 HB3 GLU A 105 22.679 0.837 -7.979 1.00 51.35 H new ATOM 0 HG2 GLU A 105 20.749 2.153 -7.058 1.00 71.45 H new ATOM 0 HG3 GLU A 105 21.101 1.467 -5.485 1.00 71.45 H new ATOM 1575 N ILE A 106 22.367 -1.477 -9.294 1.00 5.13 N ATOM 1576 CA ILE A 106 23.120 -2.527 -9.957 1.00 24.04 C ATOM 1577 C ILE A 106 24.588 -2.192 -10.024 1.00 50.31 C ATOM 1578 O ILE A 106 24.980 -1.168 -10.585 1.00 42.32 O ATOM 1579 CB ILE A 106 22.579 -2.882 -11.381 1.00 33.11 C ATOM 1580 CG1 ILE A 106 21.195 -3.487 -11.254 1.00 31.22 C ATOM 1581 CG2 ILE A 106 23.516 -3.843 -12.106 1.00 11.13 C ATOM 1582 CD1 ILE A 106 20.513 -3.828 -12.549 1.00 71.11 C ATOM 0 H ILE A 106 22.342 -0.592 -9.800 1.00 5.13 H new ATOM 0 HA ILE A 106 22.984 -3.416 -9.341 1.00 24.04 H new ATOM 0 HB ILE A 106 22.525 -1.968 -11.972 1.00 33.11 H new ATOM 0 HG12 ILE A 106 21.268 -4.394 -10.653 1.00 31.22 H new ATOM 0 HG13 ILE A 106 20.563 -2.790 -10.704 1.00 31.22 H new ATOM 0 HG21 ILE A 106 23.112 -4.070 -13.093 1.00 11.13 H new ATOM 0 HG22 ILE A 106 24.498 -3.382 -12.213 1.00 11.13 H new ATOM 0 HG23 ILE A 106 23.608 -4.764 -11.531 1.00 11.13 H new ATOM 0 HD11 ILE A 106 19.531 -4.254 -12.342 1.00 71.11 H new ATOM 0 HD12 ILE A 106 20.398 -2.925 -13.149 1.00 71.11 H new ATOM 0 HD13 ILE A 106 21.115 -4.553 -13.097 1.00 71.11 H new ATOM 1594 N LYS A 107 25.392 -3.052 -9.447 1.00 3.44 N ATOM 1595 CA LYS A 107 26.805 -2.882 -9.492 1.00 72.13 C ATOM 1596 C LYS A 107 27.353 -3.561 -10.740 1.00 50.31 C ATOM 1597 O LYS A 107 27.212 -4.789 -10.932 1.00 3.03 O ATOM 1598 CB LYS A 107 27.481 -3.387 -8.220 1.00 54.21 C ATOM 1599 CG LYS A 107 27.282 -4.823 -7.944 1.00 14.03 C ATOM 1600 CD LYS A 107 28.028 -5.236 -6.711 1.00 71.55 C ATOM 1601 CE LYS A 107 27.854 -6.693 -6.481 1.00 63.13 C ATOM 1602 NZ LYS A 107 28.567 -7.160 -5.278 1.00 42.13 N ATOM 0 H LYS A 107 25.079 -3.879 -8.940 1.00 3.44 H new ATOM 0 HA LYS A 107 27.030 -1.817 -9.546 1.00 72.13 H new ATOM 0 HB2 LYS A 107 28.551 -3.189 -8.290 1.00 54.21 H new ATOM 0 HB3 LYS A 107 27.106 -2.813 -7.373 1.00 54.21 H new ATOM 0 HG2 LYS A 107 26.219 -5.030 -7.818 1.00 14.03 H new ATOM 0 HG3 LYS A 107 27.623 -5.412 -8.795 1.00 14.03 H new ATOM 0 HD2 LYS A 107 29.087 -5.000 -6.819 1.00 71.55 H new ATOM 0 HD3 LYS A 107 27.663 -4.677 -5.850 1.00 71.55 H new ATOM 0 HE2 LYS A 107 26.792 -6.918 -6.381 1.00 63.13 H new ATOM 0 HE3 LYS A 107 28.216 -7.241 -7.351 1.00 63.13 H new ATOM 0 HZ1 LYS A 107 28.416 -8.182 -5.160 1.00 42.13 H new ATOM 0 HZ2 LYS A 107 29.584 -6.970 -5.382 1.00 42.13 H new ATOM 0 HZ3 LYS A 107 28.205 -6.657 -4.443 1.00 42.13 H new ATOM 1616 N ARG A 108 27.923 -2.765 -11.587 1.00 43.21 N ATOM 1617 CA ARG A 108 28.453 -3.203 -12.860 1.00 14.44 C ATOM 1618 C ARG A 108 29.404 -2.155 -13.406 1.00 20.03 C ATOM 1619 O ARG A 108 29.505 -1.048 -12.837 1.00 53.30 O ATOM 1620 CB ARG A 108 27.309 -3.466 -13.860 1.00 55.35 C ATOM 1621 CG ARG A 108 26.407 -2.265 -14.110 1.00 71.34 C ATOM 1622 CD ARG A 108 25.282 -2.603 -15.070 1.00 14.32 C ATOM 1623 NE ARG A 108 24.393 -1.461 -15.303 1.00 51.40 N ATOM 1624 CZ ARG A 108 23.462 -1.401 -16.265 1.00 72.31 C ATOM 1625 NH1 ARG A 108 23.288 -2.430 -17.097 1.00 74.21 N ATOM 1626 NH2 ARG A 108 22.707 -0.304 -16.394 1.00 62.14 N ATOM 0 H ARG A 108 28.041 -1.766 -11.418 1.00 43.21 H new ATOM 0 HA ARG A 108 28.998 -4.136 -12.714 1.00 14.44 H new ATOM 0 HB2 ARG A 108 27.738 -3.787 -14.809 1.00 55.35 H new ATOM 0 HB3 ARG A 108 26.701 -4.291 -13.490 1.00 55.35 H new ATOM 0 HG2 ARG A 108 25.988 -1.920 -13.164 1.00 71.34 H new ATOM 0 HG3 ARG A 108 26.998 -1.443 -14.515 1.00 71.34 H new ATOM 0 HD2 ARG A 108 25.703 -2.933 -16.019 1.00 14.32 H new ATOM 0 HD3 ARG A 108 24.704 -3.436 -14.671 1.00 14.32 H new ATOM 0 HE ARG A 108 24.490 -0.653 -14.688 1.00 51.40 H new ATOM 0 HH11 ARG A 108 23.865 -3.266 -17.002 1.00 74.21 H new ATOM 0 HH12 ARG A 108 22.578 -2.380 -17.828 1.00 74.21 H new ATOM 0 HH21 ARG A 108 22.841 0.484 -15.761 1.00 62.14 H new ATOM 0 HH22 ARG A 108 21.998 -0.256 -17.126 1.00 62.14 H new ATOM 1641 N ASP B 201 6.716 12.385 8.988 1.00 4.30 N ATOM 1642 CA ASP B 201 5.696 11.615 8.293 1.00 3.21 C ATOM 1643 C ASP B 201 4.552 12.530 7.950 1.00 3.22 C ATOM 1644 O ASP B 201 4.423 13.620 8.523 1.00 71.45 O ATOM 1645 CB ASP B 201 5.173 10.466 9.172 1.00 44.34 C ATOM 1646 CG ASP B 201 4.300 10.931 10.329 1.00 43.54 C ATOM 1647 OD1 ASP B 201 4.841 11.405 11.356 1.00 61.10 O ATOM 1648 OD2 ASP B 201 3.054 10.844 10.227 1.00 22.43 O ATOM 0 HA ASP B 201 6.134 11.186 7.392 1.00 3.21 H new ATOM 0 HB2 ASP B 201 4.601 9.776 8.551 1.00 44.34 H new ATOM 0 HB3 ASP B 201 6.021 9.909 9.569 1.00 44.34 H new ATOM 1653 N ILE B 202 3.754 12.126 7.021 1.00 63.51 N ATOM 1654 CA ILE B 202 2.598 12.887 6.643 1.00 2.25 C ATOM 1655 C ILE B 202 1.387 12.240 7.253 1.00 54.34 C ATOM 1656 O ILE B 202 1.031 11.129 6.897 1.00 24.24 O ATOM 1657 CB ILE B 202 2.474 12.950 5.110 1.00 15.05 C ATOM 1658 CG1 ILE B 202 3.738 13.597 4.515 1.00 23.11 C ATOM 1659 CG2 ILE B 202 1.220 13.726 4.698 1.00 55.04 C ATOM 1660 CD1 ILE B 202 3.824 13.531 3.011 1.00 31.11 C ATOM 0 H ILE B 202 3.879 11.259 6.498 1.00 63.51 H new ATOM 0 HA ILE B 202 2.688 13.911 7.006 1.00 2.25 H new ATOM 0 HB ILE B 202 2.380 11.936 4.721 1.00 15.05 H new ATOM 0 HG12 ILE B 202 3.776 14.642 4.823 1.00 23.11 H new ATOM 0 HG13 ILE B 202 4.615 13.108 4.939 1.00 23.11 H new ATOM 0 HG21 ILE B 202 1.153 13.758 3.611 1.00 55.04 H new ATOM 0 HG22 ILE B 202 0.337 13.231 5.102 1.00 55.04 H new ATOM 0 HG23 ILE B 202 1.277 14.742 5.088 1.00 55.04 H new ATOM 0 HD11 ILE B 202 4.745 14.010 2.678 1.00 31.11 H new ATOM 0 HD12 ILE B 202 3.821 12.489 2.692 1.00 31.11 H new ATOM 0 HD13 ILE B 202 2.968 14.047 2.575 1.00 31.11 H new ATOM 1672 N GLN B 203 0.754 12.925 8.161 1.00 43.25 N ATOM 1673 CA GLN B 203 -0.362 12.341 8.846 1.00 74.13 C ATOM 1674 C GLN B 203 -1.567 12.391 7.952 1.00 22.32 C ATOM 1675 O GLN B 203 -1.848 13.422 7.337 1.00 43.31 O ATOM 1676 CB GLN B 203 -0.678 13.099 10.126 1.00 60.04 C ATOM 1677 CG GLN B 203 -1.631 12.344 11.023 1.00 74.12 C ATOM 1678 CD GLN B 203 -2.010 13.105 12.272 1.00 53.44 C ATOM 1679 OE1 GLN B 203 -1.337 13.014 13.297 1.00 13.32 O ATOM 1680 NE2 GLN B 203 -3.099 13.828 12.215 1.00 51.53 N ATOM 0 H GLN B 203 0.988 13.877 8.442 1.00 43.25 H new ATOM 0 HA GLN B 203 -0.108 11.312 9.100 1.00 74.13 H new ATOM 0 HB2 GLN B 203 0.248 13.295 10.667 1.00 60.04 H new ATOM 0 HB3 GLN B 203 -1.111 14.067 9.874 1.00 60.04 H new ATOM 0 HG2 GLN B 203 -2.535 12.107 10.462 1.00 74.12 H new ATOM 0 HG3 GLN B 203 -1.175 11.396 11.308 1.00 74.12 H new ATOM 0 HE21 GLN B 203 -3.632 13.880 11.347 1.00 51.53 H new ATOM 0 HE22 GLN B 203 -3.415 14.340 13.039 1.00 51.53 H new ATOM 1689 N MET B 204 -2.248 11.287 7.853 1.00 25.53 N ATOM 1690 CA MET B 204 -3.441 11.210 7.067 1.00 62.24 C ATOM 1691 C MET B 204 -4.607 11.079 8.017 1.00 1.34 C ATOM 1692 O MET B 204 -4.840 10.018 8.594 1.00 14.15 O ATOM 1693 CB MET B 204 -3.390 10.016 6.103 1.00 71.15 C ATOM 1694 CG MET B 204 -2.154 9.995 5.206 1.00 54.11 C ATOM 1695 SD MET B 204 -1.955 11.490 4.206 1.00 73.35 S ATOM 1696 CE MET B 204 -3.419 11.428 3.186 1.00 60.00 C ATOM 0 H MET B 204 -1.991 10.415 8.316 1.00 25.53 H new ATOM 0 HA MET B 204 -3.546 12.107 6.457 1.00 62.24 H new ATOM 0 HB2 MET B 204 -3.422 9.093 6.682 1.00 71.15 H new ATOM 0 HB3 MET B 204 -4.281 10.030 5.476 1.00 71.15 H new ATOM 0 HG2 MET B 204 -1.268 9.863 5.827 1.00 54.11 H new ATOM 0 HG3 MET B 204 -2.211 9.131 4.544 1.00 54.11 H new ATOM 0 HE1 MET B 204 -3.147 11.615 2.147 1.00 60.00 H new ATOM 0 HE2 MET B 204 -3.879 10.443 3.269 1.00 60.00 H new ATOM 0 HE3 MET B 204 -4.126 12.188 3.518 1.00 60.00 H new ATOM 1706 N THR B 205 -5.293 12.151 8.214 1.00 32.03 N ATOM 1707 CA THR B 205 -6.371 12.213 9.161 1.00 61.04 C ATOM 1708 C THR B 205 -7.692 11.836 8.474 1.00 4.13 C ATOM 1709 O THR B 205 -8.024 12.387 7.435 1.00 31.42 O ATOM 1710 CB THR B 205 -6.458 13.643 9.725 1.00 61.32 C ATOM 1711 OG1 THR B 205 -5.159 14.040 10.222 1.00 30.13 O ATOM 1712 CG2 THR B 205 -7.467 13.716 10.858 1.00 44.41 C ATOM 0 H THR B 205 -5.125 13.027 7.718 1.00 32.03 H new ATOM 0 HA THR B 205 -6.189 11.510 9.974 1.00 61.04 H new ATOM 0 HB THR B 205 -6.779 14.312 8.927 1.00 61.32 H new ATOM 0 HG1 THR B 205 -5.265 14.764 10.874 1.00 30.13 H new ATOM 0 HG21 THR B 205 -7.511 14.736 11.241 1.00 44.41 H new ATOM 0 HG22 THR B 205 -8.450 13.424 10.489 1.00 44.41 H new ATOM 0 HG23 THR B 205 -7.165 13.041 11.659 1.00 44.41 H new ATOM 1720 N GLN B 206 -8.424 10.894 9.044 1.00 31.20 N ATOM 1721 CA GLN B 206 -9.669 10.460 8.457 1.00 71.40 C ATOM 1722 C GLN B 206 -10.891 10.862 9.231 1.00 54.31 C ATOM 1723 O GLN B 206 -11.038 10.567 10.421 1.00 33.02 O ATOM 1724 CB GLN B 206 -9.670 8.980 8.154 1.00 71.35 C ATOM 1725 CG GLN B 206 -8.848 8.640 6.941 1.00 2.54 C ATOM 1726 CD GLN B 206 -8.908 7.193 6.606 1.00 31.44 C ATOM 1727 OE1 GLN B 206 -8.089 6.415 7.043 1.00 0.41 O ATOM 1728 NE2 GLN B 206 -9.908 6.817 5.865 1.00 1.45 N ATOM 0 H GLN B 206 -8.174 10.419 9.911 1.00 31.20 H new ATOM 0 HA GLN B 206 -9.732 10.999 7.512 1.00 71.40 H new ATOM 0 HB2 GLN B 206 -9.283 8.436 9.015 1.00 71.35 H new ATOM 0 HB3 GLN B 206 -10.696 8.645 8.000 1.00 71.35 H new ATOM 0 HG2 GLN B 206 -9.202 9.223 6.090 1.00 2.54 H new ATOM 0 HG3 GLN B 206 -7.811 8.928 7.115 1.00 2.54 H new ATOM 0 HE21 GLN B 206 -10.574 7.508 5.519 1.00 1.45 H new ATOM 0 HE22 GLN B 206 -10.026 5.832 5.630 1.00 1.45 H new ATOM 1737 N SER B 207 -11.745 11.564 8.561 1.00 62.02 N ATOM 1738 CA SER B 207 -12.997 11.981 9.095 1.00 15.51 C ATOM 1739 C SER B 207 -14.039 11.887 7.981 1.00 14.54 C ATOM 1740 O SER B 207 -13.843 12.453 6.904 1.00 75.24 O ATOM 1741 CB SER B 207 -12.866 13.394 9.648 1.00 72.30 C ATOM 1742 OG SER B 207 -11.833 13.437 10.631 1.00 72.51 O ATOM 0 H SER B 207 -11.585 11.871 7.601 1.00 62.02 H new ATOM 0 HA SER B 207 -13.313 11.343 9.920 1.00 15.51 H new ATOM 0 HB2 SER B 207 -12.641 14.090 8.840 1.00 72.30 H new ATOM 0 HB3 SER B 207 -13.812 13.711 10.088 1.00 72.30 H new ATOM 0 HG SER B 207 -11.753 14.349 10.981 1.00 72.51 H new ATOM 1748 N PRO B 208 -15.144 11.167 8.188 1.00 0.31 N ATOM 1749 CA PRO B 208 -15.468 10.504 9.459 1.00 24.21 C ATOM 1750 C PRO B 208 -14.621 9.247 9.700 1.00 14.15 C ATOM 1751 O PRO B 208 -14.139 8.627 8.761 1.00 42.04 O ATOM 1752 CB PRO B 208 -16.942 10.131 9.284 1.00 41.12 C ATOM 1753 CG PRO B 208 -17.109 9.934 7.821 1.00 45.24 C ATOM 1754 CD PRO B 208 -16.169 10.904 7.158 1.00 30.41 C ATOM 0 HA PRO B 208 -15.269 11.144 10.319 1.00 24.21 H new ATOM 0 HB2 PRO B 208 -17.190 9.225 9.837 1.00 41.12 H new ATOM 0 HB3 PRO B 208 -17.597 10.919 9.655 1.00 41.12 H new ATOM 0 HG2 PRO B 208 -16.874 8.908 7.537 1.00 45.24 H new ATOM 0 HG3 PRO B 208 -18.139 10.121 7.518 1.00 45.24 H new ATOM 0 HD2 PRO B 208 -15.729 10.480 6.256 1.00 30.41 H new ATOM 0 HD3 PRO B 208 -16.682 11.819 6.863 1.00 30.41 H new ATOM 1762 N SER B 209 -14.415 8.912 10.954 1.00 50.23 N ATOM 1763 CA SER B 209 -13.681 7.714 11.336 1.00 32.44 C ATOM 1764 C SER B 209 -14.542 6.473 11.061 1.00 44.11 C ATOM 1765 O SER B 209 -14.050 5.353 11.017 1.00 54.00 O ATOM 1766 CB SER B 209 -13.314 7.792 12.828 1.00 71.43 C ATOM 1767 OG SER B 209 -12.519 6.682 13.257 1.00 30.34 O ATOM 0 H SER B 209 -14.751 9.461 11.745 1.00 50.23 H new ATOM 0 HA SER B 209 -12.765 7.642 10.750 1.00 32.44 H new ATOM 0 HB2 SER B 209 -12.771 8.718 13.017 1.00 71.43 H new ATOM 0 HB3 SER B 209 -14.227 7.831 13.422 1.00 71.43 H new ATOM 0 HG SER B 209 -11.652 6.705 12.801 1.00 30.34 H new ATOM 1773 N SER B 210 -15.818 6.693 10.878 1.00 71.15 N ATOM 1774 CA SER B 210 -16.762 5.649 10.586 1.00 0.00 C ATOM 1775 C SER B 210 -18.022 6.266 9.978 1.00 1.22 C ATOM 1776 O SER B 210 -18.442 7.352 10.395 1.00 33.21 O ATOM 1777 CB SER B 210 -17.083 4.871 11.875 1.00 12.43 C ATOM 1778 OG SER B 210 -17.448 5.760 12.928 1.00 32.41 O ATOM 0 H SER B 210 -16.237 7.622 10.929 1.00 71.15 H new ATOM 0 HA SER B 210 -16.340 4.949 9.865 1.00 0.00 H new ATOM 0 HB2 