USER MOD reduce.3.24.130724 H: found=0, std=0, add=1581, rem=0, adj=78 USER MOD reduce.3.24.130724 removed 1581 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: B 237 GLN : amide:sc= -1.29 K(o=-1,f=-3.4!) USER MOD Set 1.2: B 286 TYR OH : rot 54:sc= 0.247 USER MOD Set 2.1: B 209 SER OG : rot 170:sc= 0.17 USER MOD Set 2.2: B 300 GLN : amide:sc= 0.173 X(o=0.34,f=0.57) USER MOD Set 3.1: A 1 ASP N :NH3+ -174:sc= 1.4 (180deg=-0.0433!) USER MOD Set 3.2: A 90 GLN : amide:sc= -2.04! C(o=0.51!,f=-8.7!) USER MOD Set 3.3: A 97 THR OG1 : rot 122:sc= 1.15 USER MOD Set 4.1: A 37 GLN : amide:sc= -0.252 K(o=1,f=-0.97!) USER MOD Set 4.2: A 86 TYR OH : rot 53:sc= 1.3 USER MOD Set 5.1: A 52 SER OG : rot 180:sc= 0 USER MOD Set 5.2: A 53 ASN :FLIP amide:sc= -2.08! C(o=-4.1!,f=-2.1!) USER MOD Set 6.1: A 34 ASN :FLIP amide:sc= -6.51! C(o=-14!,f=-13!) USER MOD Set 6.2: A 36 TYR OH : rot 143:sc= 0.681 USER MOD Set 6.3: B 234 ASN :FLIP amide:sc= -7.23! C(o=-14!,f=-13!) USER MOD Set 6.4: B 236 TYR OH : rot 90:sc= 0.0329 USER MOD Set 7.1: A 6 GLN : amide:sc= -4.75! C(o=-3.5!,f=-3.7!) USER MOD Set 7.2: A 102 THR OG1 : rot -79:sc= 1.27 USER MOD Single : A 3 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 4 MET CE :methyl -128:sc= -1.73 (180deg=-5.45!) USER MOD Single : A 5 THR OG1 : rot 83:sc= 0.199 USER MOD Single : A 7 SER OG : rot 180:sc= 0 USER MOD Single : A 9 SER OG : rot 180:sc= 0.0135 USER MOD Single : A 10 SER OG : rot 180:sc= 0 USER MOD Single : A 12 SER OG : rot 33:sc= 0.282 USER MOD Single : A 14 SER OG : rot 26:sc= 1.26 USER MOD Single : A 20 THR OG1 : rot 180:sc= 0 USER MOD Single : A 22 THR OG1 : rot 3:sc= 1.14 USER MOD Single : A 24 GLN : amide:sc= 0.789 K(o=0.79,f=0) USER MOD Single : A 26 SER OG : rot 161:sc= 0.203 USER MOD Single : A 27 GLN : amide:sc= -0.378 X(o=-0.38,f=-0.37) USER MOD Single : A 30 SER OG : rot -5:sc= 1.15 USER MOD Single : A 31 ASN : amide:sc= -0.142 X(o=-0.14,f=0) USER MOD Single : A 32 TYR OH : rot 180:sc= 0 USER MOD Single : A 38 GLN : amide:sc= -0.564 K(o=-0.56,f=-1.4) USER MOD Single : A 39 LYS NZ :NH3+ 157:sc= 0.671 (180deg=0.455) USER MOD Single : A 42 LYS NZ :NH3+ 162:sc= -0.0605 (180deg=-0.402) USER MOD Single : A 45 LYS NZ :NH3+ 158:sc= 0.624 (180deg=0.541) USER MOD Single : A 49 TYR OH : rot 180:sc= 0 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= -0.0807 USER MOD Single : A 67 SER OG : rot 180:sc= 0 USER MOD Single : A 69 THR OG1 : rot 180:sc= 0 USER MOD Single : A 72 THR OG1 : rot 180:sc= -0.053 USER MOD Single : A 74 THR OG1 : rot 39: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= -0.569 X(o=-0.57,f=-0.63) USER MOD Single : A 85 THR OG1 : rot 180:sc= 0 USER MOD Single : A 87 HIS : no HE2:sc= -1.17 K(o=-1.2,f=-3.3!) USER MOD Single : A 89 GLN : amide:sc= -2.19 K(o=-2.2,f=-2.8) USER MOD Single : A 91 TYR OH : rot -46:sc= 0.149 USER MOD Single : A 93 ASN : amide:sc= 0 X(o=0,f=-0.48) USER MOD Single : A 96 TYR OH : rot -52:sc= -0.121 USER MOD Single : A 100 GLN : amide:sc= -0.194 X(o=-0.19,f=0) USER MOD Single : A 103 LYS NZ :NH3+ -167:sc= -0.0441 (180deg=-0.232) USER MOD Single : A 107 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 203 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : B 204 MET CE :methyl -132:sc= -1.04 (180deg=-5.56!) USER MOD Single : B 205 THR OG1 : rot 180:sc= 0 USER MOD Single : B 206 GLN :FLIP amide:sc= -3.58! C(o=-5!,f=-3.6!) USER MOD Single : B 207 SER OG : rot 180:sc= 0 USER MOD Single : B 210 SER OG : rot 180:sc= 0 USER MOD Single : B 212 SER OG : rot 180:sc= -0.0712 USER MOD Single : B 214 SER OG : rot 56:sc= 1.27 USER MOD Single : B 220 THR OG1 : rot 180:sc= 0 USER MOD Single : B 222 THR OG1 : rot 0:sc= 1.21 USER MOD Single : B 224 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : B 226 SER OG : rot 150:sc= 0.951 USER MOD Single : B 227 GLN :FLIP amide:sc= -0.574 F(o=-1.3,f=-0.57) USER MOD Single : B 230 SER OG : rot 15:sc= 0.582 USER MOD Single : B 231 ASN : amide:sc= 0.391 X(o=0.39,f=0) USER MOD Single : B 232 TYR OH : rot 180:sc= 0 USER MOD Single : B 238 GLN : amide:sc= -0.498 X(o=-0.5,f=-0.44) USER MOD Single : B 239 LYS NZ :NH3+ 139:sc= 0.865 (180deg=0.127) USER MOD Single : B 245 LYS NZ :NH3+ 154:sc= 0.79 (180deg=0.405) 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= -0.692! X(o=-0.69!,f=-0.43) USER MOD Single : B 256 THR OG1 : rot 86:sc= 0.197 USER MOD Single : B 260 SER OG : rot 180:sc= 0 USER MOD Single : B 263 SER OG : rot 180:sc= 0 USER MOD Single : B 265 SER OG : rot -8:sc= -0.588 USER MOD Single : B 267 SER OG : rot 180:sc= 0 USER MOD Single : B 269 THR OG1 : rot 180:sc= 0 USER MOD Single : B 272 THR OG1 : rot 180:sc= -0.0292 USER MOD Single : B 274 THR OG1 : rot 42:sc= 0.732 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= -0.0726 K(o=-0.073,f=-0.87) USER MOD Single : B 285 THR OG1 : rot 180:sc= 0 USER MOD Single : B 287 HIS : no HE2:sc= -1.87 X(o=-1.9,f=-1.6) USER MOD Single : B 289 GLN : amide:sc= -2.31! C(o=-2.3!,f=-4.2!) USER MOD Single : B 290 GLN : amide:sc= -2.37! C(o=-2.4!,f=-11!) USER MOD Single : B 291 TYR OH : rot -56:sc= 0.215 USER MOD Single : B 293 ASN : amide:sc=-0.00988 X(o=-0.0099,f=0) USER MOD Single : B 296 TYR OH : rot -53:sc= -0.46 USER MOD Single : B 297 THR OG1 : rot -146:sc= 0.419 USER MOD Single : B 302 THR OG1 : rot -100:sc= 1.23 USER MOD Single : B 303 LYS NZ :NH3+ -171:sc= -0.0185 (180deg=-0.151) USER MOD Single : B 307 LYS NZ :NH3+ 152:sc= -0.212 (180deg=-0.652) USER MOD ----------------------------------------------------------------- ATOM 1 N