SER B 210 -17.896 4.169 11.688 1.00 12.43 H new ATOM 0 HB3 SER B 210 -16.216 4.282 12.175 1.00 12.43 H new ATOM 0 HG SER B 210 -17.649 5.244 13.737 1.00 32.41 H new ATOM 1784 N LEU B 211 -18.597 5.621 8.991 1.00 20.53 N ATOM 1785 CA LEU B 211 -19.795 6.141 8.364 1.00 33.10 C ATOM 1786 C LEU B 211 -20.730 5.027 7.976 1.00 31.41 C ATOM 1787 O LEU B 211 -20.306 4.020 7.411 1.00 44.14 O ATOM 1788 CB LEU B 211 -19.465 6.985 7.122 1.00 63.43 C ATOM 1789 CG LEU B 211 -20.681 7.569 6.371 1.00 4.02 C ATOM 1790 CD1 LEU B 211 -21.477 8.515 7.259 1.00 40.04 C ATOM 1791 CD2 LEU B 211 -20.253 8.261 5.095 1.00 74.15 C ATOM 0 H LEU B 211 -18.259 4.740 8.604 1.00 20.53 H new ATOM 0 HA LEU B 211 -20.284 6.780 9.099 1.00 33.10 H new ATOM 0 HB2 LEU B 211 -18.818 7.808 7.425 1.00 63.43 H new ATOM 0 HB3 LEU B 211 -18.893 6.369 6.428 1.00 63.43 H new ATOM 0 HG LEU B 211 -21.331 6.737 6.102 1.00 4.02 H new ATOM 0 HD11 LEU B 211 -22.326 8.909 6.701 1.00 40.04 H new ATOM 0 HD12 LEU B 211 -21.837 7.975 8.135 1.00 40.04 H new ATOM 0 HD13 LEU B 211 -20.838 9.339 7.578 1.00 40.04 H new ATOM 0 HD21 LEU B 211 -21.130 8.662 4.587 1.00 74.15 H new ATOM 0 HD22 LEU B 211 -19.568 9.074 5.334 1.00 74.15 H new ATOM 0 HD23 LEU B 211 -19.752 7.545 4.443 1.00 74.15 H new ATOM 1803 N SER B 212 -21.982 5.199 8.294 1.00 11.21 N ATOM 1804 CA SER B 212 -22.985 4.266 7.918 1.00 42.04 C ATOM 1805 C SER B 212 -23.840 4.855 6.801 1.00 32.54 C ATOM 1806 O SER B 212 -24.445 5.925 6.954 1.00 42.22 O ATOM 1807 CB SER B 212 -23.860 3.928 9.105 1.00 2.12 C ATOM 1808 OG SER B 212 -23.074 3.506 10.203 1.00 62.22 O ATOM 0 H SER B 212 -22.329 5.998 8.825 1.00 11.21 H new ATOM 0 HA SER B 212 -22.503 3.354 7.565 1.00 42.04 H new ATOM 0 HB2 SER B 212 -24.450 4.800 9.388 1.00 2.12 H new ATOM 0 HB3 SER B 212 -24.564 3.142 8.832 1.00 2.12 H new ATOM 0 HG SER B 212 -23.658 3.294 10.961 1.00 62.22 H new ATOM 1814 N ALA B 213 -23.865 4.182 5.700 1.00 63.30 N ATOM 1815 CA ALA B 213 -24.682 4.575 4.562 1.00 54.23 C ATOM 1816 C ALA B 213 -25.545 3.399 4.157 1.00 64.31 C ATOM 1817 O ALA B 213 -25.205 2.283 4.454 1.00 35.43 O ATOM 1818 CB ALA B 213 -23.803 5.037 3.409 1.00 44.03 C ATOM 0 H ALA B 213 -23.320 3.334 5.546 1.00 63.30 H new ATOM 0 HA ALA B 213 -25.323 5.413 4.836 1.00 54.23 H new ATOM 0 HB1 ALA B 213 -24.431 5.327 2.566 1.00 44.03 H new ATOM 0 HB2 ALA B 213 -23.205 5.891 3.727 1.00 44.03 H new ATOM 0 HB3 ALA B 213 -23.143 4.224 3.107 1.00 44.03 H new ATOM 1824 N SER B 214 -26.670 3.644 3.548 1.00 62.33 N ATOM 1825 CA SER B 214 -27.547 2.563 3.138 1.00 12.24 C ATOM 1826 C SER B 214 -27.115 2.014 1.771 1.00 31.52 C ATOM 1827 O SER B 214 -26.327 2.659 1.058 1.00 22.40 O ATOM 1828 CB SER B 214 -28.991 3.051 3.101 1.00 70.54 C ATOM 1829 OG SER B 214 -29.382 3.536 4.378 1.00 24.54 O ATOM 0 H SER B 214 -27.009 4.579 3.321 1.00 62.33 H new ATOM 0 HA SER B 214 -27.477 1.752 3.863 1.00 12.24 H new ATOM 0 HB2 SER B 214 -29.096 3.841 2.357 1.00 70.54 H new ATOM 0 HB3 SER B 214 -29.649 2.237 2.797 1.00 70.54 H new ATOM 0 HG SER B 214 -29.394 2.795 5.020 1.00 24.54 H new ATOM 1835 N VAL B 215 -27.595 0.827 1.423 1.00 52.01 N ATOM 1836 CA VAL B 215 -27.255 0.201 0.153 1.00 1.44 C ATOM 1837 C VAL B 215 -27.633 1.096 -1.018 1.00 33.20 C ATOM 1838 O VAL B 215 -28.801 1.456 -1.201 1.00 33.00 O ATOM 1839 CB VAL B 215 -27.938 -1.191 -0.005 1.00 44.52 C ATOM 1840 CG1 VAL B 215 -27.650 -1.800 -1.376 1.00 22.34 C ATOM 1841 CG2 VAL B 215 -27.449 -2.123 1.070 1.00 71.45 C ATOM 0 H VAL B 215 -28.225 0.276 2.007 1.00 52.01 H new ATOM 0 HA VAL B 215 -26.175 0.054 0.152 1.00 1.44 H new ATOM 0 HB VAL B 215 -29.015 -1.050 0.087 1.00 44.52 H new ATOM 0 HG11 VAL B 215 -28.141 -2.770 -1.454 1.00 22.34 H new ATOM 0 HG12 VAL B 215 -28.029 -1.138 -2.155 1.00 22.34 H new ATOM 0 HG13 VAL B 215 -26.574 -1.927 -1.499 1.00 22.34 H new ATOM 0 HG21 VAL B 215 -27.929 -3.095 0.955 1.00 71.45 H new ATOM 0 HG22 VAL B 215 -26.369 -2.240 0.986 1.00 71.45 H new ATOM 0 HG23 VAL B 215 -27.694 -1.710 2.049 1.00 71.45 H new ATOM 1851 N GLY B 216 -26.650 1.438 -1.796 1.00 12.41 N ATOM 1852 CA GLY B 216 -26.876 2.270 -2.963 1.00 41.34 C ATOM 1853 C GLY B 216 -26.531 3.732 -2.731 1.00 40.11 C ATOM 1854 O GLY B 216 -26.503 4.525 -3.677 1.00 33.45 O ATOM 0 H GLY B 216 -25.680 1.159 -1.652 1.00 12.41 H new ATOM 0 HA2 GLY B 216 -26.280 1.890 -3.793 1.00 41.34 H new ATOM 0 HA3 GLY B 216 -27.922 2.193 -3.259 1.00 41.34 H new ATOM 1858 N ASP B 217 -26.279 4.094 -1.488 1.00 74.33 N ATOM 1859 CA ASP B 217 -25.901 5.464 -1.161 1.00 41.40 C ATOM 1860 C ASP B 217 -24.477 5.750 -1.503 1.00 13.23 C ATOM 1861 O ASP B 217 -23.633 4.844 -1.537 1.00 63.21 O ATOM 1862 CB ASP B 217 -26.138 5.806 0.306 1.00 3.12 C ATOM 1863 CG ASP B 217 -27.573 6.126 0.635 1.00 13.12 C ATOM 1864 OD1 ASP B 217 -28.017 7.257 0.338 1.00 11.52 O ATOM 1865 OD2 ASP B 217 -28.265 5.302 1.240 1.00 14.13 O ATOM 0 H ASP B 217 -26.328 3.464 -0.687 1.00 74.33 H new ATOM 0 HA ASP B 217 -26.549 6.093 -1.772 1.00 41.40 H new ATOM 0 HB2 ASP B 217 -25.813 4.967 0.921 1.00 3.12 H new ATOM 0 HB3 ASP B 217 -25.515 6.659 0.575 1.00 3.12 H new ATOM 1870 N ARG B 218 -24.202 7.008 -1.746 1.00 21.25 N ATOM 1871 CA ARG B 218 -22.887 7.433 -2.066 1.00 44.34 C ATOM 1872 C ARG B 218 -22.138 7.816 -0.793 1.00 1.33 C ATOM 1873 O ARG B 218 -22.431 8.830 -0.155 1.00 64.25 O ATOM 1874 CB ARG B 218 -22.898 8.577 -3.085 1.00 11.04 C ATOM 1875 CG ARG B 218 -21.511 8.989 -3.521 1.00 12.12 C ATOM 1876 CD ARG B 218 -21.514 10.039 -4.621 1.00 34.12 C ATOM 1877 NE ARG B 218 -22.070 11.322 -4.188 1.00 15.23 N ATOM 1878 CZ ARG B 218 -21.955 12.466 -4.878 1.00 71.14 C ATOM 1879 NH1 ARG B 218 -21.282 12.488 -6.035 1.00 61.34 N ATOM 1880 NH2 ARG B 218 -22.497 13.587 -4.405 1.00 25.32 N ATOM 0 H ARG B 218 -24.894 7.757 -1.724 1.00 21.25 H new ATOM 0 HA ARG B 218 -22.360 6.603 -2.536 1.00 44.34 H new ATOM 0 HB2 ARG B 218 -23.473 8.272 -3.960 1.00 11.04 H new ATOM 0 HB3 ARG B 218 -23.408 9.438 -2.652 1.00 11.04 H new ATOM 0 HG2 ARG B 218 -20.967 9.377 -2.660 1.00 12.12 H new ATOM 0 HG3 ARG B 218 -20.971 8.109 -3.870 1.00 12.12 H new ATOM 0 HD2 ARG B 218 -20.493 10.192 -4.972 1.00 34.12 H new ATOM 0 HD3 ARG B 218 -22.090 9.667 -5.468 1.00 34.12 H new ATOM 0 HE ARG B 218 -22.578 11.347 -3.304 1.00 15.23 H new ATOM 0 HH11 ARG B 218 -20.856 11.633 -6.393 1.00 61.34 H new ATOM 0 HH12 ARG B 218 -21.196 13.359 -6.558 1.00 61.34 H new ATOM 0 HH21 ARG B 218 -23.000 13.575 -3.518 1.00 25.32 H new ATOM 0 HH22 ARG B 218 -22.409 14.457 -4.930 1.00 25.32 H new ATOM 1894 N VAL B 219 -21.203 6.977 -0.435 1.00 41.50 N ATOM 1895 CA VAL B 219 -20.390 7.124 0.762 1.00 24.33 C ATOM 1896 C VAL B 219 -19.439 8.303 0.623 1.00 24.43 C ATOM 1897 O VAL B 219 -18.881 8.521 -0.446 1.00 55.14 O ATOM 1898 CB VAL B 219 -19.545 5.842 0.986 1.00 40.34 C ATOM 1899 CG1 VAL B 219 -18.668 5.950 2.224 1.00 74.43 C ATOM 1900 CG2 VAL B 219 -20.435 4.624 1.066 1.00 60.14 C ATOM 0 H VAL B 219 -20.972 6.145 -0.978 1.00 41.50 H new ATOM 0 HA VAL B 219 -21.059 7.291 1.606 1.00 24.33 H new ATOM 0 HB VAL B 219 -18.883 5.734 0.127 1.00 40.34 H new ATOM 0 HG11 VAL B 219 -18.093 5.032 2.344 1.00 74.43 H new ATOM 0 HG12 VAL B 219 -17.986 6.793 2.114 1.00 74.43 H new ATOM 0 HG13 VAL B 219 -19.295 6.103 3.102 1.00 74.43 H new ATOM 0 HG21 VAL B 219 -19.823 3.736 1.223 1.00 60.14 H new ATOM 0 HG22 VAL B 219 -21.132 4.736 1.897 1.00 60.14 H new ATOM 0 HG23 VAL B 219 -20.993 4.520 0.136 1.00 60.14 H new ATOM 1910 N THR B 220 -19.261 9.047 1.687 1.00 41.51 N ATOM 1911 CA THR B 220 -18.335 10.134 1.687 1.00 32.30 C ATOM 1912 C THR B 220 -17.268 9.882 2.758 1.00 64.42 C ATOM 1913 O THR B 220 -17.577 9.799 3.943 1.00 64.42 O ATOM 1914 CB THR B 220 -19.064 11.447 2.018 1.00 52.33 C ATOM 1915 OG1 THR B 220 -20.188 11.608 1.138 1.00 25.45 O ATOM 1916 CG2 THR B 220 -18.132 12.639 1.861 1.00 33.15 C ATOM 0 H THR B 220 -19.755 8.911 2.569 1.00 41.51 H new ATOM 0 HA THR B 220 -17.875 10.211 0.702 1.00 32.30 H new ATOM 0 HB THR B 220 -19.402 11.400 3.053 1.00 52.33 H new ATOM 0 HG1 THR B 220 -20.653 12.444 1.351 1.00 25.45 H new ATOM 0 HG21 THR B 220 -18.670 13.556 2.101 1.00 33.15 H new ATOM 0 HG22 THR B 220 -17.284 12.529 2.537 1.00 33.15 H new ATOM 0 HG23 THR B 220 -17.773 12.687 0.833 1.00 33.15 H new ATOM 1924 N ILE B 221 -16.042 9.747 2.336 1.00 2.21 N ATOM 1925 CA ILE B 221 -14.927 9.573 3.235 1.00 23.03 C ATOM 1926 C ILE B 221 -13.905 10.649 2.925 1.00 64.44 C ATOM 1927 O ILE B 221 -13.491 10.794 1.787 1.00 60.55 O ATOM 1928 CB ILE B 221 -14.274 8.155 3.071 1.00 62.22 C ATOM 1929 CG1 ILE B 221 -15.273 7.047 3.488 1.00 43.53 C ATOM 1930 CG2 ILE B 221 -12.989 8.069 3.885 1.00 14.31 C ATOM 1931 CD1 ILE B 221 -14.800 5.610 3.285 1.00 72.42 C ATOM 0 H ILE B 221 -15.782 9.754 1.350 1.00 2.21 H new ATOM 0 HA ILE B 221 -15.277 9.654 4.264 1.00 23.03 H new ATOM 0 HB ILE B 221 -14.023 8.003 2.021 1.00 62.22 H new ATOM 0 HG12 ILE B 221 -15.517 7.183 4.542 1.00 43.53 H new ATOM 0 HG13 ILE B 221 -16.196 7.188 2.926 1.00 43.53 H new ATOM 0 HG21 ILE B 221 -12.546 7.081 3.763 1.00 14.31 H new ATOM 0 HG22 ILE B 221 -12.287 8.827 3.538 1.00 14.31 H new ATOM 0 HG23 ILE B 221 -13.213 8.238 4.938 1.00 14.31 H new ATOM 0 HD11 ILE B 221 -15.579 4.921 3.611 1.00 72.42 H new ATOM 0 HD12 ILE B 221 -14.586 5.443 2.229 1.00 72.42 H new ATOM 0 HD13 ILE B 221 -13.896 5.438 3.870 1.00 72.42 H new ATOM 1943 N THR B 222 -13.517 11.409 3.904 1.00 43.41 N ATOM 1944 CA THR B 222 -12.573 12.457 3.673 1.00 64.23 C ATOM 1945 C THR B 222 -11.270 12.131 4.389 1.00 53.45 C ATOM 1946 O THR B 222 -11.274 11.588 5.507 1.00 65.02 O ATOM 1947 CB THR B 222 -13.128 13.801 4.174 1.00 35.43 C ATOM 1948 OG1 THR B 222 -14.485 13.940 3.705 1.00 21.02 O ATOM 1949 CG2 THR B 222 -12.314 14.966 3.615 1.00 60.34 C ATOM 0 H THR B 222 -13.839 11.323 4.868 1.00 43.41 H new ATOM 0 HA THR B 222 -12.388 12.539 2.602 1.00 64.23 H new ATOM 0 HB THR B 222 -13.078 13.817 5.263 1.00 35.43 H new ATOM 0 HG1 THR B 222 -14.854 14.792 4.018 1.00 21.02 H new ATOM 0 HG21 THR B 222 -12.725 15.906 3.983 1.00 60.34 H new ATOM 0 HG22 THR B 222 -11.277 14.873 3.937 1.00 60.34 H new ATOM 0 HG23 THR B 222 -12.359 14.952 2.526 1.00 60.34 H new ATOM 1957 N CYS B 223 -10.185 12.411 3.743 1.00 54.34 N ATOM 1958 CA CYS B 223 -8.899 12.207 4.309 1.00 30.52 C ATOM 1959 C CYS B 223 -8.159 13.528 4.208 1.00 20.53 C ATOM 1960 O CYS B 223 -8.210 14.189 3.163 1.00 0.00 O ATOM 1961 CB CYS B 223 -8.177 11.089 3.512 1.00 52.33 C ATOM 1962 SG CYS B 223 -6.500 10.637 4.082 1.00 31.31 S ATOM 0 H CYS B 223 -10.171 12.792 2.797 1.00 54.34 H new ATOM 0 HA CYS B 223 -8.949 11.894 5.352 1.00 30.52 H new ATOM 0 HB2 CYS B 223 -8.799 10.194 3.538 1.00 52.33 H new ATOM 0 HB3 CYS B 223 -8.111 11.401 2.470 1.00 52.33 H new ATOM 1967 N GLN B 224 -7.520 13.921 5.278 1.00 5.23 N ATOM 1968 CA GLN B 224 -6.760 15.145 5.306 1.00 20.14 C ATOM 1969 C GLN B 224 -5.298 14.819 5.437 1.00 44.21 C ATOM 1970 O GLN B 224 -4.902 14.075 6.331 1.00 72.12 O ATOM 1971 CB GLN B 224 -7.148 16.086 6.477 1.00 2.43 C ATOM 1972 CG GLN B 224 -8.602 16.571 6.558 1.00 62.02 C ATOM 1973 CD GLN B 224 -9.594 15.518 7.035 1.00 72.14 C ATOM 1974 OE1 GLN B 224 -10.188 14.787 6.252 1.00 0.03 O ATOM 1975 NE2 GLN B 224 -9.787 15.444 8.333 1.00 51.40 N ATOM 0 H GLN B 224 -7.511 13.402 6.156 1.00 5.23 H new ATOM 0 HA GLN B 224 -6.981 15.666 4.374 1.00 20.14 H new ATOM 0 HB2 GLN B 224 -6.914 15.573 7.410 1.00 2.43 H new ATOM 0 HB3 GLN B 224 -6.505 16.965 6.427 1.00 2.43 H new ATOM 0 HG2 GLN B 224 -8.649 17.427 7.231 1.00 62.02 H new ATOM 0 HG3 GLN B 224 -8.910 16.922 5.573 1.00 62.02 H new ATOM 0 HE21 GLN B 224 -9.278 16.066 8.961 1.00 51.40 H new ATOM 0 HE22 GLN B 224 -10.446 14.764 8.713 1.00 51.40 H new ATOM 1984 N ALA B 225 -4.517 15.352 4.562 1.00 12.32 N ATOM 1985 CA ALA B 225 -3.100 15.165 4.599 1.00 3.25 C ATOM 1986 C ALA B 225 -2.446 16.300 5.367 1.00 42.35 C ATOM 1987 O ALA B 225 -2.771 17.476 5.159 1.00 41.30 O ATOM 1988 CB ALA B 225 -2.542 15.090 3.189 1.00 42.24 C ATOM 0 H ALA B 225 -4.843 15.936 3.792 1.00 12.32 H new ATOM 0 HA ALA B 225 -2.882 14.226 5.107 1.00 3.25 H new ATOM 0 HB1 ALA B 225 -1.462 14.948 3.232 1.00 42.24 H new ATOM 0 HB2 ALA B 225 -2.998 14.252 2.661 1.00 42.24 H new ATOM 0 HB3 ALA B 225 -2.765 16.016 2.660 1.00 42.24 H new ATOM 1994 N SER B 226 -1.556 15.950 6.264 1.00 43.13 N ATOM 1995 CA SER B 226 -0.824 16.914 7.064 1.00 4.25 C ATOM 1996 C SER B 226 0.186 17.702 6.197 1.00 53.02 C ATOM 1997 O SER B 226 0.646 18.783 6.577 1.00 61.40 O ATOM 1998 CB SER B 226 -0.113 16.187 8.209 1.00 64.12 C ATOM 1999 OG SER B 226 0.569 17.076 9.073 1.00 52.23 O ATOM 0 H SER B 226 -1.314 14.980 6.464 1.00 43.13 H new ATOM 0 HA SER B 226 -1.526 17.636 7.481 1.00 4.25 H new ATOM 0 HB2 SER B 226 -0.844 15.617 8.783 1.00 64.12 H new ATOM 0 HB3 SER B 226 0.597 15.471 7.795 1.00 64.12 H new ATOM 0 HG SER B 226 1.005 16.567 9.788 1.00 52.23 H new ATOM 2005 N GLN B 227 0.510 17.164 5.036 1.00 70.03 N ATOM 2006 CA GLN B 227 1.430 17.803 4.120 1.00 51.01 C ATOM 2007 C GLN B 227 0.842 17.694 2.727 1.00 63.24 C ATOM 2008 O GLN B 227 0.052 16.789 2.470 1.00 74.23 O ATOM 2009 CB GLN B 227 2.810 17.105 4.152 1.00 23.32 C ATOM 2010 CG GLN B 227 3.877 17.811 3.320 1.00 23.55 C ATOM 2011 CD GLN B 227 5.197 17.070 3.234 1.00 13.11 C ATOM 2012 OE1 GLN B 227 5.357 16.296 2.196 1.00 24.12 O flip ATOM 2013 NE2 GLN B 227 6.084 17.232 4.076 1.00 61.32 N flip ATOM 0 H GLN B 227 0.142 16.273 4.704 1.00 70.03 H new ATOM 0 HA GLN B 227 1.572 18.845 4.406 1.00 51.01 H new ATOM 0 HB2 GLN B 227 3.151 17.042 5.185 1.00 23.32 H new ATOM 0 HB3 GLN B 227 2.698 16.083 3.791 1.00 23.32 H new ATOM 0 HG2 GLN B 227 3.493 17.962 2.311 1.00 23.55 H new ATOM 0 HG3 GLN B 227 4.056 18.799 3.744 1.00 23.55 H new ATOM 0 HE21 GLN B 227 5.923 17.845 4.875 1.00 61.32 H new ATOM 0 HE22 GLN B 227 6.979 16.753 3.973 1.00 61.32 H new ATOM 2022 N ASP B 228 1.197 18.610 1.855 1.00 3.51 N ATOM 2023 CA ASP B 228 0.744 18.572 0.468 1.00 3.41 C ATOM 2024 C ASP B 228 1.290 17.330 -0.227 1.00 33.11 C ATOM 2025 O ASP B 228 2.505 17.164 -0.360 1.00 35.50 O ATOM 2026 CB ASP B 228 1.197 19.838 -0.274 1.00 63.55 C ATOM 2027 CG ASP B 228 0.836 19.846 -1.757 1.00 2.03 C ATOM 2028 OD1 ASP B 228 -0.294 20.262 -2.111 1.00 11.22 O ATOM 2029 OD2 ASP B 228 1.692 19.474 -2.588 1.00 25.41 O ATOM 0 H ASP B 228 1.803 19.400 2.077 1.00 3.51 H new ATOM 0 HA ASP B 228 -0.345 18.532 0.455 1.00 3.41 H new ATOM 0 HB2 ASP B 228 0.748 20.708 0.204 1.00 63.55 H new ATOM 0 HB3 ASP B 228 2.277 19.940 -0.172 1.00 63.55 H new ATOM 2034 N ILE B 229 0.403 16.444 -0.620 1.00 65.10 N ATOM 2035 CA ILE B 229 0.797 15.231 -1.329 1.00 22.15 C ATOM 2036 C ILE B 229 0.274 15.287 -2.752 1.00 64.41 C ATOM 2037 O ILE B 229 0.385 14.339 -3.517 1.00 73.32 O ATOM 2038 CB ILE B 229 0.275 13.949 -0.627 1.00 74.12 C ATOM 2039 CG1 ILE B 229 -1.255 13.942 -0.569 1.00 22.32 C ATOM 2040 CG2 ILE B 229 0.865 13.844 0.774 1.00 41.32 C ATOM 2041 CD1 ILE B 229 -1.845 12.693 0.050 1.00 30.01 C ATOM 0 H ILE B 229 -0.601 16.534 -0.464 1.00 65.10 H new ATOM 0 HA ILE B 229 1.886 15.183 -1.329 1.00 22.15 H new ATOM 0 HB ILE B 229 0.592 13.083 -1.208 1.00 74.12 H new ATOM 0 HG12 ILE B 229 -1.590 14.809 -0.000 1.00 22.32 H new ATOM 0 HG13 ILE B 229 -1.647 14.053 -1.580 1.00 22.32 H new ATOM 0 HG21 ILE B 229 0.493 12.941 1.259 1.00 41.32 H new ATOM 0 HG22 ILE B 229 1.952 13.799 0.709 1.00 41.32 H new ATOM 0 HG23 ILE B 229 0.573 14.716 1.358 1.00 41.32 H new ATOM 0 HD11 ILE B 229 -2.932 12.767 0.053 1.00 30.01 H new ATOM 0 HD12 ILE B 229 -1.543 11.821 -0.531 1.00 30.01 H new ATOM 0 HD13 ILE B 229 -1.485 12.590 1.074 1.00 30.01 H new ATOM 2053 N SER B 230 -0.287 16.426 -3.073 1.00 42.34 N ATOM 2054 CA SER B 230 -0.861 16.734 -4.374 1.00 61.40 C ATOM 2055 C SER B 230 -1.919 15.695 -4.836 1.00 24.44 C ATOM 2056 O SER B 230 -3.058 15.733 -4.402 1.00 64.01 O ATOM 2057 CB SER B 230 0.236 16.982 -5.434 1.00 41.20 C ATOM 2058 OG SER B 230 -0.312 17.324 -6.698 1.00 41.33 O ATOM 0 H SER B 230 -0.363 17.200 -2.413 1.00 42.34 H new ATOM 0 HA SER B 230 -1.410 17.668 -4.258 1.00 61.40 H new ATOM 0 HB2 SER B 230 0.893 17.783 -5.095 1.00 41.20 H new ATOM 0 HB3 SER B 230 0.851 16.088 -5.536 1.00 41.20 H new ATOM 0 HG SER B 230 -0.370 16.521 -7.257 1.00 41.33 H new ATOM 2064 N ASN B 231 -1.534 14.783 -5.686 1.00 23.12 N ATOM 2065 CA ASN B 231 -2.440 13.756 -6.182 1.00 4.02 C ATOM 2066 C ASN B 231 -1.939 12.385 -5.815 1.00 62.31 C ATOM 2067 O ASN B 231 -2.514 11.372 -6.213 1.00 11.41 O ATOM 2068 CB ASN B 231 -2.615 13.871 -7.707 1.00 43.11 C ATOM 2069 CG ASN B 231 -1.298 13.805 -8.468 1.00 72.44 C ATOM 2070 OD1 ASN B 231 -0.664 14.835 -8.720 1.00 41.21 O ATOM 2071 ND2 ASN B 231 -0.879 12.629 -8.837 1.00 21.33 N ATOM 0 H ASN B 231 -0.587 14.722 -6.060 1.00 23.12 H new ATOM 0 HA ASN B 231 -3.412 13.907 -5.712 1.00 4.02 H new ATOM 0 HB2 ASN B 231 -3.268 13.069 -8.053 1.00 43.11 H new ATOM 0 HB3 ASN B 231 -3.115 14.812 -7.939 1.00 43.11 H new ATOM 0 HD21 ASN B 231 -0.002 12.538 -9.351 1.00 21.33 H new ATOM 0 HD22 ASN B 231 -1.427 11.799 -8.612 1.00 21.33 H new ATOM 2078 N TYR B 232 -0.885 12.352 -5.038 1.00 75.15 N ATOM 2079 CA TYR B 232 -0.264 11.112 -4.686 1.00 55.45 C ATOM 2080 C TYR B 232 -0.957 10.496 -3.481 1.00 23.21 C ATOM 2081 O TYR B 232 -0.554 10.701 -2.333 1.00 24.40 O ATOM 2082 CB TYR B 232 1.240 11.308 -4.437 1.00 74.52 C ATOM 2083 CG TYR B 232 1.963 11.958 -5.607 1.00 43.31 C ATOM 2084 CD1 TYR B 232 2.220 11.253 -6.767 1.00 30.51 C ATOM 2085 CD2 TYR B 232 2.382 13.280 -5.544 1.00 33.40 C ATOM 2086 CE1 TYR B 232 2.871 11.839 -7.829 1.00 11.01 C ATOM 2087 CE2 TYR B 232 3.033 13.873 -6.602 1.00 50.00 C ATOM 2088 CZ TYR B 232 3.275 13.148 -7.743 1.00 73.33 C ATOM 2089 OH TYR B 232 3.929 13.739 -8.809 1.00 25.13 O ATOM 0 H TYR B 232 -0.441 13.179 -4.638 1.00 75.15 H new ATOM 0 HA TYR B 232 -0.368 10.418 -5.520 1.00 55.45 H new ATOM 0 HB2 TYR B 232 1.377 11.923 -3.547 1.00 74.52 H new ATOM 0 HB3 TYR B 232 1.696 10.340 -4.229 1.00 74.52 H new ATOM 0 HD1 TYR B 232 1.904 10.223 -6.842 1.00 30.51 H new ATOM 0 HD2 TYR B 232 2.194 13.854 -4.649 1.00 33.40 H new ATOM 0 HE1 TYR B 232 3.063 11.271 -8.727 1.00 11.01 H new ATOM 0 HE2 TYR B 232 3.352 14.903 -6.535 1.00 50.00 H new ATOM 0 HH TYR B 232 4.145 14.668 -8.586 1.00 25.13 H new ATOM 2099 N LEU B 233 -2.024 9.777 -3.751 1.00 32.42 N ATOM 2100 CA LEU B 233 -2.829 9.188 -2.716 1.00 3.32 C ATOM 2101 C LEU B 233 -3.321 7.801 -3.120 1.00 34.41 C ATOM 2102 O LEU B 233 -3.831 7.613 -4.232 1.00 30.20 O ATOM 2103 CB LEU B 233 -4.032 10.081 -2.455 1.00 1.41 C ATOM 2104 CG LEU B 233 -4.987 9.615 -1.372 1.00 31.44 C ATOM 2105 CD1 LEU B 233 -4.316 9.622 -0.025 1.00 33.23 C ATOM 2106 CD2 LEU B 233 -6.225 10.458 -1.357 1.00 71.13 C ATOM 0 H LEU B 233 -2.354 9.587 -4.697 1.00 32.42 H new ATOM 0 HA LEU B 233 -2.218 9.091 -1.818 1.00 3.32 H new ATOM 0 HB2 LEU B 233 -3.671 11.074 -2.189 1.00 1.41 H new ATOM 0 HB3 LEU B 233 -4.591 10.183 -3.385 1.00 1.41 H new ATOM 0 HG LEU B 233 -5.279 8.589 -1.596 1.00 31.44 H new ATOM 0 HD11 LEU B 233 -5.021 9.284 0.734 1.00 33.23 H new ATOM 0 HD12 LEU B 233 -3.455 8.954 -0.044 1.00 33.23 H new ATOM 0 HD13 LEU B 233 -3.985 10.633 0.211 1.00 33.23 H new ATOM 0 HD21 LEU B 233 -6.895 10.106 -0.573 1.00 71.13 H new ATOM 0 HD22 LEU B 233 -5.956 11.497 -1.165 1.00 71.13 H new ATOM 0 HD23 LEU B 233 -6.726 10.386 -2.322 1.00 71.13 H new ATOM 2118 N ASN B 234 -3.179 6.844 -2.220 1.00 44.45 N ATOM 2119 CA ASN B 234 -3.683 5.488 -2.439 1.00 74.14 C ATOM 2120 C ASN B 234 -4.823 5.207 -1.477 1.00 1.00 C ATOM 2121 O ASN B 234 -4.781 5.642 -0.318 1.00 34.40 O ATOM 2122 CB ASN B 234 -2.599 4.416 -2.188 1.00 65.34 C ATOM 2123 CG ASN B 234 -1.378 4.481 -3.081 1.00 44.02 C ATOM 2124 OD1 ASN B 234 -1.535 4.987 -4.248 1.00 44.31 O flip ATOM 2125 ND2 ASN B 234 -0.291 4.079 -2.694 1.00 62.22 N flip ATOM 0 H ASN B 234 -2.715 6.977 -1.321 1.00 44.45 H new ATOM 0 HA ASN B 234 -4.007 5.435 -3.478 1.00 74.14 H new ATOM 0 HB2 ASN B 234 -2.271 4.496 -1.152 1.00 65.34 H new ATOM 0 HB3 ASN B 234 -3.056 3.433 -2.302 1.00 65.34 H new ATOM 0 HD21 ASN B 234 -0.198 3.681 -1.759 1.00 62.22 H new ATOM 0 HD22 ASN B 234 0.523 4.141 -3.305 1.00 62.22 H new ATOM 2132 N TRP B 235 -5.841 4.503 -1.941 1.00 34.13 N ATOM 2133 CA TRP B 235 -6.914 4.081 -1.076 1.00 74.31 C ATOM 2134 C TRP B 235 -6.936 2.570 -0.976 1.00 30.21 C ATOM 2135 O TRP B 235 -6.918 1.880 -1.987 1.00 71.33 O ATOM 2136 CB TRP B 235 -8.281 4.584 -1.576 1.00 55.25 C ATOM 2137 CG TRP B 235 -8.488 6.063 -1.437 1.00 63.22 C ATOM 2138 CD1 TRP B 235 -8.280 7.042 -2.380 1.00 62.12 C ATOM 2139 CD2 TRP B 235 -8.970 6.730 -0.264 1.00 2.15 C ATOM 2140 NE1 TRP B 235 -8.590 8.267 -1.847 1.00 0.31 N ATOM 2141 CE2 TRP B 235 -9.014 8.103 -0.551 1.00 53.10 C ATOM 2142 CE3 TRP B 235 -9.365 6.288 1.008 1.00 1.23 C ATOM 2143 CZ2 TRP B 235 -9.439 9.049 0.390 1.00 51.14 C ATOM 2144 CZ3 TRP B 235 -9.789 7.214 1.940 1.00 20.21 C ATOM 2145 CH2 TRP B 235 -9.823 8.583 1.626 1.00 31.21 C ATOM 0 H TRP B 235 -5.941 4.214 -2.914 1.00 34.13 H new ATOM 0 HA TRP B 235 -6.733 4.514 -0.092 1.00 74.31 H new ATOM 0 HB2 TRP B 235 -8.393 4.311 -2.625 1.00 55.25 H new ATOM 0 HB3 TRP B 235 -9.068 4.067 -1.027 1.00 55.25 H new ATOM 0 HD1 TRP B 235 -7.927 6.872 -3.386 1.00 62.12 H new ATOM 0 HE1 TRP B 235 -8.517 9.159 -2.336 1.00 0.31 H new ATOM 0 HE3 TRP B 235 -9.338 5.237 1.255 1.00 1.23 H new ATOM 0 HZ2 TRP B 235 -9.464 10.103 0.155 1.00 51.14 H new ATOM 0 HZ3 TRP B 235 -10.098 6.883 2.920 1.00 20.21 H new ATOM 0 HH2 TRP B 235 -10.159 9.287 2.373 1.00 31.21 H new ATOM 2156 N TYR B 236 -6.979 2.078 0.234 1.00 44.44 N ATOM 2157 CA TYR B 236 -7.080 0.663 0.514 1.00 73.40 C ATOM 2158 C TYR B 236 -8.321 0.343 1.329 1.00 54.44 C ATOM 2159 O TYR B 236 -8.788 1.158 2.149 1.00 2.52 O ATOM 2160 CB TYR B 236 -5.836 0.150 1.274 1.00 14.41 C ATOM 2161 CG TYR B 236 -4.587 0.030 0.440 1.00 64.53 C ATOM 2162 CD1 TYR B 236 -3.843 1.141 0.086 1.00 53.14 C ATOM 2163 CD2 TYR B 236 -4.159 -1.211 0.003 1.00 11.33 C ATOM 2164 CE1 TYR B 236 -2.710 1.014 -0.685 1.00 45.23 C ATOM 2165 CE2 TYR B 236 -3.026 -1.351 -0.763 1.00 75.13 C ATOM 2166 CZ TYR B 236 -2.305 -0.240 -1.108 1.00 23.24 C ATOM 2167 OH TYR B 236 -1.187 -0.377 -1.898 1.00 54.30 O ATOM 0 H TYR B 236 -6.944 2.658 1.072 1.00 44.44 H new ATOM 0 HA TYR B 236 -7.147 0.159 -0.450 1.00 73.40 H new ATOM 0 HB2 TYR B 236 -5.635 0.822 2.108 1.00 14.41 H new ATOM 0 HB3 TYR B 236 -6.066 -0.827 1.700 1.00 14.41 H new ATOM 0 HD1 TYR B 236 -4.155 2.120 0.419 1.00 53.14 H new ATOM 0 HD2 TYR B 236 -4.728 -2.090 0.270 1.00 11.33 H new ATOM 0 HE1 TYR B 236 -2.139 1.889 -0.959 1.00 45.23 H new ATOM 0 HE2 TYR B 236 -2.707 -2.330 -1.090 1.00 75.13 H new ATOM 0 HH TYR B 236 -0.461 -0.773 -1.372 1.00 54.30 H new ATOM 2177 N GLN B 237 -8.808 -0.851 1.125 1.00 54.04 N ATOM 2178 CA GLN B 237 -9.947 -1.401 1.813 1.00 42.32 C ATOM 2179 C GLN B 237 -9.444 -2.533 2.666 1.00 2.43 C ATOM 2180 O GLN B 237 -8.916 -3.500 2.144 1.00 54.52 O ATOM 2181 CB GLN B 237 -10.915 -2.022 0.775 1.00 55.10 C ATOM 2182 CG GLN B 237 -12.063 -2.824 1.393 1.00 40.21 C ATOM 2183 CD GLN B 237 -12.800 -3.700 0.382 1.00 51.41 C ATOM 2184 OE1 GLN B 237 -12.419 -4.849 0.157 1.00 35.22 O ATOM 2185 NE2 GLN B 237 -13.870 -3.212 -0.180 1.00 11.31 N ATOM 0 H GLN B 237 -8.405 -1.496 0.445 1.00 54.04 H new ATOM 0 HA GLN B 237 -10.449 -0.628 2.395 1.00 42.32 H new ATOM 0 HB2 GLN B 237 -11.333 -1.224 0.161 1.00 55.10 H new ATOM 0 HB3 GLN B 237 -10.348 -2.673 0.109 1.00 55.10 H new ATOM 0 HG2 GLN B 237 -11.669 -3.454 2.190 1.00 40.21 H new ATOM 0 HG3 GLN B 237 -12.772 -2.135 1.852 1.00 40.21 H new ATOM 0 HE21 GLN B 237 -14.163 -2.257 0.024 1.00 11.31 H new ATOM 0 HE22 GLN B 237 -14.414 -3.786 -0.824 1.00 11.31 H new ATOM 2194 N GLN B 238 -9.586 -2.428 3.953 1.00 62.44 N ATOM 2195 CA GLN B 238 -9.177 -3.499 4.801 1.00 22.34 C ATOM 2196 C GLN B 238 -10.437 -4.237 5.157 1.00 62.01 C ATOM 2197 O GLN B 238 -11.295 -3.724 5.870 1.00 54.32 O ATOM 2198 CB GLN B 238 -8.464 -2.956 6.058 1.00 64.33 C ATOM 2199 CG GLN B 238 -7.613 -3.971 6.864 1.00 15.02 C ATOM 2200 CD GLN B 238 -8.364 -5.184 7.380 1.00 44.52 C ATOM 2201 OE1 GLN B 238 -8.931 -5.157 8.458 1.00 71.04 O ATOM 2202 NE2 GLN B 238 -8.315 -6.264 6.644 1.00 54.12 N ATOM 0 H GLN B 238 -9.979 -1.618 4.433 1.00 62.44 H new ATOM 0 HA GLN B 238 -8.462 -4.158 4.309 1.00 22.34 H new ATOM 0 HB2 GLN B 238 -7.817 -2.133 5.754 1.00 64.33 H new ATOM 0 HB3 GLN B 238 -9.219 -2.538 6.725 1.00 64.33 H new ATOM 0 HG2 GLN B 238 -6.793 -4.314 6.233 1.00 15.02 H new ATOM 0 HG3 GLN B 238 -7.167 -3.453 7.713 1.00 15.02 H new ATOM 0 HE21 GLN B 238 -7.831 -6.248 5.746 1.00 54.12 H new ATOM 0 HE22 GLN B 238 -8.761 -7.122 6.968 1.00 54.12 H new ATOM 2211 N LYS B 239 -10.538 -5.402 4.639 1.00 0.02 N ATOM 2212 CA LYS B 239 -11.655 -6.248 4.794 1.00 62.22 C ATOM 2213 C LYS B 239 -11.330 -7.371 5.759 1.00 71.24 C ATOM 2214 O LYS B 239 -10.359 -8.071 5.567 1.00 3.13 O ATOM 2215 CB LYS B 239 -12.002 -6.788 3.387 1.00 11.33 C ATOM 2216 CG LYS B 239 -12.717 -8.125 3.335 1.00 21.33 C ATOM 2217 CD LYS B 239 -14.030 -8.150 4.016 1.00 10.22 C ATOM 2218 CE LYS B 239 -15.066 -7.291 3.289 1.00 45.32 C ATOM 2219 NZ LYS B 239 -16.356 -7.250 4.005 1.00 33.35 N ATOM 0 H LYS B 239 -9.802 -5.812 4.064 1.00 0.02 H new ATOM 0 HA LYS B 239 -12.508 -5.714 5.212 1.00 62.22 H new ATOM 0 HB2 LYS B 239 -12.623 -6.049 2.881 1.00 11.33 H new ATOM 0 HB3 LYS B 239 -11.077 -6.873 2.816 1.00 11.33 H new ATOM 0 HG2 LYS B 239 -12.859 -8.406 2.291 1.00 21.33 H new ATOM 0 HG3 LYS B 239 -12.075 -8.883 3.784 1.00 21.33 H new ATOM 0 HD2 LYS B 239 -14.388 -9.178 4.076 1.00 10.22 H new ATOM 0 HD3 LYS B 239 -13.915 -7.792 5.039 1.00 10.22 H new ATOM 0 HE2 LYS B 239 -14.682 -6.277 3.178 1.00 45.32 H new ATOM 0 HE3 LYS B 239 -15.222 -7.685 2.285 1.00 45.32 H new ATOM 0 HZ1 LYS B 239 -17.132 -7.163 3.318 1.00 33.35 H new ATOM 0 HZ2 LYS B 239 -16.476 -8.125 4.554 1.00 33.35 H new ATOM 0 HZ3 LYS B 239 -16.370 -6.433 4.648 1.00 33.35 H new ATOM 2276 N ALA B 243 -7.082 -9.339 2.869 1.00 52.00 N ATOM 2277 CA ALA B 243 -5.986 -8.422 3.050 1.00 22.34 C ATOM 2278 C ALA B 243 -6.430 -7.069 2.504 1.00 42.40 C ATOM 2279 O ALA B 243 -7.262 -7.029 1.595 1.00 21.41 O ATOM 2280 CB ALA B 243 -4.747 -8.920 2.316 1.00 53.25 C ATOM 0 HA ALA B 243 -5.725 -8.339 4.105 1.00 22.34 H new ATOM 0 HB1 ALA B 243 -3.929 -8.215 2.464 1.00 53.25 H new ATOM 0 HB2 ALA B 243 -4.460 -9.896 2.707 1.00 53.25 H new ATOM 0 HB3 ALA B 243 -4.965 -9.006 1.251 1.00 53.25 H new ATOM 2286 N PRO B 244 -5.950 -5.941 3.072 1.00 23.42 N ATOM 2287 CA PRO B 244 -6.296 -4.619 2.566 1.00 43.45 C ATOM 2288 C PRO B 244 -5.929 -4.459 1.083 1.00 73.13 C ATOM 2289 O PRO B 244 -4.762 -4.536 0.707 1.00 21.10 O ATOM 2290 CB PRO B 244 -5.485 -3.646 3.459 1.00 41.50 C ATOM 2291 CG PRO B 244 -4.463 -4.501 4.121 1.00 50.13 C ATOM 2292 CD PRO B 244 -5.072 -5.868 4.238 1.00 42.23 C ATOM 0 HA PRO B 244 -7.369 -4.431 2.611 1.00 43.45 H new ATOM 0 HB2 PRO B 244 -5.019 -2.860 2.865 1.00 41.50 H new ATOM 0 HB3 PRO B 244 -6.125 -3.155 4.192 1.00 41.50 H new ATOM 0 HG2 PRO B 244 -3.544 -4.533 3.536 1.00 50.13 H new ATOM 0 HG3 PRO B 244 -4.202 -4.106 5.103 1.00 50.13 H new ATOM 0 HD2 PRO B 244 -4.313 -6.650 4.221 1.00 42.23 H new ATOM 0 HD3 PRO B 244 -5.627 -5.983 5.169 1.00 42.23 H new ATOM 2300 N LYS B 245 -6.940 -4.253 0.257 1.00 12.42 N ATOM 2301 CA LYS B 245 -6.744 -4.109 -1.165 1.00 75.00 C ATOM 2302 C LYS B 245 -6.881 -2.671 -1.617 1.00 12.41 C ATOM 2303 O LYS B 245 -7.774 -1.945 -1.176 1.00 53.11 O ATOM 2304 CB LYS B 245 -7.668 -5.017 -2.009 1.00 0.21 C ATOM 2305 CG LYS B 245 -7.468 -4.758 -3.497 1.00 3.42 C ATOM 2306 CD LYS B 245 -8.277 -5.627 -4.418 1.00 51.24 C ATOM 2307 CE LYS B 245 -8.040 -5.175 -5.866 1.00 11.31 C ATOM 2308 NZ LYS B 245 -6.592 -5.154 -6.219 1.00 1.43 N ATOM 0 H LYS B 245 -7.913 -4.182 0.556 1.00 12.42 H new ATOM 0 HA LYS B 245 -5.719 -4.436 -1.341 1.00 75.00 H new ATOM 0 HB2 LYS B 245 -7.459 -6.063 -1.786 1.00 0.21 H new ATOM 0 HB3 LYS B 245 -8.709 -4.835 -1.740 1.00 0.21 H new ATOM 0 HG2 LYS B 245 -7.711 -3.715 -3.703 1.00 3.42 H new ATOM 0 HG3 LYS B 245 -6.412 -4.892 -3.733 1.00 3.42 H new ATOM 0 HD2 LYS B 245 -7.991 -6.672 -4.298 1.00 51.24 H new ATOM 0 HD3 LYS B 245 -9.336 -5.556 -4.170 1.00 51.24 H new ATOM 0 HE2 LYS B 245 -8.568 -5.844 -6.545 1.00 11.31 H new ATOM 0 HE3 LYS B 245 -8.461 -4.180 -6.008 1.00 11.31 H new ATOM 0 HZ1 LYS B 245 -6.477 -4.811 -7.194 1.00 1.43 H new ATOM 0 HZ2 LYS B 245 -6.085 -4.522 -5.567 1.00 1.43 H new ATOM 0 HZ3 LYS B 245 -6.202 -6.115 -6.142 1.00 1.43 H new ATOM 2322 N LEU B 246 -5.973 -2.274 -2.468 1.00 43.24 N ATOM 2323 CA LEU B 246 -5.948 -0.979 -3.071 1.00 51.14 C ATOM 2324 C LEU B 246 -7.072 -0.824 -4.077 1.00 12.31 C ATOM 2325 O LEU B 246 -7.297 -1.689 -4.931 1.00 10.31 O ATOM 2326 CB LEU B 246 -4.595 -0.810 -3.721 1.00 21.42 C ATOM 2327 CG LEU B 246 -4.319 0.370 -4.600 1.00 61.20 C ATOM 2328 CD1 LEU B 246 -4.213 1.590 -3.764 1.00 23.45 C ATOM 2329 CD2 LEU B 246 -3.041 0.144 -5.384 1.00 53.24 C ATOM 0 H LEU B 246 -5.203 -2.871 -2.768 1.00 43.24 H new ATOM 0 HA LEU B 246 -6.101 -0.204 -2.320 1.00 51.14 H new ATOM 0 HB2 LEU B 246 -3.853 -0.797 -2.922 1.00 21.42 H new ATOM 0 HB3 LEU B 246 -4.409 -1.705 -4.315 1.00 21.42 H new ATOM 0 HG LEU B 246 -5.136 0.498 -5.310 1.00 61.20 H new ATOM 0 HD11 LEU B 246 -4.012 2.451 -4.401 1.00 23.45 H new ATOM 0 HD12 LEU B 246 -5.149 1.746 -3.228 1.00 23.45 H new ATOM 0 HD13 LEU B 246 -3.400 1.471 -3.048 1.00 23.45 H new ATOM 0 HD21 LEU B 246 -2.847 1.007 -6.021 1.00 53.24 H new ATOM 0 HD22 LEU B 246 -2.209 0.009 -4.693 1.00 53.24 H new ATOM 0 HD23 LEU B 246 -3.146 -0.747 -6.003 1.00 53.24 H new ATOM 2341 N LEU B 247 -7.781 0.256 -3.943 1.00 2.04 N ATOM 2342 CA LEU B 247 -8.862 0.583 -4.825 1.00 2.34 C ATOM 2343 C LEU B 247 -8.439 1.682 -5.763 1.00 60.34 C ATOM 2344 O LEU B 247 -8.793 1.690 -6.933 1.00 12.12 O ATOM 2345 CB LEU B 247 -10.062 1.079 -4.027 1.00 55.45 C ATOM 2346 CG LEU B 247 -10.640 0.129 -2.989 1.00 34.42 C ATOM 2347 CD1 LEU B 247 -11.785 0.783 -2.295 1.00 61.10 C ATOM 2348 CD2 LEU B 247 -11.068 -1.190 -3.607 1.00 44.54 C ATOM 0 H LEU B 247 -7.623 0.945 -3.208 1.00 2.04 H new ATOM 0 HA LEU B 247 -9.131 -0.313 -5.384 1.00 2.34 H new ATOM 0 HB2 LEU B 247 -9.775 2.000 -3.521 1.00 55.45 H new ATOM 0 HB3 LEU B 247 -10.854 1.335 -4.730 1.00 55.45 H new ATOM 0 HG LEU B 247 -9.859 -0.098 -2.263 1.00 34.42 H new ATOM 0 HD11 LEU B 247 -12.198 0.101 -1.552 1.00 61.10 H new ATOM 0 HD12 LEU B 247 -11.440 1.692 -1.802 1.00 61.10 H new ATOM 0 HD13 LEU B 247 -12.556 1.035 -3.023 1.00 61.10 H new ATOM 0 HD21 LEU B 247 -11.475 -1.840 -2.832 1.00 44.54 H new ATOM 0 HD22 LEU B 247 -11.830 -1.007 -4.364 1.00 44.54 H new ATOM 0 HD23 LEU B 247 -10.206 -1.672 -4.069 1.00 44.54 H new ATOM 2360 N ILE B 248 -7.660 2.613 -5.245 1.00 10.24 N ATOM 2361 CA ILE B 248 -7.272 3.791 -6.013 1.00 65.44 C ATOM 2362 C ILE B 248 -5.819 4.071 -5.765 1.00 51.34 C ATOM 2363 O ILE B 248 -5.394 4.055 -4.635 1.00 25.04 O ATOM 2364 CB ILE B 248 -8.111 5.024 -5.549 1.00 31.11 C ATOM 2365 CG1 ILE B 248 -9.600 4.781 -5.801 1.00 64.40 C ATOM 2366 CG2 ILE B 248 -7.645 6.307 -6.222 1.00 53.44 C ATOM 2367 CD1 ILE B 248 -10.505 5.897 -5.358 1.00 54.24 C ATOM 0 H ILE B 248 -7.282 2.581 -4.298 1.00 10.24 H new ATOM 0 HA ILE B 248 -7.449 3.610 -7.073 1.00 65.44 H new ATOM 0 HB ILE B 248 -7.957 5.149 -4.477 1.00 31.11 H new ATOM 0 HG12 ILE B 248 -9.751 4.611 -6.867 1.00 64.40 H new ATOM 0 HG13 ILE B 248 -9.896 3.866 -5.288 1.00 64.40 H new ATOM 0 HG21 ILE B 248 -8.253 7.142 -5.874 1.00 53.44 H new ATOM 0 HG22 ILE B 248 -6.600 6.490 -5.972 1.00 53.44 H new ATOM 0 HG23 ILE B 248 -7.748 6.209 -7.303 1.00 53.44 H new ATOM 0 HD11 ILE B 248 -11.540 5.635 -5.577 1.00 54.24 H new ATOM 0 HD12 ILE B 248 -10.390 6.055 -4.286 1.00 54.24 H new ATOM 0 HD13 ILE B 248 -10.242 6.812 -5.890 1.00 54.24 H new ATOM 2379 N TYR B 249 -5.083 4.412 -6.787 1.00 11.12 N ATOM 2380 CA TYR B 249 -3.646 4.585 -6.621 1.00 62.32 C ATOM 2381 C TYR B 249 -3.165 5.986 -6.908 1.00 3.12 C ATOM 2382 O TYR B 249 -2.057 6.322 -6.581 1.00 20.10 O ATOM 2383 CB TYR B 249 -2.856 3.561 -7.438 1.00 15.24 C ATOM 2384 CG TYR B 249 -3.164 3.578 -8.905 1.00 31.14 C ATOM 2385 CD1 TYR B 249 -2.574 4.501 -9.750 1.00 20.14 C ATOM 2386 CD2 TYR B 249 -4.049 2.673 -9.442 1.00 11.51 C ATOM 2387 CE1 TYR B 249 -2.857 4.520 -11.086 1.00 24.13 C ATOM 2388 CE2 TYR B 249 -4.342 2.676 -10.773 1.00 64.34 C ATOM 2389 CZ TYR B 249 -3.743 3.601 -11.601 1.00 11.35 C ATOM 2390 OH TYR B 249 -4.036 3.617 -12.951 1.00 32.11 O ATOM 0 H TYR B 249 -5.435 4.575 -7.730 1.00 11.12 H new ATOM 0 HA TYR B 249 -3.455 4.408 -5.563 1.00 62.32 H new ATOM 0 HB2 TYR B 249 -1.791 3.746 -7.299 1.00 15.24 H new ATOM 0 HB3 TYR B 249 -3.060 2.564 -7.046 1.00 15.24 H new ATOM 0 HD1 TYR B 249 -1.877 5.220 -9.346 1.00 20.14 H new ATOM 0 HD2 TYR B 249 -4.521 1.946 -8.797 1.00 11.51 H new ATOM 0 HE1 TYR B 249 -2.390 5.249 -11.732 1.00 24.13 H new ATOM 0 HE2 TYR B 249 -5.040 1.957 -11.177 1.00 64.34 H new ATOM 0 HH TYR B 249 -4.677 2.904 -13.155 1.00 32.11 H new ATOM 2400 N ASP B 250 -3.979 6.787 -7.511 1.00 54.43 N ATOM 2401 CA ASP B 250 -3.575 8.151 -7.796 1.00 74.20 C ATOM 2402 C ASP B 250 -4.756 9.035 -7.621 1.00 1.00 C ATOM 2403 O ASP B 250 -5.401 9.375 -8.593 1.00 71.40 O ATOM 2404 CB ASP B 250 -3.009 8.295 -9.225 1.00 44.10 C ATOM 2405 CG ASP B 250 -2.469 9.684 -9.547 1.00 22.45 C ATOM 2406 OD1 ASP B 250 -3.253 10.557 -9.996 1.00 60.42 O ATOM 2407 OD2 ASP B 250 -1.256 9.908 -9.409 1.00 20.05 O ATOM 0 H ASP B 250 -4.919 6.539 -7.818 1.00 54.43 H new ATOM 0 HA ASP B 250 -2.779 8.435 -7.107 1.00 74.20 H new ATOM 0 HB2 ASP B 250 -2.210 7.566 -9.362 1.00 44.10 H new ATOM 0 HB3 ASP B 250 -3.793 8.047 -9.941 1.00 44.10 H new ATOM 2412 N ALA B 251 -5.111 9.268 -6.349 1.00 3.44 N ATOM 2413 CA ALA B 251 -6.239 10.137 -5.898 1.00 72.11 C ATOM 2414 C ALA B 251 -7.618 9.758 -6.476 1.00 43.22 C ATOM 2415 O ALA B 251 -8.534 9.418 -5.731 1.00 13.33 O ATOM 2416 CB ALA B 251 -5.944 11.615 -6.115 1.00 41.42 C ATOM 0 H ALA B 251 -4.610 8.847 -5.567 1.00 3.44 H new ATOM 0 HA ALA B 251 -6.311 9.950 -4.827 1.00 72.11 H new ATOM 0 HB1 ALA B 251 -6.791 12.209 -5.773 1.00 41.42 H new ATOM 0 HB2 ALA B 251 -5.054 11.895 -5.552 1.00 41.42 H new ATOM 0 HB3 ALA B 251 -5.776 11.800 -7.176 1.00 41.42 H new ATOM 2422 N SER B 252 -7.745 9.812 -7.784 1.00 52.22 N ATOM 2423 CA SER B 252 -8.987 9.534 -8.454 1.00 34.04 C ATOM 2424 C SER B 252 -8.870 8.288 -9.361 1.00 22.31 C ATOM 2425 O SER B 252 -9.874 7.773 -9.846 1.00 40.30 O ATOM 2426 CB SER B 252 -9.364 10.735 -9.316 1.00 63.22 C ATOM 2427 OG SER B 252 -9.342 11.949 -8.562 1.00 4.32 O ATOM 0 H SER B 252 -6.980 10.053 -8.414 1.00 52.22 H new ATOM 0 HA SER B 252 -9.749 9.342 -7.699 1.00 34.04 H new ATOM 0 HB2 SER B 252 -8.672 10.814 -10.155 1.00 63.22 H new ATOM 0 HB3 SER B 252 -10.358 10.585 -9.736 1.00 63.22 H new ATOM 0 HG SER B 252 -9.586 12.699 -9.143 1.00 4.32 H new ATOM 2433 N ASN B 253 -7.648 7.810 -9.585 1.00 22.11 N ATOM 2434 CA ASN B 253 -7.425 6.703 -10.517 1.00 45.20 C ATOM 2435 C ASN B 253 -7.642 5.342 -9.878 1.00 3.33 C ATOM 2436 O ASN B 253 -6.908 4.948 -8.956 1.00 34.10 O ATOM 2437 CB ASN B 253 -6.030 6.784 -11.141 1.00 4.33 C ATOM 2438 CG ASN B 253 -5.836 8.021 -12.009 1.00 22.23 C ATOM 2439 OD1 ASN B 253 -6.100 7.995 -13.207 1.00 32.01 O ATOM 2440 ND2 ASN B 253 -5.381 9.100 -11.427 1.00 62.41 N ATOM 0 H ASN B 253 -6.803 8.167 -9.139 1.00 22.11 H new ATOM 0 HA ASN B 253 -8.172 6.808 -11.304 1.00 45.20 H new ATOM 0 HB2 ASN B 253 -5.283 6.783 -10.348 1.00 4.33 H new ATOM 0 HB3 ASN B 253 -5.856 5.893 -11.744 1.00 4.33 H new ATOM 0 HD21 ASN B 253 -5.237 9.951 -11.971 1.00 62.41 H new ATOM 0 HD22 ASN B 253 -5.170 9.091 -10.429 1.00 62.41 H new ATOM 2447 N LEU B 254 -8.632 4.625 -10.391 1.00 22.34 N ATOM 2448 CA LEU B 254 -8.997 3.289 -9.916 