ASP A 1 2.485 1.568 12.203 1.00 54.20 N ATOM 2 CA ASP A 1 2.938 2.317 13.363 1.00 73.12 C ATOM 3 C ASP A 1 4.172 1.637 13.898 1.00 44.35 C ATOM 4 O ASP A 1 4.936 2.187 14.687 1.00 73.05 O ATOM 5 CB ASP A 1 1.834 2.319 14.393 1.00 10.42 C ATOM 6 CG ASP A 1 1.510 0.941 14.885 1.00 54.11 C ATOM 7 OD1 ASP A 1 1.299 0.053 14.040 1.00 22.54 O ATOM 8 OD2 ASP A 1 1.439 0.742 16.115 1.00 40.50 O ATOM 0 H1 ASP A 1 1.694 2.071 11.752 1.00 54.20 H new ATOM 0 H2 ASP A 1 3.267 1.473 11.524 1.00 54.20 H new ATOM 0 H3 ASP A 1 2.169 0.623 12.502 1.00 54.20 H new ATOM 0 HA ASP A 1 3.178 3.349 13.108 1.00 73.12 H new ATOM 0 HB2 ASP A 1 2.129 2.943 15.237 1.00 10.42 H new ATOM 0 HB3 ASP A 1 0.939 2.768 13.962 1.00 10.42 H new ATOM 13 N ILE A 2 4.341 0.440 13.429 1.00 13.20 N ATOM 14 CA ILE A 2 5.434 -0.433 13.722 1.00 64.42 C ATOM 15 C ILE A 2 6.605 -0.060 12.839 1.00 33.12 C ATOM 16 O ILE A 2 6.434 0.199 11.638 1.00 64.31 O ATOM 17 CB ILE A 2 4.940 -1.843 13.431 1.00 20.01 C ATOM 18 CG1 ILE A 2 3.760 -2.156 14.354 1.00 34.15 C ATOM 19 CG2 ILE A 2 6.045 -2.882 13.562 1.00 10.10 C ATOM 20 CD1 ILE A 2 2.897 -3.283 13.902 1.00 2.15 C ATOM 0 H ILE A 2 3.671 0.018 12.786 1.00 13.20 H new ATOM 0 HA ILE A 2 5.767 -0.360 14.757 1.00 64.42 H new ATOM 0 HB ILE A 2 4.611 -1.889 12.393 1.00 20.01 H new ATOM 0 HG12 ILE A 2 4.145 -2.387 15.347 1.00 34.15 H new ATOM 0 HG13 ILE A 2 3.145 -1.261 14.451 1.00 34.15 H new ATOM 0 HG21 ILE A 2 5.642 -3.871 13.345 1.00 10.10 H new ATOM 0 HG22 ILE A 2 6.845 -2.653 12.858 1.00 10.10 H new ATOM 0 HG23 ILE A 2 6.440 -2.867 14.578 1.00 10.10 H new ATOM 0 HD11 ILE A 2 2.088 -3.432 14.617 1.00 2.15 H new ATOM 0 HD12 ILE A 2 2.477 -3.050 12.923 1.00 2.15 H new ATOM 0 HD13 ILE A 2 3.493 -4.193 13.834 1.00 2.15 H new ATOM 32 N GLN A 3 7.763 0.006 13.431 1.00 40.15 N ATOM 33 CA GLN A 3 8.942 0.443 12.748 1.00 33.33 C ATOM 34 C GLN A 3 9.483 -0.690 11.901 1.00 32.13 C ATOM 35 O GLN A 3 9.875 -1.732 12.423 1.00 75.24 O ATOM 36 CB GLN A 3 9.993 0.858 13.764 1.00 51.14 C ATOM 37 CG GLN A 3 11.176 1.560 13.158 1.00 65.54 C ATOM 38 CD GLN A 3 12.225 1.916 14.185 1.00 54.43 C ATOM 39 OE1 GLN A 3 13.136 1.139 14.448 1.00 62.43 O ATOM 40 NE2 GLN A 3 12.113 3.078 14.765 1.00 61.11 N ATOM 0 H GLN A 3 7.914 -0.244 14.408 1.00 40.15 H new ATOM 0 HA GLN A 3 8.697 1.292 12.110 1.00 33.33 H new ATOM 0 HB2 GLN A 3 9.532 1.514 14.503 1.00 51.14 H new ATOM 0 HB3 GLN A 3 10.341 -0.027 14.296 1.00 51.14 H new ATOM 0 HG2 GLN A 3 11.621 0.922 12.395 1.00 65.54 H new ATOM 0 HG3 GLN A 3 10.839 2.468 12.658 1.00 65.54 H new ATOM 0 HE21 GLN A 3 11.341 3.698 14.520 1.00 61.11 H new ATOM 0 HE22 GLN A 3 12.797 3.367 15.464 1.00 61.11 H new ATOM 49 N MET A 4 9.481 -0.496 10.611 1.00 42.53 N ATOM 50 CA MET A 4 9.968 -1.497 9.698 1.00 