1.00 12.41 C ATOM 2449 C LEU B 254 -7.987 2.251 -10.340 1.00 11.31 C ATOM 2450 O LEU B 254 -7.463 2.282 -11.465 1.00 70.43 O ATOM 2451 CB LEU B 254 -10.410 2.870 -10.401 1.00 23.33 C ATOM 2452 CG LEU B 254 -11.643 3.421 -9.649 1.00 50.40 C ATOM 2453 CD1 LEU B 254 -11.700 2.879 -8.241 1.00 11.02 C ATOM 2454 CD2 LEU B 254 -11.684 4.932 -9.630 1.00 54.11 C ATOM 0 H LEU B 254 -9.215 4.956 -11.160 1.00 22.34 H new ATOM 0 HA LEU B 254 -9.006 3.343 -8.827 1.00 12.41 H new ATOM 0 HB2 LEU B 254 -10.502 3.163 -11.447 1.00 23.33 H new ATOM 0 HB3 LEU B 254 -10.462 1.782 -10.369 1.00 23.33 H new ATOM 0 HG LEU B 254 -12.521 3.081 -10.198 1.00 50.40 H new ATOM 0 HD11 LEU B 254 -12.576 3.281 -7.732 1.00 11.02 H new ATOM 0 HD12 LEU B 254 -11.765 1.791 -8.272 1.00 11.02 H new ATOM 0 HD13 LEU B 254 -10.800 3.173 -7.701 1.00 11.02 H new ATOM 0 HD21 LEU B 254 -12.570 5.265 -9.089 1.00 54.11 H new ATOM 0 HD22 LEU B 254 -10.791 5.314 -9.134 1.00 54.11 H new ATOM 0 HD23 LEU B 254 -11.720 5.308 -10.652 1.00 54.11 H new ATOM 2466 N GLU B 255 -7.729 1.341 -9.443 1.00 31.02 N ATOM 2467 CA GLU B 255 -6.786 0.275 -9.632 1.00 63.54 C ATOM 2468 C GLU B 255 -7.444 -0.768 -10.555 1.00 24.32 C ATOM 2469 O GLU B 255 -8.687 -0.810 -10.672 1.00 52.32 O ATOM 2470 CB GLU B 255 -6.436 -0.268 -8.229 1.00 52.01 C ATOM 2471 CG GLU B 255 -5.136 -1.057 -8.071 1.00 43.31 C ATOM 2472 CD GLU B 255 -5.129 -2.435 -8.652 1.00 61.45 C ATOM 2473 OE1 GLU B 255 -5.576 -3.379 -7.972 1.00 72.33 O ATOM 2474 OE2 GLU B 255 -4.635 -2.606 -9.777 1.00 43.34 O ATOM 0 H GLU B 255 -8.184 1.320 -8.530 1.00 31.02 H new ATOM 0 HA GLU B 255 -5.857 0.585 -10.110 1.00 63.54 H new ATOM 0 HB2 GLU B 255 -6.399 0.578 -7.543 1.00 52.01 H new ATOM 0 HB3 GLU B 255 -7.257 -0.907 -7.903 1.00 52.01 H new ATOM 0 HG2 GLU B 255 -4.330 -0.486 -8.532 1.00 43.31 H new ATOM 0 HG3 GLU B 255 -4.907 -1.131 -7.008 1.00 43.31 H new ATOM 2481 N THR B 256 -6.649 -1.573 -11.208 1.00 4.03 N ATOM 2482 CA THR B 256 -7.137 -2.497 -12.188 1.00 74.12 C ATOM 2483 C THR B 256 -8.047 -3.573 -11.551 1.00 31.21 C ATOM 2484 O THR B 256 -7.640 -4.308 -10.653 1.00 33.13 O ATOM 2485 CB THR B 256 -5.946 -3.141 -12.928 1.00 41.25 C ATOM 2486 OG1 THR B 256 -5.116 -2.082 -13.470 1.00 1.45 O ATOM 2487 CG2 THR B 256 -6.427 -4.031 -14.072 1.00 25.03 C ATOM 0 H THR B 256 -5.639 -1.604 -11.072 1.00 4.03 H new ATOM 0 HA THR B 256 -7.748 -1.951 -12.907 1.00 74.12 H new ATOM 0 HB THR B 256 -5.384 -3.757 -12.226 1.00 41.25 H new ATOM 0 HG1 THR B 256 -4.352 -2.474 -13.943 1.00 1.45 H new ATOM 0 HG21 THR B 256 -5.567 -4.472 -14.576 1.00 25.03 H new ATOM 0 HG22 THR B 256 -7.061 -4.824 -13.674 1.00 25.03 H new ATOM 0 HG23 THR B 256 -6.997 -3.433 -14.783 1.00 25.03 H new ATOM 2495 N GLY B 257 -9.284 -3.630 -12.019 1.00 52.33 N ATOM 2496 CA GLY B 257 -10.226 -4.602 -11.517 1.00 22.41 C ATOM 2497 C GLY B 257 -11.183 -4.004 -10.509 1.00 42.31 C ATOM 2498 O GLY B 257 -12.165 -4.643 -10.112 1.00 34.12 O ATOM 0 H GLY B 257 -9.653 -3.014 -12.744 1.00 52.33 H new ATOM 0 HA2 GLY B 257 -10.792 -5.020 -12.349 1.00 22.41 H new ATOM 0 HA3 GLY B 257 -9.683 -5.427 -11.055 1.00 22.41 H new ATOM 2502 N VAL B 258 -10.909 -2.786 -10.090 1.00 14.03 N ATOM 2503 CA VAL B 258 -11.744 -2.109 -9.123 1.00 15.30 C ATOM 2504 C VAL B 258 -12.849 -1.323 -9.858 1.00 14.24 C ATOM 2505 O VAL B 258 -12.558 -0.489 -10.725 1.00 25.12 O ATOM 2506 CB VAL B 258 -10.902 -1.167 -8.222 1.00 54.12 C ATOM 2507 CG1 VAL B 258 -11.751 -0.561 -7.111 1.00 55.50 C ATOM 2508 CG2 VAL B 258 -9.719 -1.924 -7.639 1.00 3.23 C ATOM 0 H VAL B 258 -10.107 -2.242 -10.408 1.00 14.03 H new ATOM 0 HA VAL B 258 -12.207 -2.853 -8.475 1.00 15.30 H new ATOM 0 HB VAL B 258 -10.530 -0.348 -8.838 1.00 54.12 H new ATOM 0 HG11 VAL B 258 -11.133 0.094 -6.497 1.00 55.50 H new ATOM 0 HG12 VAL B 258 -12.566 0.015 -7.549 1.00 55.50 H new ATOM 0 HG13 VAL B 258 -12.162 -1.358 -6.491 1.00 55.50 H new ATOM 0 HG21 VAL B 258 -9.134 -1.255 -7.008 1.00 3.23 H new ATOM 0 HG22 VAL B 258 -10.081 -2.761 -7.042 1.00 3.23 H new ATOM 0 HG23 VAL B 258 -9.093 -2.300 -8.448 1.00 3.23 H new ATOM 2518 N PRO B 259 -14.124 -1.613 -9.539 1.00 41.22 N ATOM 2519 CA PRO B 259 -15.282 -0.998 -10.200 1.00 23.11 C ATOM 2520 C PRO B 259 -15.414 0.515 -9.982 1.00 30.42 C ATOM 2521 O PRO B 259 -14.988 1.061 -8.952 1.00 73.00 O ATOM 2522 CB PRO B 259 -16.482 -1.711 -9.595 1.00 32.21 C ATOM 2523 CG PRO B 259 -15.997 -2.296 -8.316 1.00 65.23 C ATOM 2524 CD PRO B 259 -14.537 -2.578 -8.501 1.00 70.04 C ATOM 0 HA PRO B 259 -15.188 -1.106 -11.281 1.00 23.11 H new ATOM 0 HB2 PRO B 259 -17.304 -1.017 -9.422 1.00 32.21 H new ATOM 0 HB3 PRO B 259 -16.855 -2.486 -10.264 1.00 32.21 H new ATOM 0 HG2 PRO B 259 -16.156 -1.605 -7.489 1.00 65.23 H new ATOM 0 HG3 PRO B 259 -16.541 -3.210 -8.077 1.00 65.23 H new ATOM 0 HD2 PRO B 259 -13.981 -2.433 -7.575 1.00 70.04 H new ATOM 0 HD3 PRO B 259 -14.365 -3.606 -8.819 1.00 70.04 H new ATOM 2532 N SER B 260 -16.051 1.166 -10.951 1.00 32.11 N ATOM 2533 CA SER B 260 -16.260 2.608 -10.982 1.00 43.12 C ATOM 2534 C SER B 260 -17.172 3.106 -9.848 1.00 73.54 C ATOM 2535 O SER B 260 -17.335 4.306 -9.666 1.00 15.41 O ATOM 2536 CB SER B 260 -16.837 2.996 -12.335 1.00 42.31 C ATOM 2537 OG SER B 260 -16.012 2.489 -13.375 1.00 23.25 O ATOM 0 H SER B 260 -16.448 0.689 -11.761 1.00 32.11 H new ATOM 0 HA SER B 260 -15.293 3.087 -10.829 1.00 43.12 H new ATOM 0 HB2 SER B 260 -17.848 2.601 -12.436 1.00 42.31 H new ATOM 0 HB3 SER B 260 -16.909 4.081 -12.412 1.00 42.31 H new ATOM 0 HG SER B 260 -16.389 2.740 -14.244 1.00 23.25 H new ATOM 2543 N ARG B 261 -17.761 2.181 -9.085 1.00 52.25 N ATOM 2544 CA ARG B 261 -18.555 2.561 -7.919 1.00 63.31 C ATOM 2545 C ARG B 261 -17.671 3.128 -6.825 1.00 52.55 C ATOM 2546 O ARG B 261 -18.162 3.717 -5.882 1.00 3.32 O ATOM 2547 CB ARG B 261 -19.409 1.409 -7.373 1.00 41.11 C ATOM 2548 CG ARG B 261 -18.668 0.119 -7.131 1.00 74.23 C ATOM 2549 CD ARG B 261 -19.527 -0.882 -6.375 1.00 33.30 C ATOM 2550 NE ARG B 261 -19.703 -0.492 -4.998 1.00 23.15 N ATOM 2551 CZ ARG B 261 -19.648 -1.325 -3.978 1.00 72.12 C ATOM 2552 NH1 ARG B 261 -19.481 -2.607 -4.182 1.00 11.12 N ATOM 2553 NH2 ARG B 261 -19.781 -0.868 -2.737 1.00 24.11 N ATOM 0 H ARG B 261 -17.703 1.177 -9.252 1.00 52.25 H new ATOM 0 HA ARG B 261 -19.246 3.333 -8.257 1.00 63.31 H new ATOM 0 HB2 ARG B 261 -19.865 1.729 -6.436 1.00 41.11 H new ATOM 0 HB3 ARG B 261 -20.222 1.217 -8.074 1.00 41.11 H new ATOM 0 HG2 ARG B 261 -18.361 -0.310 -8.085 1.00 74.23 H new ATOM 0 HG3 ARG B 261 -17.759 0.321 -6.565 1.00 74.23 H new ATOM 0 HD2 ARG B 261 -20.501 -0.966 -6.858 1.00 33.30 H new ATOM 0 HD3 ARG B 261 -19.063 -1.868 -6.419 1.00 33.30 H new ATOM 0 HE ARG B 261 -19.882 0.493 -4.800 1.00 23.15 H new ATOM 0 HH11 ARG B 261 -19.393 -2.965 -5.133 1.00 11.12 H new ATOM 0 HH12 ARG B 261 -19.439 -3.248 -3.390 1.00 11.12 H new ATOM 0 HH21 ARG B 261 -19.926 0.128 -2.573 1.00 24.11 H new ATOM 0 HH22 ARG B 261 -19.738 -1.514 -1.948 1.00 24.11 H new ATOM 2567 N PHE B 262 -16.377 2.928 -6.945 1.00 52.00 N ATOM 2568 CA PHE B 262 -15.438 3.543 -6.045 1.00 52.52 C ATOM 2569 C PHE B 262 -14.786 4.687 -6.796 1.00 34.25 C ATOM 2570 O PHE B 262 -14.535 4.569 -7.997 1.00 13.22 O ATOM 2571 CB PHE B 262 -14.364 2.544 -5.579 1.00 45.32 C ATOM 2572 CG PHE B 262 -14.893 1.337 -4.854 1.00 62.34 C ATOM 2573 CD1 PHE B 262 -15.158 1.382 -3.493 1.00 42.04 C ATOM 2574 CD2 PHE B 262 -15.117 0.155 -5.534 1.00 2.22 C ATOM 2575 CE1 PHE B 262 -15.636 0.267 -2.828 1.00 70.43 C ATOM 2576 CE2 PHE B 262 -15.594 -0.962 -4.873 1.00 52.54 C ATOM 2577 CZ PHE B 262 -15.853 -0.905 -3.519 1.00 13.13 C ATOM 0 H PHE B 262 -15.953 2.340 -7.663 1.00 52.00 H new ATOM 0 HA PHE B 262 -15.956 3.894 -5.153 1.00 52.52 H new ATOM 0 HB2 PHE B 262 -13.799 2.209 -6.449 1.00 45.32 H new ATOM 0 HB3 PHE B 262 -13.664 3.064 -4.925 1.00 45.32 H new ATOM 0 HD1 PHE B 262 -14.989 2.298 -2.946 1.00 42.04 H new ATOM 0 HD2 PHE B 262 -14.917 0.103 -6.594 1.00 2.22 H new ATOM 0 HE1 PHE B 262 -15.839 0.315 -1.768 1.00 70.43 H new ATOM 0 HE2 PHE B 262 -15.764 -1.879 -5.417 1.00 52.54 H new ATOM 0 HZ PHE B 262 -16.225 -1.777 -3.002 1.00 13.13 H new ATOM 2587 N SER B 263 -14.551 5.787 -6.128 1.00 13.41 N ATOM 2588 CA SER B 263 -13.917 6.928 -6.750 1.00 11.21 C ATOM 2589 C SER B 263 -13.401 7.882 -5.694 1.00 44.01 C ATOM 2590 O SER B 263 -13.914 7.907 -4.582 1.00 41.53 O ATOM 2591 CB SER B 263 -14.917 7.635 -7.686 1.00 61.41 C ATOM 2592 OG SER B 263 -16.118 7.975 -6.996 1.00 35.34 O ATOM 0 H SER B 263 -14.790 5.920 -5.145 1.00 13.41 H new ATOM 0 HA SER B 263 -13.068 6.587 -7.342 1.00 11.21 H new ATOM 0 HB2 SER B 263 -14.461 8.537 -8.094 1.00 61.41 H new ATOM 0 HB3 SER B 263 -15.151 6.986 -8.530 1.00 61.41 H new ATOM 0 HG SER B 263 -16.085 7.615 -6.085 1.00 35.34 H new ATOM 2598 N GLY B 264 -12.375 8.620 -6.012 1.00 33.02 N ATOM 2599 CA GLY B 264 -11.883 9.600 -5.106 1.00 52.41 C ATOM 2600 C GLY B 264 -11.655 10.877 -5.832 1.00 13.03 C ATOM 2601 O GLY B 264 -11.573 10.874 -7.053 1.00 62.34 O ATOM 0 H GLY B 264 -11.868 8.556 -6.895 1.00 33.02 H new ATOM 0 HA2 GLY B 264 -12.596 9.752 -4.296 1.00 52.41 H new ATOM 0 HA3 GLY B 264 -10.953 9.257 -4.652 1.00 52.41 H new ATOM 2605 N SER B 265 -11.633 11.958 -5.126 1.00 71.24 N ATOM 2606 CA SER B 265 -11.373 13.244 -5.706 1.00 44.31 C ATOM 2607 C SER B 265 -10.590 14.109 -4.721 1.00 1.33 C ATOM 2608 O SER B 265 -10.596 13.839 -3.510 1.00 42.45 O ATOM 2609 CB SER B 265 -12.693 13.907 -6.100 1.00 61.41 C ATOM 2610 OG SER B 265 -13.412 13.084 -7.017 1.00 3.24 O ATOM 0 H SER B 265 -11.796 11.979 -4.119 1.00 71.24 H new ATOM 0 HA SER B 265 -10.769 13.126 -6.605 1.00 44.31 H new ATOM 0 HB2 SER B 265 -13.297 14.084 -5.210 1.00 61.41 H new ATOM 0 HB3 SER B 265 -12.498 14.880 -6.551 1.00 61.41 H new ATOM 0 HG SER B 265 -14.255 13.522 -7.258 1.00 3.24 H new ATOM 2616 N GLY B 266 -9.922 15.115 -5.227 1.00 73.40 N ATOM 2617 CA GLY B 266 -9.157 15.997 -4.388 1.00 62.21 C ATOM 2618 C GLY B 266 -7.740 16.120 -4.878 1.00 61.54 C ATOM 2619 O GLY B 266 -7.271 15.271 -5.649 1.00 31.23 O ATOM 0 H GLY B 266 -9.894 15.343 -6.221 1.00 73.40 H new ATOM 0 HA2 GLY B 266 -9.625 16.981 -4.369 1.00 62.21 H new ATOM 0 HA3 GLY B 266 -9.159 15.623 -3.364 1.00 62.21 H new ATOM 2623 N SER B 267 -7.064 17.159 -4.455 1.00 54.31 N ATOM 2624 CA SER B 267 -5.695 17.401 -4.841 1.00 52.20 C ATOM 2625 C SER B 267 -5.030 18.391 -3.889 1.00 35.33 C ATOM 2626 O SER B 267 -5.417 19.558 -3.824 1.00 40.02 O ATOM 2627 CB SER B 267 -5.632 17.896 -6.296 1.00 24.40 C ATOM 2628 OG SER B 267 -6.495 19.015 -6.498 1.00 4.43 O ATOM 0 H SER B 267 -7.450 17.866 -3.829 1.00 54.31 H new ATOM 0 HA SER B 267 -5.143 16.463 -4.777 1.00 52.20 H new ATOM 0 HB2 SER B 267 -4.608 18.174 -6.544 1.00 24.40 H new ATOM 0 HB3 SER B 267 -5.916 17.088 -6.970 1.00 24.40 H new ATOM 0 HG SER B 267 -6.502 19.573 -5.692 1.00 4.43 H new ATOM 2634 N GLY B 268 -4.058 17.917 -3.148 1.00 22.45 N ATOM 2635 CA GLY B 268 -3.345 18.758 -2.234 1.00 4.33 C ATOM 2636 C GLY B 268 -3.284 18.181 -0.854 1.00 32.52 C ATOM 2637 O GLY B 268 -2.390 17.378 -0.545 1.00 70.31 O ATOM 0 H GLY B 268 -3.745 16.946 -3.165 1.00 22.45 H new ATOM 0 HA2 GLY B 268 -2.332 18.915 -2.604 1.00 4.33 H new ATOM 0 HA3 GLY B 268 -3.825 19.736 -2.195 1.00 4.33 H new ATOM 2641 N THR B 269 -4.224 18.575 -0.032 1.00 54.52 N ATOM 2642 CA THR B 269 -4.286 18.137 1.340 1.00 55.44 C ATOM 2643 C THR B 269 -5.633 17.486 1.702 1.00 44.22 C ATOM 2644 O THR B 269 -5.670 16.526 2.449 1.00 10.04 O ATOM 2645 CB THR B 269 -3.957 19.293 2.303 1.00 43.02 C ATOM 2646 OG1 THR B 269 -4.686 20.464 1.903 1.00 52.04 O ATOM 2647 CG2 THR B 269 -2.464 19.596 2.313 1.00 65.11 C ATOM 0 H THR B 269 -4.974 19.214 -0.298 1.00 54.52 H new ATOM 0 HA THR B 269 -3.527 17.362 1.452 1.00 55.44 H new ATOM 0 HB THR B 269 -4.248 18.997 3.311 1.00 43.02 H new ATOM 0 HG1 THR B 269 -4.481 21.202 2.514 1.00 52.04 H new ATOM 0 HG21 THR B 269 -2.264 20.416 3.002 1.00 65.11 H new ATOM 0 HG22 THR B 269 -1.915 18.711 2.634 1.00 65.11 H new ATOM 0 HG23 THR B 269 -2.143 19.878 1.310 1.00 65.11 H new ATOM 2655 N ASP B 270 -6.731 17.998 1.172 1.00 11.05 N ATOM 2656 CA ASP B 270 -8.039 17.397 1.457 1.00 3.54 C ATOM 2657 C ASP B 270 -8.448 16.489 0.328 1.00 14.13 C ATOM 2658 O ASP B 270 -8.334 16.857 -0.849 1.00 2.02 O ATOM 2659 CB ASP B 270 -9.124 18.459 1.691 1.00 42.45 C ATOM 2660 CG ASP B 270 -8.939 19.242 2.971 1.00 61.33 C ATOM 2661 OD1 ASP B 270 -8.173 20.227 2.985 1.00 15.21 O ATOM 2662 OD2 ASP B 270 -9.567 18.893 3.983 1.00 3.02 O ATOM 0 H ASP B 270 -6.753 18.810 0.555 1.00 11.05 H new ATOM 0 HA ASP B 270 -7.938 16.819 2.376 1.00 3.54 H new ATOM 0 HB2 ASP B 270 -9.130 19.151 0.849 1.00 42.45 H new ATOM 0 HB3 ASP B 270 -10.099 17.972 1.711 1.00 42.45 H new ATOM 2667 N PHE B 271 -8.919 15.310 0.666 1.00 70.23 N ATOM 2668 CA PHE B 271 -9.309 14.325 -0.327 1.00 62.12 C ATOM 2669 C PHE B 271 -10.608 13.678 0.052 1.00 22.25 C ATOM 2670 O PHE B 271 -10.867 13.449 1.228 1.00 64.30 O ATOM 2671 CB PHE B 271 -8.238 13.250 -0.477 1.00 44.23 C ATOM 2672 CG PHE B 271 -6.919 13.765 -0.952 1.00 13.35 C ATOM 2673 CD1 PHE B 271 -6.652 13.860 -2.303 1.00 70.24 C ATOM 2674 CD2 PHE B 271 -5.945 14.150 -0.050 1.00 2.22 C ATOM 2675 CE1 PHE B 271 -5.441 14.331 -2.746 1.00 12.43 C ATOM 2676 CE2 PHE B 271 -4.735 14.622 -0.488 1.00 5.21 C ATOM 2677 CZ PHE B 271 -4.482 14.713 -1.837 1.00 52.42 C ATOM 0 H PHE B 271 -9.044 15.004 1.631 1.00 70.23 H new ATOM 0 HA PHE B 271 -9.428 14.845 -1.278 1.00 62.12 H new ATOM 0 HB2 PHE B 271 -8.098 12.755 0.484 1.00 44.23 H new ATOM 0 HB3 PHE B 271 -8.594 12.493 -1.176 1.00 44.23 H new ATOM 0 HD1 PHE B 271 -7.403 13.561 -3.019 1.00 70.24 H new ATOM 0 HD2 PHE B 271 -6.139 14.078 1.010 1.00 2.22 H new ATOM 0 HE1 PHE B 271 -5.242 14.401 -3.805 1.00 12.43 H new ATOM 0 HE2 PHE B 271 -3.981 14.922 0.225 1.00 5.21 H new ATOM 0 HZ PHE B 271 -3.529 15.085 -2.183 1.00 52.42 H new ATOM 2687 N THR B 272 -11.397 13.354 -0.922 1.00 1.01 N ATOM 2688 CA THR B 272 -12.669 12.747 -0.675 1.00 5.33 C ATOM 2689 C THR B 272 -12.828 11.480 -1.488 1.00 71.20 C ATOM 2690 O THR B 272 -12.815 11.501 -2.709 1.00 61.43 O ATOM 2691 CB THR B 272 -13.833 13.719 -0.987 1.00 25.30 C ATOM 2692 OG1 THR B 272 -13.686 14.912 -0.196 1.00 13.15 O ATOM 2693 CG2 THR B 272 -15.181 13.076 -0.669 1.00 1.41 C ATOM 0 H THR B 272 -11.181 13.501 -1.908 1.00 1.01 H new ATOM 0 HA THR B 272 -12.706 12.497 0.385 1.00 5.33 H new ATOM 0 HB THR B 272 -13.801 13.962 -2.049 1.00 25.30 H new ATOM 0 HG1 THR B 272 -14.421 15.529 -0.394 1.00 13.15 H new ATOM 0 HG21 THR B 272 -15.982 13.779 -0.897 1.00 1.41 H new ATOM 0 HG22 THR B 272 -15.306 12.176 -1.271 1.00 1.41 H new ATOM 0 HG23 THR B 272 -15.218 12.813 0.388 1.00 1.41 H new ATOM 2701 N PHE B 273 -12.937 10.404 -0.795 1.00 35.32 N ATOM 2702 CA PHE B 273 -13.202 9.127 -1.362 1.00 74.03 C ATOM 2703 C PHE B 273 -14.678 8.913 -1.289 1.00 13.52 C ATOM 2704 O PHE B 273 -15.280 9.040 -0.216 1.00 14.23 O ATOM 2705 CB PHE B 273 -12.464 8.063 -0.573 1.00 41.22 C ATOM 2706 CG PHE B 273 -12.783 6.655 -0.937 1.00 74.32 C ATOM 2707 CD1 PHE B 273 -12.327 6.082 -2.112 1.00 33.21 C ATOM 2708 CD2 PHE B 273 -13.533 5.900 -0.081 1.00 11.43 C ATOM 2709 CE1 PHE B 273 -12.635 4.770 -2.410 1.00 33.31 C ATOM 2710 CE2 PHE B 273 -13.843 4.608 -0.362 1.00 53.12 C ATOM 2711 CZ PHE B 273 -13.397 4.034 -1.527 1.00 61.13 C ATOM 0 H PHE B 273 -12.841 10.386 0.220 1.00 35.32 H new ATOM 0 HA PHE B 273 -12.865 9.070 -2.397 1.00 74.03 H new ATOM 0 HB2 PHE B 273 -11.393 8.219 -0.701 1.00 41.22 H new ATOM 0 HB3 PHE B 273 -12.682 8.204 0.486 1.00 41.22 H new ATOM 0 HD1 PHE B 273 -11.728 6.663 -2.798 1.00 33.21 H new ATOM 0 HD2 PHE B 273 -13.887 6.340 0.839 1.00 11.43 H new ATOM 0 HE1 PHE B 273 -12.282 4.323 -3.328 1.00 33.31 H new ATOM 0 HE2 PHE B 273 -14.440 4.033 0.330 1.00 53.12 H new ATOM 0 HZ PHE B 273 -13.643 3.007 -1.752 1.00 61.13 H new ATOM 2721 N THR B 274 -15.265 8.627 -2.379 1.00 35.24 N ATOM 2722 CA THR B 274 -16.648 8.485 -2.410 1.00 25.11 C ATOM 2723 C THR B 274 -17.044 7.196 -3.140 1.00 63.14 C ATOM 2724 O THR B 274 -16.557 6.895 -4.251 1.00 44.14 O ATOM 2725 CB THR B 274 -17.305 9.758 -3.022 1.00 72.34 C ATOM 2726 OG1 THR B 274 -18.706 9.706 -2.898 1.00 2.04 O ATOM 2727 CG2 THR B 274 -16.937 9.936 -4.485 1.00 24.11 C ATOM 0 H THR B 274 -14.795 8.486 -3.273 1.00 35.24 H new ATOM 0 HA THR B 274 -17.026 8.390 -1.392 1.00 25.11 H new ATOM 0 HB THR B 274 -16.921 10.612 -2.463 1.00 72.34 H new ATOM 0 HG1 THR B 274 -18.944 9.249 -2.065 1.00 2.04 H new ATOM 0 HG21 THR B 274 -17.415 10.835 -4.874 1.00 24.11 H new ATOM 0 HG22 THR B 274 -15.855 10.031 -4.579 1.00 24.11 H new ATOM 0 HG23 THR B 274 -17.276 9.070 -5.053 1.00 24.11 H new ATOM 2735 N ILE B 275 -17.872 6.417 -2.505 1.00 25.02 N ATOM 2736 CA ILE B 275 -18.345 5.209 -3.096 1.00 4.34 C ATOM 2737 C ILE B 275 -19.751 5.487 -3.593 1.00 64.50 C ATOM 2738 O ILE B 275 -20.642 5.690 -2.803 1.00 51.40 O ATOM 2739 CB ILE B 275 -18.360 4.059 -2.052 1.00 5.42 C ATOM 2740 CG1 ILE B 275 -16.979 3.882 -1.435 1.00 55.11 C ATOM 2741 CG2 ILE B 275 -18.805 2.765 -2.679 1.00 34.22 C ATOM 2742 CD1 ILE B 275 -16.910 2.786 -0.390 1.00 41.23 C ATOM 0 H ILE B 275 -18.233 6.604 -1.570 1.00 25.02 H new ATOM 0 HA ILE B 275 -17.694 4.897 -3.913 1.00 4.34 H new ATOM 0 HB ILE B 275 -19.070 4.328 -1.270 1.00 5.42 H new ATOM 0 HG12 ILE B 275 -16.263 3.661 -2.227 1.00 55.11 H new ATOM 0 HG13 ILE B 275 -16.671 4.824 -0.981 1.00 55.11 H new ATOM 0 HG21 ILE B 275 -18.806 1.977 -1.926 1.00 34.22 H new ATOM 0 HG22 ILE B 275 -19.811 2.883 -3.082 1.00 34.22 H new ATOM 0 HG23 ILE B 275 -18.121 2.496 -3.484 1.00 34.22 H new ATOM 0 HD11 ILE B 275 -15.895 2.721 0.003 1.00 41.23 H new ATOM 0 HD12 ILE B 275 -17.600 3.014 0.423 1.00 41.23 H new ATOM 0 HD13 ILE B 275 -17.185 1.834 -0.843 1.00 41.23 H new ATOM 2754 N SER B 276 -19.924 5.486 -4.894 1.00 23.21 N ATOM 2755 CA SER B 276 -21.180 5.855 -5.516 1.00 34.54 C ATOM 2756 C SER B 276 -22.256 4.804 -5.270 1.00 12.51 C ATOM 2757 O SER B 276 -23.400 5.131 -4.971 1.00 52.20 O ATOM 2758 CB SER B 276 -20.949 6.054 -7.021 1.00 45.54 C ATOM 2759 OG SER B 276 -22.143 6.397 -7.713 1.00 70.33 O ATOM 0 H SER B 276 -19.194 5.228 -5.558 1.00 23.21 H new ATOM 0 HA SER B 276 -21.535 6.785 -5.071 1.00 34.54 H new ATOM 0 HB2 SER B 276 -20.207 6.839 -7.171 1.00 45.54 H new ATOM 0 HB3 SER B 276 -20.536 5.139 -7.446 1.00 45.54 H new ATOM 0 HG SER B 276 -21.947 6.515 -8.666 1.00 70.33 H new ATOM 2765 N SER B 277 -21.884 3.570 -5.383 1.00 64.35 N ATOM 2766 CA SER B 277 -22.790 2.498 -5.152 1.00 42.51 C ATOM 2767 C SER B 277 -22.300 1.724 -3.958 1.00 63.12 C ATOM 2768 O SER B 277 -21.122 1.446 -3.874 1.00 55.24 O ATOM 2769 CB SER B 277 -22.853 1.615 -6.388 1.00 50.35 C ATOM 2770 OG SER B 277 -23.223 2.380 -7.525 1.00 71.32 O ATOM 0 H SER B 277 -20.940 3.279 -5.639 1.00 64.35 H new ATOM 0 HA SER B 277 -23.795 2.871 -4.953 1.00 42.51 H new ATOM 0 HB2 SER B 277 -21.884 1.146 -6.557 1.00 50.35 H new ATOM 0 HB3 SER B 277 -23.573 0.812 -6.232 1.00 50.35 H new ATOM 0 HG SER B 277 -23.258 1.799 -8.313 1.00 71.32 H new ATOM 2776 N LEU B 278 -23.154 1.387 -3.040 1.00 44.51 N ATOM 2777 CA LEU B 278 -22.704 0.682 -1.858 1.00 52.22 C ATOM 2778 C LEU B 278 -23.423 -0.650 -1.709 1.00 25.23 C ATOM 2779 O LEU B 278 -24.645 -0.693 -1.693 1.00 0.13 O ATOM 2780 CB LEU B 278 -22.904 1.563 -0.618 1.00 12.10 C ATOM 2781 CG LEU B 278 -22.381 1.010 0.709 1.00 43.14 C ATOM 2782 CD1 LEU B 278 -20.879 0.766 0.628 1.00 0.32 C ATOM 2783 CD2 LEU B 278 -22.697 1.975 1.837 1.00 45.13 C ATOM 0 H LEU B 278 -24.155 1.581 -3.076 1.00 44.51 H new ATOM 0 HA LEU B 278 -21.641 0.466 -1.963 1.00 52.22 H new ATOM 0 HB2 LEU B 278 -22.421 2.523 -0.801 1.00 12.10 H new ATOM 0 HB3 LEU B 278 -23.971 1.759 -0.508 1.00 12.10 H new ATOM 0 HG LEU B 278 -22.875 0.060 0.910 1.00 43.14 H new ATOM 0 HD11 LEU B 278 -20.522 0.373 1.580 1.00 0.32 H new ATOM 0 HD12 LEU B 278 -20.669 0.046 -0.163 1.00 0.32 H new ATOM 0 HD13 LEU B 278 -20.369 1.704 0.409 1.00 0.32 H new ATOM 0 HD21 LEU B 278 -22.320 1.572 2.777 1.00 45.13 H new ATOM 0 HD22 LEU B 278 -22.222 2.936 1.638 1.00 45.13 H new ATOM 0 HD23 LEU B 278 -23.776 2.112 1.907 1.00 45.13 H new ATOM 2795 N GLN B 279 -22.648 -1.728 -1.625 1.00 63.25 N ATOM 2796 CA GLN B 279 -23.182 -3.076 -1.453 1.00 54.00 C ATOM 2797 C GLN B 279 -22.827 -3.626 -0.054 1.00 75.11 C ATOM 2798 O GLN B 279 -21.810 -3.231 0.525 1.00 73.23 O ATOM 2799 CB GLN B 279 -22.627 -4.006 -2.538 1.00 34.21 C ATOM 2800 CG GLN B 279 -22.972 -3.586 -3.950 1.00 10.54 C ATOM 2801 CD GLN B 279 -24.462 -3.567 -4.201 1.00 22.20 C ATOM 2802 OE1 GLN B 279 -25.224 -4.342 -3.618 1.00 41.34 O ATOM 2803 NE2 GLN B 279 -24.888 -2.688 -5.047 1.00 55.32 N ATOM 0 H GLN B 279 -21.630 -1.691 -1.674 1.00 63.25 H new ATOM 0 HA GLN B 279 -24.267 -3.031 -1.544 1.00 54.00 H new ATOM 0 HB2 GLN B 279 -21.542 -4.054 -2.440 1.00 34.21 H new ATOM 0 HB3 GLN B 279 -23.007 -5.013 -2.367 1.00 34.21 H new ATOM 0 HG2 GLN B 279 -22.562 -2.594 -4.141 1.00 10.54 H new ATOM 0 HG3 GLN B 279 -22.497 -4.268 -4.655 1.00 10.54 H new ATOM 0 HE21 GLN B 279 -24.227 -2.064 -5.510 1.00 55.32 H new ATOM 0 HE22 GLN B 279 -25.885 -2.618 -5.252 1.00 55.32 H new ATOM 2812 N PRO B 280 -23.665 -4.547 0.495 1.00 33.52 N ATOM 2813 CA PRO B 280 -23.492 -5.136 1.853 1.00 44.24 C ATOM 2814 C PRO B 280 -22.144 -5.819 2.091 1.00 11.32 C ATOM 2815 O PRO B 280 -21.635 -5.830 3.207 1.00 13.44 O ATOM 2816 CB PRO B 280 -24.620 -6.168 1.939 1.00 40.44 C ATOM 2817 CG PRO B 280 -25.639 -5.687 0.979 1.00 3.04 C ATOM 2818 CD PRO B 280 -24.876 -5.085 -0.158 1.00 73.14 C ATOM 0 HA PRO B 280 -23.523 -4.352 2.609 1.00 44.24 H new ATOM 0 HB2 PRO B 280 -24.266 -7.165 1.676 1.00 40.44 H new ATOM 0 HB3 PRO B 280 -25.025 -6.230 2.949 1.00 40.44 H new ATOM 0 HG2 PRO B 280 -26.270 -6.507 0.636 1.00 3.04 H new ATOM 0 HG3 PRO B 280 -26.296 -4.951 1.442 1.00 3.04 H new ATOM 0 HD2 PRO B 280 -24.628 -5.829 -0.915 1.00 73.14 H new ATOM 0 HD3 PRO B 280 -25.447 -4.301 -0.656 1.00 73.14 H new ATOM 2826 N GLU B 281 -21.571 -6.382 1.056 1.00 73.32 N ATOM 2827 CA GLU B 281 -20.321 -7.126 1.192 1.00 63.44 C ATOM 2828 C GLU B 281 -19.090 -6.210 1.220 1.00 71.14 C ATOM 2829 O GLU B 281 -17.954 -6.677 1.403 1.00 24.52 O ATOM 2830 CB GLU B 281 -20.213 -8.166 0.082 1.00 30.33 C ATOM 2831 CG GLU B 281 -21.332 -9.195 0.128 1.00 33.42 C ATOM 2832 CD GLU B 281 -21.321 -10.150 -1.034 1.00 4.43 C ATOM 2833 OE1 GLU B 281 -20.608 -11.161 -0.990 1.00 14.50 O ATOM 2834 OE2 GLU B 281 -22.057 -9.909 -2.014 1.00 52.33 O ATOM 0 H GLU B 281 -21.942 -6.345 0.106 1.00 73.32 H new ATOM 0 HA GLU B 281 -20.342 -7.635 2.156 1.00 63.44 H new ATOM 0 HB2 GLU B 281 -20.228 -7.662 -0.884 1.00 30.33 H new ATOM 0 HB3 GLU B 281 -19.253 -8.676 0.160 1.00 30.33 H new ATOM 0 HG2 GLU B 281 -21.254 -9.763 1.055 1.00 33.42 H new ATOM 0 HG3 GLU B 281 -22.290 -8.676 0.152 1.00 33.42 H new ATOM 2841 N ASP B 282 -19.312 -4.920 1.085 1.00 75.21 N ATOM 2842 CA ASP B 282 -18.214 -3.953 1.041 1.00 24.12 C ATOM 2843 C ASP B 282 -18.028 -3.267 2.363 1.00 70.43 C ATOM 2844 O ASP B 282 -17.405 -2.205 2.445 1.00 2.52 O ATOM 2845 CB ASP B 282 -18.449 -2.924 -0.046 1.00 33.11 C ATOM 2846 CG ASP B 282 -18.488 -3.542 -1.403 1.00 15.01 C ATOM 2847 OD1 ASP B 282 -17.433 -3.744 -2.020 1.00 73.02 O ATOM 2848 OD2 ASP B 282 -19.592 -3.823 -1.887 1.00 43.53 O ATOM 0 H ASP B 282 -20.241 -4.507 1.003 1.00 75.21 H new ATOM 0 HA ASP B 282 -17.303 -4.507 0.816 1.00 24.12 H new ATOM 0 HB2 ASP B 282 -19.389 -2.405 0.143 1.00 33.11 H new ATOM 0 HB3 ASP B 282 -17.659 -2.174 -0.012 1.00 33.11 H new ATOM 2853 N ILE B 283 -18.550 -3.868 3.396 1.00 45.21 N ATOM 2854 CA ILE B 283 -18.370 -3.361 4.734 1.00 20.04 C ATOM 2855 C ILE B 283 -16.952 -3.683 5.182 1.00 1.43 C ATOM 2856 O ILE B 283 -16.611 -4.852 5.439 1.00 24.55 O ATOM 2857 CB ILE B 283 -19.419 -3.971 5.709 1.00 71.12 C ATOM 2858 CG1 ILE B 283 -20.833 -3.626 5.246 1.00 63.53 C ATOM 2859 CG2 ILE B 283 -19.204 -3.509 7.136 1.00 65.23 C ATOM 2860 CD1 ILE B 283 -21.078 -2.153 5.113 1.00 74.41 C ATOM 0 H ILE B 283 -19.110 -4.719 3.338 1.00 45.21 H new ATOM 0 HA ILE B 283 -18.521 -2.281 4.742 1.00 20.04 H new ATOM 0 HB ILE B 283 -19.290 -5.053 5.695 1.00 71.12 H new ATOM 0 HG12 ILE B 283 -21.019 -4.105 4.285 1.00 63.53 H new ATOM 0 HG13 ILE B 283 -21.550 -4.043 5.953 1.00 63.53 H new ATOM 0 HG21 ILE B 283 -19.958 -3.959 7.782 1.00 65.23 H new ATOM 0 HG22 ILE B 283 -18.212 -3.812 7.471 1.00 65.23 H new ATOM 0 HG23 ILE B 283 -19.287 -2.423 7.183 1.00 65.23 H new ATOM 0 HD11 ILE B 283 -22.102 -1.983 4.781 1.00 74.41 H new ATOM 0 HD12 ILE B 283 -20.925 -1.670 6.078 1.00 74.41 H new ATOM 0 HD13 ILE B 283 -20.385 -1.733 4.383 1.00 74.41 H new ATOM 2872 N ALA B 284 -16.123 -2.670 5.214 1.00 71.01 N ATOM 2873 CA ALA B 284 -14.733 -2.820 5.538 1.00 64.13 C ATOM 2874 C ALA B 284 -14.176 -1.506 6.060 1.00 55.21 C ATOM 2875 O ALA B 284 -14.903 -0.507 6.144 1.00 31.43 O ATOM 2876 CB ALA B 284 -13.972 -3.256 4.295 1.00 1.32 C ATOM 0 H ALA B 284 -16.401 -1.709 5.013 1.00 71.01 H new ATOM 0 HA ALA B 284 -14.620 -3.577 6.314 1.00 64.13 H new ATOM 0 HB1 ALA B 284 -12.915 -3.371 4.537 1.00 1.32 H new ATOM 0 HB2 ALA B 284 -14.369 -4.207 3.940 1.00 1.32 H new ATOM 0 HB3 ALA B 284 -14.086 -2.502 3.516 1.00 1.32 H new ATOM 2882 N THR B 285 -12.912 -1.498 6.406 1.00 14.00 N ATOM 2883 CA THR B 285 -12.272 -0.310 6.886 1.00 64.12 C ATOM 2884 C THR B 285 -11.477 0.344 5.741 1.00 75.11 C ATOM 2885 O THR B 285 -10.530 -0.241 5.210 1.00 52.51 O ATOM 2886 CB THR B 285 -11.332 -0.641 8.059 1.00 51.41 C ATOM 2887 OG1 THR B 285 -12.058 -1.366 9.061 1.00 11.40 O ATOM 2888 CG2 THR B 285 -10.780 0.632 8.681 1.00 3.22 C ATOM 0 H THR B 285 -12.304 -2.316 6.361 1.00 14.00 H new ATOM 0 HA THR B 285 -13.034 0.384 7.241 1.00 64.12 H new ATOM 0 HB THR B 285 -10.505 -1.241 7.680 1.00 51.41 H new ATOM 0 HG1 THR B 285 -11.460 -1.579 9.808 1.00 11.40 H new ATOM 0 HG21 THR B 285 -10.118 0.375 9.508 1.00 3.22 H new ATOM 0 HG22 THR B 285 -10.222 1.192 7.930 1.00 3.22 H new ATOM 0 HG23 THR B 285 -11.603 1.243 9.051 1.00 3.22 H new ATOM 2896 N TYR B 286 -11.847 1.542 5.390 1.00 73.52 N ATOM 2897 CA TYR B 286 -11.251 2.246 4.273 1.00 74.13 C ATOM 2898 C TYR B 286 -10.274 3.289 4.748 1.00 13.24 C ATOM 2899 O TYR B 286 -10.570 4.076 5.633 1.00 3.21 O ATOM 2900 CB TYR B 286 -12.344 2.854 3.390 1.00 44.51 C ATOM 2901 CG TYR B 286 -13.185 1.800 2.703 1.00 44.15 C ATOM 2902 CD1 TYR B 286 -14.306 1.221 3.321 1.00 44.21 C ATOM 2903 CD2 TYR B 286 -12.837 1.348 1.445 1.00 1.12 C ATOM 2904 CE1 TYR B 286 -15.019 0.241 2.690 1.00 54.32 C ATOM 2905 CE2 TYR B 286 -13.565 0.373 0.818 1.00 30.43 C ATOM 2906 CZ TYR B 286 -14.649 -0.179 1.443 1.00 5.41 C ATOM 2907 OH TYR B 286 -15.364 -1.157 0.817 1.00 71.34 O ATOM 0 H TYR B 286 -12.577 2.069 5.870 1.00 73.52 H new ATOM 0 HA TYR B 286 -10.688 1.533 3.671 1.00 74.13 H new ATOM 0 HB2 TYR B 286 -12.988 3.488 3.999 1.00 44.51 H new ATOM 0 HB3 TYR B 286 -11.884 3.495 2.638 1.00 44.51 H new ATOM 0 HD1 TYR B 286 -14.607 1.553 4.304 1.00 44.21 H new ATOM 0 HD2 TYR B 286 -11.976 1.771 0.948 1.00 1.12 H new ATOM 0 HE1 TYR B 286 -15.875 -0.202 3.177 1.00 54.32 H new ATOM 0 HE2 TYR B 286 -13.283 0.040 -0.170 1.00 30.43 H new ATOM 0 HH TYR B 286 -16.062 -1.489 1.420 1.00 71.34 H new ATOM 2917 N HIS B 287 -9.097 3.273 4.171 1.00 3.24 N ATOM 2918 CA HIS B 287 -8.031 4.181 4.561 1.00 14.24 C ATOM 2919 C HIS B 287 -7.128 4.576 3.449 1.00 62.54 C ATOM 2920 O HIS B 287 -6.861 3.802 2.525 1.00 63.33 O ATOM 2921 CB HIS B 287 -7.229 3.724 5.803 1.00 43.32 C ATOM 2922 CG HIS B 287 -6.979 2.264 5.914 1.00 0.00 C ATOM 2923 ND1 HIS B 287 -6.383 1.381 5.079 1.00 35.44 N flip ATOM 2924 CD2 HIS B 287 -7.368 1.546 7.016 1.00 71.41 C flip ATOM 2925 CE1 HIS B 287 -6.436 0.154 5.699 1.00 33.33 C flip ATOM 2926 NE2 HIS B 287 -7.041 0.296 6.866 1.00 15.41 N flip ATOM 0 H HIS B 287 -8.845 2.633 3.418 1.00 3.24 H new ATOM 0 HA HIS B 287 -8.571 5.081 4.855 1.00 14.24 H new ATOM 0 HB2 HIS B 287 -6.268 4.238 5.800 1.00 43.32 H new ATOM 0 HB3 HIS B 287 -7.762 4.050 6.696 1.00 43.32 H new ATOM 0 HD1 HIS B 287 -5.974 1.586 4.167 1.00 35.44 H new ATOM 0 HD2 HIS B 287 -7.871 1.957 7.879 1.00 71.41 H new ATOM 0 HE1 HIS B 287 -6.048 -0.771 5.299 1.00 33.33 H new ATOM 2935 N CYS B 288 -6.669 5.770 3.569 1.00 24.02 N ATOM 2936 CA CYS B 288 -5.808 6.416 2.638 1.00 31.32 C ATOM 2937 C CYS B 288 -4.354 6.291 3.074 1.00 45.44 C ATOM 2938 O CYS B 288 -4.068 6.307 4.264 1.00 11.40 O ATOM 2939 CB CYS B 288 -6.219 7.897 2.609 1.00 12.22 C ATOM 2940 SG CYS B 288 -6.531 8.598 4.288 1.00 70.51 S ATOM 0 H CYS B 288 -6.898 6.360 4.369 1.00 24.02 H new ATOM 0 HA CYS B 288 -5.896 5.959 1.652 1.00 31.32 H new ATOM 0 HB2 CYS B 288 -5.435 8.476 2.121 1.00 12.22 H new ATOM 0 HB3 CYS B 288 -7.119 8.006 2.004 1.00 12.22 H new ATOM 2945 N GLN B 289 -3.460 6.115 2.136 1.00 64.41 N ATOM 2946 CA GLN B 289 -2.048 6.179 2.439 1.00 44.34 C ATOM 2947 C GLN B 289 -1.422 7.163 1.482 1.00 71.22 C ATOM 2948 O GLN B 289 -1.822 7.234 0.304 1.00 22.21 O ATOM 2949 CB GLN B 289 -1.316 4.822 2.346 1.00 32.42 C ATOM 2950 CG GLN B 289 -1.172 4.264 0.949 1.00 40.32 C ATOM 2951 CD GLN B 289 -0.180 3.127 0.856 1.00 31.21 C ATOM 2952 OE1 GLN B 289 -0.519 1.982 1.000 1.00 3.20 O ATOM 2953 NE2 GLN B 289 1.059 3.456 0.614 1.00 50.32 N ATOM 0 H GLN B 289 -3.680 5.927 1.158 1.00 64.41 H new ATOM 0 HA GLN B 289 -1.947 6.490 3.479 1.00 44.34 H new ATOM 0 HB2 GLN B 289 -0.322 4.933 2.780 1.00 32.42 H new ATOM 0 HB3 GLN B 289 -1.852 4.095 2.957 1.00 32.42 H new ATOM 0 HG2 GLN B 289 -2.145 3.916 0.602 1.00 40.32 H new ATOM 0 HG3 GLN B 289 -0.861 5.064 0.277 1.00 40.32 H new ATOM 0 HE21 GLN B 289 1.313 4.437 0.497 1.00 50.32 H new ATOM 0 HE22 GLN B 289 1.774 2.732 0.542 1.00 50.32 H new ATOM 2962 N GLN B 290 -0.505 7.942 1.955 1.00 74.54 N ATOM 2963 CA GLN B 290 0.144 8.891 1.095 1.00 3.33 C ATOM 2964 C GLN B 290 1.447 8.332 0.609 1.00 60.04 C ATOM 2965 O GLN B 290 2.029 7.459 1.258 1.00 0.25 O ATOM 2966 CB GLN B 290 0.308 10.270 1.776 1.00 12.44 C ATOM 2967 CG GLN B 290 1.178 10.345 3.047 1.00 2.32 C ATOM 2968 CD GLN B 290 2.683 10.211 2.802 1.00 60.22 C ATOM 2969 OE1 GLN B 290 3.196 10.579 1.734 1.00 1.03 O ATOM 2970 NE2 GLN B 290 3.398 9.737 3.792 1.00 52.30 N ATOM 0 H GLN B 290 -0.186 7.945 2.924 1.00 74.54 H new ATOM 0 HA GLN B 290 -0.492 9.064 0.227 1.00 3.33 H new ATOM 0 HB2 GLN B 290 0.727 10.958 1.042 1.00 12.44 H new ATOM 0 HB3 GLN B 290 -0.686 10.639 2.028 1.00 12.44 H new ATOM 0 HG2 GLN B 290 0.988 11.296 3.545 1.00 2.32 H new ATOM 0 HG3 GLN B 290 0.864 9.558 3.733 1.00 2.32 H new ATOM 0 HE21 GLN B 290 2.942 9.444 4.656 1.00 52.30 H new ATOM 0 HE22 GLN B 290 4.411 9.661 3.699 1.00 52.30 H new ATOM 2979 N TYR B 291 1.897 8.790 -0.521 1.00 22.13 N ATOM 2980 CA TYR B 291 3.152 8.324 -1.029 1.00 31.31 C ATOM 2981 C TYR B 291 3.970 9.451 -1.630 1.00 30.34 C ATOM 2982 O TYR B 291 4.799 9.229 -2.502 1.00 52.15 O ATOM 2983 CB TYR B 291 2.977 7.152 -2.018 1.00 53.14 C ATOM 2984 CG TYR B 291 2.206 7.445 -3.292 1.00 61.13 C ATOM 2985 CD1 TYR B 291 0.837 7.319 -3.341 1.00 31.12 C ATOM 2986 CD2 TYR B 291 2.864 7.830 -4.451 1.00 54.14 C ATOM 2987 CE1 TYR B 291 0.147 7.572 -4.503 1.00 71.12 C ATOM 2988 CE2 TYR B 291 2.183 8.081 -5.610 1.00 4.30 C ATOM 2989 CZ TYR B 291 0.825 7.953 -5.632 1.00 4.22 C ATOM 2990 OH TYR B 291 0.134 8.226 -6.778 1.00 44.31 O ATOM 0 H TYR B 291 1.420 9.478 -1.103 1.00 22.13 H new ATOM 0 HA TYR B 291 3.714 7.938 -0.178 1.00 31.31 H new ATOM 0 HB2 TYR B 291 3.967 6.790 -2.295 1.00 53.14 H new ATOM 0 HB3 TYR B 291 2.474 6.338 -1.496 1.00 53.14 H new ATOM 0 HD1 TYR B 291 0.297 7.017 -2.455 1.00 31.12 H new ATOM 0 HD2 TYR B 291 3.939 7.934 -4.438 1.00 54.14 H new ATOM 0 HE1 TYR B 291 -0.928 7.471 -4.526 1.00 71.12 H new ATOM 0 HE2 TYR B 291 2.716 8.378 -6.501 1.00 4.30 H new ATOM 0 HH TYR B 291 -0.648 7.638 -6.836 1.00 44.31 H new ATOM 3000 N ASP B 292 3.801 10.649 -1.114 1.00 63.31 N ATOM 3001 CA ASP B 292 4.573 11.769 -1.637 1.00 13.32 C ATOM 3002 C ASP B 292 5.934 11.863 -0.959 1.00 1.24 C ATOM 3003 O ASP B 292 6.943 12.164 -1.608 1.00 3.21 O ATOM 3004 CB ASP B 292 3.819 13.113 -1.579 1.00 13.54 C ATOM 3005 CG ASP B 292 4.657 14.251 -2.150 1.00 11.25 C ATOM 3006 OD1 ASP B 292 4.826 14.303 -3.381 1.00 72.11 O ATOM 3007 OD2 ASP B 292 5.181 15.093 -1.377 1.00 23.52 O ATOM 0 H ASP B 292 3.158 10.876 -0.356 1.00 63.31 H new ATOM 0 HA ASP B 292 4.731 11.562 -2.695 1.00 13.32 H new ATOM 0 HB2 ASP B 292 2.886 13.032 -2.137 1.00 13.54 H new ATOM 0 HB3 ASP B 292 3.554 13.338 -0.546 1.00 13.54 H new ATOM 3012 N ASN B 293 5.984 11.574 0.329 1.00 72.35 N ATOM 3013 CA ASN B 293 7.253 11.636 1.062 1.00 13.15 C ATOM 3014 C ASN B 293 7.291 10.576 2.153 1.00 65.41 C ATOM 3015 O ASN B 293 6.248 10.209 2.709 1.00 22.34 O ATOM 3016 CB ASN B 293 7.486 13.032 1.671 1.00 12.04 C ATOM 3017 CG ASN B 293 8.865 13.170 2.328 1.00 2.04 C ATOM 3018 OD1 ASN B 293 9.839 12.544 1.903 1.00 24.10 O ATOM 3019 ND2 ASN B 293 8.949 13.967 3.359 1.00 15.24 N ATOM 0 H ASN B 293 5.178 11.297 0.890 1.00 72.35 H new ATOM 0 HA ASN B 293 8.055 11.442 0.349 1.00 13.15 H new ATOM 0 HB2 ASN B 293 7.383 13.786 0.890 1.00 12.04 H new ATOM 0 HB3 ASN B 293 6.713 13.234 2.413 1.00 12.04 H new ATOM 0 HD21 ASN B 293 9.841 14.087 3.839 1.00 15.24 H new ATOM 0 HD22 ASN B 293 8.123 14.470 3.684 1.00 15.24 H new ATOM 3026 N LEU B 294 8.480 10.095 2.463 1.00 51.30 N ATOM 3027 CA LEU B 294 8.671 9.085 3.473 1.00 2.20 C ATOM 3028 C LEU B 294 8.748 9.695 4.874 1.00 43.11 C ATOM 3029 O LEU B 294 9.101 10.868 5.037 1.00 13.13 O ATOM 3030 CB LEU B 294 9.947 8.239 3.214 1.00 21.41 C ATOM 3031 CG LEU B 294 9.927 7.208 2.070 1.00 62.33 C ATOM 3032 CD1 LEU B 294 9.793 7.836 0.700 1.00 35.04 C ATOM 3033 CD2 LEU B 294 11.150 6.311 2.146 1.00 25.22 C ATOM 0 H LEU B 294 9.344 10.400 2.014 1.00 51.30 H new ATOM 0 HA LEU B 294 7.800 8.432 3.416 1.00 2.20 H new ATOM 0 HB2 LEU B 294 10.769 8.929 3.024 1.00 21.41 H new ATOM 0 HB3 LEU B 294 10.184 7.707 4.135 1.00 21.41 H new ATOM 0 HG LEU B 294 9.032 6.602 2.208 1.00 62.33 H new ATOM 0 HD11 LEU B 294 9.786 7.054 -0.059 1.00 35.04 H new ATOM 0 HD12 LEU B 294 8.862 8.401 0.648 1.00 35.04 H new ATOM 0 HD13 LEU B 294 10.635 8.506 0.523 1.00 35.04 H new ATOM 0 HD21 LEU B 294 11.122 5.588 1.331 1.00 25.22 H new ATOM 0 HD22 LEU B 294 12.052 6.917 2.062 1.00 25.22 H new ATOM 0 HD23 LEU B 294 11.155 5.783 3.100 1.00 25.22 H new ATOM 3045 N PRO B 295 8.388 8.908 5.906 1.00 11.03 N ATOM 3046 CA PRO B 295 7.872 7.544 5.724 1.00 41.12 C ATOM 3047 C PRO B 295 6.425 7.556 5.231 1.00 4.34 C ATOM 3048 O PRO B 295 5.666 8.483 5.533 1.00 34.44 O ATOM 3049 CB PRO B 295 7.959 6.939 7.129 1.00 14.13 C ATOM 3050 CG PRO B 295 7.858 8.106 8.051 1.00 71.03 C ATOM 3051 CD PRO B 295 8.484 9.275 7.333 1.00 11.21 C ATOM 0 HA PRO B 295 8.432 6.981 4.977 1.00 41.12 H new ATOM 0 HB2 PRO B 295 7.153 6.226 7.303 1.00 14.13 H new ATOM 0 HB3 PRO B 295 8.897 6.402 7.271 1.00 14.13 H new ATOM 0 HG2 PRO B 295 6.817 8.315 8.299 1.00 71.03 H new ATOM 0 HG3 PRO B 295 8.375 7.905 8.989 1.00 71.03 H new ATOM 0 HD2 PRO B 295 7.953 10.204 7.543 1.00 11.21 H new ATOM 0 HD3 PRO B 295 9.520 9.423 7.639 1.00 11.21 H new ATOM 3059 N TYR B 296 6.056 6.556 4.451 1.00 52.22 N ATOM 3060 CA TYR B 296 4.700 6.480 3.964 1.00 15.31 C ATOM 3061 C TYR B 296 3.808 5.964 5.056 1.00 73.22 C ATOM 3062 O TYR B 296 4.039 4.890 5.622 1.00 65.20 O ATOM 3063 CB TYR B 296 4.565 5.645 2.692 1.00 62.52 C ATOM 3064 CG TYR B 296 5.343 6.166 1.495 1.00 20.23 C ATOM 3065 CD1 TYR B 296 5.553 7.521 1.304 1.00 23.20 C ATOM 3066 CD2 TYR B 296 5.863 5.291 0.556 1.00 24.52 C ATOM 3067 CE1 TYR B 296 6.259 7.981 0.207 1.00 74.42 C ATOM 3068 CE2 TYR B 296 6.562 5.740 -0.539 1.00 71.22 C ATOM 3069 CZ TYR B 296 6.758 7.084 -0.710 1.00 55.21 C ATOM 3070 OH TYR B 296 7.446 7.535 -1.808 1.00 43.24 O ATOM 0 H TYR B 296 6.668 5.799 4.148 1.00 52.22 H new ATOM 0 HA TYR B 296 4.391 7.487 3.685 1.00 15.31 H new ATOM 0 HB2 TYR B 296 4.895 4.629 2.906 1.00 62.52 H new ATOM 0 HB3 TYR B 296 3.510 5.588 2.423 1.00 62.52 H new ATOM 0 HD1 TYR B 296 5.161 8.228 2.020 1.00 23.20 H new ATOM 0 HD2 TYR B 296 5.716 4.229 0.687 1.00 24.52 H new ATOM 0 HE1 TYR B 296 6.418 9.040 0.070 1.00 74.42 H new ATOM 0 HE2 TYR B 296 6.954 5.037 -1.259 1.00 71.22 H new ATOM 0 HH TYR B 296 6.874 8.137 -2.328 1.00 43.24 H new ATOM 3080 N THR B 297 2.848 6.744 5.370 1.00 1.54 N ATOM 3081 CA THR B 297 1.947 6.499 6.435 1.00 34.21 C ATOM 3082 C THR B 297 0.508 6.285 5.960 1.00 3.40 C ATOM 3083 O THR B 297 0.123 6.696 4.850 1.00 51.42 O ATOM 3084 CB THR B 297 2.021 7.695 7.359 1.00 54.22 C ATOM 3085 OG1 THR B 297 2.147 8.870 6.527 1.00 21.02 O ATOM 3086 CG2 THR B 297 3.215 7.593 8.290 1.00 11.23 C ATOM 0 H THR B 297 2.656 7.613 4.871 1.00 1.54 H new ATOM 0 HA THR B 297 2.233 5.577 6.941 1.00 34.21 H new ATOM 0 HB THR B 297 1.127 7.743 7.980 1.00 54.22 H new ATOM 0 HG1 THR B 297 1.743 9.638 6.982 1.00 21.02 H new ATOM 0 HG21 THR B 297 3.243 8.466 8.942 1.00 11.23 H new ATOM 0 HG22 THR B 297 3.129 6.690 8.895 1.00 11.23 H new ATOM 0 HG23 THR B 297 4.132 7.550 7.702 1.00 11.23 H new ATOM 3094 N PHE B 298 -0.267 5.645 6.812 1.00 51.42 N ATOM 3095 CA PHE B 298 -1.663 5.355 6.569 1.00 72.33 C ATOM 3096 C PHE B 298 -2.567 6.160 7.442 1.00 32.13 C ATOM 3097 O PHE B 298 -2.201 6.554 8.561 1.00 12.31 O ATOM 3098 CB PHE B 298 -1.970 3.893 6.859 1.00 2.41 C ATOM 3099 CG PHE B 298 -1.845 2.968 5.714 1.00 63.35 C ATOM 3100 CD1 PHE B 298 -0.633 2.710 5.117 1.00 21.21 C ATOM 3101 CD2 PHE B 298 -2.973 2.340 5.233 1.00 0.44 C ATOM 3102 CE1 PHE B 298 -0.556 1.837 4.060 1.00 33.13 C ATOM 3103 CE2 PHE B 298 -2.907 1.468 4.187 1.00 73.33 C ATOM 3104 CZ PHE B 298 -1.700 1.213 3.594 1.00 74.00 C ATOM 0 H PHE B 298 0.066 5.304 7.714 1.00 51.42 H new ATOM 0 HA PHE B 298 -1.838 5.600 5.521 1.00 72.33 H new ATOM 0 HB2 PHE B 298 -1.303 3.552 7.651 1.00 2.41 H new ATOM 0 HB3 PHE B 298 -2.986 3.825 7.247 1.00 2.41 H new ATOM 0 HD1 PHE B 298 0.261 3.195 5.481 1.00 21.21 H new ATOM 0 HD2 PHE B 298 -3.929 2.542 5.694 1.00 0.44 H new ATOM 0 HE1 PHE B 298 0.397 1.637 3.592 1.00 33.13 H new ATOM 0 HE2 PHE B 298 -3.802 0.981 3.828 1.00 73.33 H new ATOM 0 HZ PHE B 298 -1.640 0.525 2.763 1.00 74.00 H new ATOM 3114 N GLY B 299 -3.744 6.398 6.936 1.00 72.24 N ATOM 3115 CA GLY B 299 -4.775 6.984 7.705 1.00 41.22 C ATOM 3116 C GLY B 299 -5.308 5.974 8.686 1.00 41.42 C ATOM 3117 O GLY B 299 -5.189 4.747 8.457 1.00 70.41 O ATOM 0 H GLY B 299 -4.004 6.186 5.973 1.00 72.24 H new ATOM 0 HA2 GLY B 299 -4.395 7.857 8.236 1.00 41.22 H new ATOM 0 HA3 GLY B 299 -5.577 7.331 7.053 1.00 41.22 H new ATOM 3121 N GLN B 300 -5.874 6.467 9.754 1.00 12.22 N ATOM 3122 CA GLN B 300 -6.396 5.657 10.839 1.00 21.12 C ATOM 3123 C GLN B 300 -7.421 4.610 10.362 1.00 35.32 C ATOM 3124 O GLN B 300 -7.403 3.466 10.811 1.00 22.43 O ATOM 3125 CB GLN B 300 -6.910 6.606 11.951 1.00 11.51 C ATOM 3126 CG GLN B 300 -7.601 5.978 13.151 1.00 75.43 C ATOM 3127 CD GLN B 300 -9.056 5.636 12.912 1.00 52.12 C ATOM 3128 OE1 GLN B 300 -9.733 6.459 12.144 1.00 15.43 O flip ATOM 3129 NE2 GLN B 300 -9.583 4.676 13.469 1.00 32.32 N flip ATOM 0 H GLN B 300 -5.992 7.469 9.905 1.00 12.22 H new ATOM 0 HA GLN B 300 -5.601 5.044 11.263 1.00 21.12 H new ATOM 0 HB2 GLN B 300 -6.062 7.185 12.317 1.00 11.51 H new ATOM 0 HB3 GLN B 300 -7.604 7.312 11.495 1.00 11.51 H new ATOM 0 HG2 GLN B 300 -7.066 5.071 13.432 1.00 75.43 H new ATOM 0 HG3 GLN B 300 -7.533 6.663 13.996 1.00 75.43 H new ATOM 0 HE21 GLN B 300 -9.024 4.059 14.058 1.00 32.32 H new ATOM 0 HE22 GLN B 300 -10.579 4.496 13.342 1.00 32.32 H new ATOM 3138 N GLY B 301 -8.260 4.978 9.431 1.00 71.43 N ATOM 3139 CA GLY B 301 -9.225 4.049 8.922 1.00 35.32 C ATOM 3140 C GLY B 301 -10.634 4.448 9.214 1.00 50.34 C ATOM 3141 O GLY B 301 -10.999 4.691 10.354 1.00 41.55 O ATOM 0 H GLY B 301 -8.293 5.908 9.014 1.00 71.43 H new ATOM 0 HA2 GLY B 301 -9.096 3.955 7.844 1.00 35.32 H new ATOM 0 HA3 GLY B 301 -9.036 3.066 9.352 1.00 35.32 H new ATOM 3145 N THR B 302 -11.424 4.511 8.196 1.00 3.43 N ATOM 3146 CA THR B 302 -12.800 4.791 8.355 1.00 74.31 C ATOM 3147 C THR B 302 -13.533 3.488 8.242 1.00 35.14 C ATOM 3148 O THR B 302 -13.396 2.772 7.241 1.00 74.30 O ATOM 3149 CB THR B 302 -13.303 5.737 7.239 1.00 34.42 C ATOM 3150 OG1 THR B 302 -12.584 6.981 7.282 1.00 43.31 O ATOM 3151 CG2 THR B 302 -14.806 5.998 7.361 1.00 43.41 C ATOM 0 H THR B 302 -11.128 4.369 7.230 1.00 3.43 H new ATOM 0 HA THR B 302 -12.969 5.274 9.318 1.00 74.31 H new ATOM 0 HB THR B 302 -13.122 5.248 6.282 1.00 34.42 H new ATOM 0 HG1 THR B 302 -13.085 7.630 7.819 1.00 43.31 H new ATOM 0 HG21 THR B 302 -15.125 6.666 6.561 1.00 43.41 H new ATOM 0 HG22 THR B 302 -15.347 5.055 7.283 1.00 43.41 H new ATOM 0 HG23 THR B 302 -15.018 6.459 8.326 1.00 43.41 H new ATOM 3159 N LYS B 303 -14.280 3.162 9.246 1.00 42.23 N ATOM 3160 CA LYS B 303 -15.033 1.961 9.217 1.00 42.42 C ATOM 3161 C LYS B 303 -16.298 2.245 8.459 1.00 31.34 C ATOM 3162 O LYS B 303 -17.042 3.172 8.801 1.00 61.34 O ATOM 3163 CB LYS B 303 -15.358 1.475 10.623 1.00 64.32 C ATOM 3164 CG LYS B 303 -15.945 0.073 10.640 1.00 52.25 C ATOM 3165 CD LYS B 303 -16.330 -0.383 12.029 1.00 23.50 C ATOM 3166 CE LYS B 303 -17.523 0.382 12.559 1.00 43.35 C ATOM 3167 NZ LYS B 303 -17.924 -0.086 13.901 1.00 55.53 N ATOM 0 H LYS B 303 -14.382 3.715 10.097 1.00 42.23 H new ATOM 0 HA LYS B 303 -14.456 1.172 8.734 1.00 42.42 H new ATOM 0 HB2 LYS B 303 -14.451 1.492 11.227 1.00 64.32 H new ATOM 0 HB3 LYS B 303 -16.063 2.165 11.087 1.00 64.32 H new ATOM 0 HG2 LYS B 303 -16.824 0.044 9.996 1.00 52.25 H new ATOM 0 HG3 LYS B 303 -15.220 -0.625 10.221 1.00 52.25 H new ATOM 0 HD2 LYS B 303 -16.559 -1.448 12.012 1.00 23.50 H new ATOM 0 HD3 LYS B 303 -15.484 -0.250 12.703 1.00 23.50 H new ATOM 0 HE2 LYS B 303 -17.284 1.445 12.601 1.00 43.35 H new ATOM 0 HE3 LYS B 303 -18.361 0.271 11.870 1.00 43.35 H new ATOM 0 HZ1 LYS B 303 -18.744 0.463 14.229 1.00 55.53 H new ATOM 0 HZ2 LYS B 303 -18.177 -1.094 13.856 1.00 55.53 H new ATOM 0 HZ3 LYS B 303 -17.133 0.043 14.564 1.00 55.53 H new ATOM 3181 N LEU B 304 -16.540 1.494 7.449 1.00 25.10 N ATOM 3182 CA LEU B 304 -17.694 1.715 6.648 1.00 42.33 C ATOM 3183 C LEU B 304 -18.768 0.748 7.049 1.00 24.30 C ATOM 3184 O LEU B 304 -18.521 -0.454 7.153 1.00 55.41 O ATOM 3185 CB LEU B 304 -17.349 1.572 5.169 1.00 44.41 C ATOM 3186 CG LEU B 304 -18.482 1.826 4.198 1.00 14.31 C ATOM 3187 CD1 LEU B 304 -19.098 3.198 4.409 1.00 64.22 C ATOM 3188 CD2 LEU B 304 -18.026 1.672 2.772 1.00 44.24 C ATOM 0 H LEU B 304 -15.952 0.715 7.153 1.00 25.10 H new ATOM 0 HA LEU B 304 -18.059 2.730 6.806 1.00 42.33 H new ATOM 0 HB2 LEU B 304 -16.536 2.261 4.937 1.00 44.41 H new ATOM 0 HB3 LEU B 304 -16.971 0.564 5.000 1.00 44.41 H new ATOM 0 HG LEU B 304 -19.247 1.076 4.396 1.00 14.31 H new ATOM 0 HD11 LEU B 304 -19.908 3.347 3.695 1.00 64.22 H new ATOM 0 HD12 LEU B 304 -19.491 3.268 5.423 1.00 64.22 H new ATOM 0 HD13 LEU B 304 -18.338 3.965 4.260 1.00 64.22 H new ATOM 0 HD21 LEU B 304 -18.863 1.861 2.100 1.00 44.24 H new ATOM 0 HD22 LEU B 304 -17.227 2.385 2.566 1.00 44.24 H new ATOM 0 HD23 LEU B 304 -17.657 0.658 2.616 1.00 44.24 H new ATOM 3200 N GLU B 305 -19.941 1.274 7.313 1.00 72.04 N ATOM 3201 CA GLU B 305 -21.057 0.491 7.744 1.00 2.45 C ATOM 3202 C GLU B 305 -22.264 0.795 6.882 1.00 21.01 C ATOM 3203 O GLU B 305 -22.295 1.809 6.169 1.00 44.42 O ATOM 3204 CB GLU B 305 -21.404 0.828 9.186 1.00 3.22 C ATOM 3205 CG GLU B 305 -20.254 0.677 10.142 1.00 25.15 C ATOM 3206 CD GLU B 305 -20.663 0.877 11.569 1.00 14.51 C ATOM 3207 OE1 GLU B 305 -21.077 -0.105 12.213 1.00 1.34 O ATOM 3208 OE2 GLU B 305 -20.575 2.006 12.077 1.00 32.13 O ATOM 0 H GLU B 305 -20.141 2.271 7.231 1.00 72.04 H new ATOM 0 HA GLU B 305 -20.791 -0.563 7.660 1.00 2.45 H new ATOM 0 HB2 GLU B 305 -21.768 1.854 9.231 1.00 3.22 H new ATOM 0 HB3 GLU B 305 -22.221 0.185 9.512 1.00 3.22 H new ATOM 0 HG2 GLU B 305 -19.819 -0.316 10.028 1.00 25.15 H new ATOM 0 HG3 GLU B 305 -19.476 1.397 9.886 1.00 25.15 H new ATOM 3215 N ILE B 306 -23.247 -0.054 6.947 1.00 32.24 N ATOM 3216 CA ILE B 306 -24.484 0.154 6.244 1.00 74.53 C ATOM 3217 C ILE B 306 -25.631 0.344 7.210 1.00 65.43 C ATOM 3218 O ILE B 306 -25.894 -0.507 8.066 1.00 72.50 O ATOM 3219 CB ILE B 306 -24.775 -0.951 5.167 1.00 72.22 C ATOM 3220 CG1 ILE B 306 -23.942 -0.677 3.898 1.00 51.24 C ATOM 3221 CG2 ILE B 306 -26.265 -1.046 4.821 1.00 71.44 C ATOM 3222 CD1 ILE B 306 -23.989 -1.779 2.878 1.00 31.43 C ATOM 0 H ILE B 306 -23.216 -0.916 7.492 1.00 32.24 H new ATOM 0 HA ILE B 306 -24.377 1.079 5.678 1.00 74.53 H new ATOM 0 HB ILE B 306 -24.485 -1.912 5.592 1.00 72.22 H new ATOM 0 HG12 ILE B 306 -24.297 0.245 3.437 1.00 51.24 H new ATOM 0 HG13 ILE B 306 -22.905 -0.510 4.188 1.00 51.24 H new ATOM 0 HG21 ILE B 306 -26.416 -1.824 4.072 1.00 71.44 H new ATOM 0 HG22 ILE B 306 -26.832 -1.292 5.719 1.00 71.44 H new ATOM 0 HG23 ILE B 306 -26.608 -0.090 4.425 1.00 71.44 H new ATOM 0 HD11 ILE B 306 -23.377 -1.505 2.018 1.00 31.43 H new ATOM 0 HD12 ILE B 306 -23.605 -2.699 3.319 1.00 31.43 H new ATOM 0 HD13 ILE B 306 -25.019 -1.933 2.556 1.00 31.43 H new ATOM 3234 N LYS B 307 -26.286 1.479 7.102 1.00 41.35 N ATOM 3235 CA LYS B 307 -27.402 1.777 7.944 1.00 1.10 C ATOM 3236 C LYS B 307 -28.662 1.227 7.316 1.00 34.33 C ATOM 3237 O LYS B 307 -29.007 1.550 6.171 1.00 23.13 O ATOM 3238 CB LYS B 307 -27.512 3.277 8.254 1.00 1.21 C ATOM 3239 CG LYS B 307 -27.700 4.152 7.070 1.00 11.34 C ATOM 3240 CD LYS B 307 -27.802 5.592 7.482 1.00 31.22 C ATOM 3241 CE LYS B 307 -28.090 6.443 6.298 1.00 30.33 C ATOM 3242 NZ LYS B 307 -28.166 7.882 6.639 1.00 51.02 N ATOM 0 H LYS B 307 -26.055 2.211 6.430 1.00 41.35 H new ATOM 0 HA LYS B 307 -27.252 1.291 8.908 1.00 1.10 H new ATOM 0 HB2 LYS B 307 -28.348 3.431 8.937 1.00 1.21 H new ATOM 0 HB3 LYS B 307 -26.610 3.591 8.779 1.00 1.21 H new ATOM 0 HG2 LYS B 307 -26.865 4.024 6.382 1.00 11.34 H new ATOM 0 HG3 LYS B 307 -28.602 3.858 6.534 1.00 11.34 H new ATOM 0 HD2 LYS B 307 -28.590 5.711 8.225 1.00 31.22 H new ATOM 0 HD3 LYS B 307 -26.871 5.911 7.951 1.00 31.22 H new ATOM 0 HE2 LYS B 307 -27.314 6.291 5.548 1.00 30.33 H new ATOM 0 HE3 LYS B 307 -29.032 6.129 5.849 1.00 30.33 H new ATOM 0 HZ1 LYS B 307 -28.369 8.432 5.780 1.00 51.02 H new ATOM 0 HZ2 LYS B 307 -28.924 8.034 7.335 1.00 51.02 H new ATOM 0 HZ3 LYS B 307 -27.259 8.192 7.042 1.00 51.02 H new ATOM 3256 N ARG B 308 -29.314 0.394 8.048 1.00 74.54 N ATOM 3257 CA ARG B 308 -30.461 -0.312 7.584 1.00 22.31 C ATOM 3258 C ARG B 308 -31.447 -0.528 8.730 1.00 52.44 C ATOM 3259 O ARG B 308 -31.383 -1.560 9.421 1.00 37.72 O ATOM 3260 CB ARG B 308 -30.013 -1.631 6.900 1.00 5.23 C ATOM 3261 CG ARG B 308 -29.057 -2.485 7.738 1.00 0.03 C ATOM 3262 CD ARG B 308 -28.526 -3.681 6.965 1.00 32.33 C ATOM 3263 NE ARG B 308 -27.573 -4.455 7.773 1.00 14.10 N ATOM 3264 CZ ARG B 308 -26.551 -5.191 7.292 1.00 13.10 C ATOM 3265 NH1 ARG B 308 -26.303 -5.250 5.992 1.00 20.30 N ATOM 3266 NH2 ARG B 308 -25.767 -5.846 8.130 1.00 55.34 N ATOM 3267 OXT ARG B 308 -32.270 0.372 8.972 1.00 37.72 O ATOM 0 H ARG B 308 -29.060 0.177 9.012 1.00 74.54 H new ATOM 0 HA ARG B 308 -30.991 0.274 6.833 1.00 22.31 H new ATOM 0 HB2 ARG B 308 -30.898 -2.223 6.664 1.00 5.23 H new ATOM 0 HB3 ARG B 308 -29.530 -1.389 5.953 1.00 5.23 H new ATOM 0 HG2 ARG B 308 -28.221 -1.870 8.071 1.00 0.03 H new ATOM 0 HG3 ARG B 308 -29.573 -2.833 8.633 1.00 0.03 H new ATOM 0 HD2 ARG B 308 -29.356 -4.321 6.664 1.00 32.33 H new ATOM 0 HD3 ARG B 308 -28.039 -3.340 6.051 1.00 32.33 H new ATOM 0 HE ARG B 308 -27.695 -4.433 8.785 1.00 14.10 H new ATOM 0 HH11 ARG B 308 -26.890 -4.733 5.337 1.00 20.30 H new ATOM 0 HH12 ARG B 308 -25.525 -5.812 5.646 1.00 20.30 H new ATOM 0 HH21 ARG B 308 -25.937 -5.793 9.134 1.00 55.34 H new ATOM 0 HH22 ARG B 308 -24.992 -6.405 7.773 1.00 55.34 H new