70.53 C ATOM 51 C MET A 4 11.391 -1.140 9.289 1.00 2.10 C ATOM 52 O MET A 4 11.620 -0.137 8.608 1.00 30.13 O ATOM 53 CB MET A 4 9.056 -1.599 8.467 1.00 34.03 C ATOM 54 CG MET A 4 7.581 -1.864 8.787 1.00 22.34 C ATOM 55 SD MET A 4 7.295 -3.367 9.759 1.00 10.01 S ATOM 56 CE MET A 4 7.887 -4.647 8.654 1.00 50.44 C ATOM 0 H MET A 4 9.144 0.356 10.163 1.00 42.53 H new ATOM 0 HA MET A 4 9.966 -2.470 10.190 1.00 70.53 H new ATOM 0 HB2 MET A 4 9.130 -0.672 7.898 1.00 34.03 H new ATOM 0 HB3 MET A 4 9.424 -2.398 7.824 1.00 34.03 H new ATOM 0 HG2 MET A 4 7.179 -1.010 9.332 1.00 22.34 H new ATOM 0 HG3 MET A 4 7.025 -1.937 7.853 1.00 22.34 H new ATOM 0 HE1 MET A 4 7.120 -5.413 8.540 1.00 50.44 H new ATOM 0 HE2 MET A 4 8.113 -4.212 7.681 1.00 50.44 H new ATOM 0 HE3 MET A 4 8.789 -5.097 9.068 1.00 50.44 H new ATOM 66 N THR A 5 12.331 -1.924 9.736 1.00 5.24 N ATOM 67 CA THR A 5 13.739 -1.677 9.494 1.00 70.03 C ATOM 68 C THR A 5 14.175 -2.284 8.156 1.00 62.42 C ATOM 69 O THR A 5 14.137 -3.486 7.994 1.00 21.54 O ATOM 70 CB THR A 5 14.570 -2.329 10.620 1.00 61.32 C ATOM 71 OG1 THR A 5 14.090 -1.868 11.906 1.00 64.31 O ATOM 72 CG2 THR A 5 16.057 -2.008 10.474 1.00 41.43 C ATOM 0 H THR A 5 12.147 -2.764 10.285 1.00 5.24 H new ATOM 0 HA THR A 5 13.901 -0.599 9.469 1.00 70.03 H new ATOM 0 HB THR A 5 14.453 -3.410 10.548 1.00 61.32 H new ATOM 0 HG1 THR A 5 13.310 -2.397 12.173 1.00 64.31 H new ATOM 0 HG21 THR A 5 16.613 -2.482 11.283 1.00 41.43 H new ATOM 0 HG22 THR A 5 16.418 -2.384 9.517 1.00 41.43 H new ATOM 0 HG23 THR A 5 16.202 -0.929 10.518 1.00 41.43 H new ATOM 80 N GLN A 6 14.571 -1.449 7.227 1.00 15.13 N ATOM 81 CA GLN A 6 15.053 -1.894 5.941 1.00 54.41 C ATOM 82 C GLN A 6 16.555 -1.802 5.835 1.00 33.44 C ATOM 83 O GLN A 6 17.147 -0.716 5.917 1.00 21.03 O ATOM 84 CB GLN A 6 14.385 -1.111 4.826 1.00 11.25 C ATOM 85 CG GLN A 6 13.040 -1.663 4.420 1.00 52.23 C ATOM 86 CD GLN A 6 13.187 -2.930 3.645 1.00 55.32 C ATOM 87 OE1 GLN A 6 13.199 -4.009 4.189 1.00 65.30 O ATOM 88 NE2 GLN A 6 13.308 -2.801 2.364 1.00 41.31 N ATOM 0 H GLN A 6 14.568 -0.435 7.342 1.00 15.13 H new ATOM 0 HA GLN A 6 14.790 -2.947 5.839 1.00 54.41 H new ATOM 0 HB2 GLN A 6 14.262 -0.076 5.144 1.00 11.25 H new ATOM 0 HB3 GLN A 6 15.042 -1.102 3.956 1.00 11.25 H new ATOM 0 HG2 GLN A 6 12.436 -1.845 5.309 1.00 52.23 H new ATOM 0 HG3 GLN A 6 12.508 -0.926 3.819 1.00 52.23 H new ATOM 0 HE21 GLN A 6 13.293 -1.873 1.941 1.00 41.31 H new ATOM 0 HE22 GLN A 6 13.418 -3.627 1.776 1.00 41.31 H new ATOM 97 N SER A 7 17.157 -2.934 5.669 1.00 23.45 N ATOM 98 CA SER A 7 18.572 -3.046 5.501 1.00 75.05 C ATOM 99 C SER A 7 18.838 -4.136 4.463 1.00 24.44 C ATOM 100 O SER A 7 18.165 -5.172 4.470 1.00 53.22 O ATOM 101 CB SER A 7 19.231 -3.382 6.851 1.00 50.44 C ATOM 102 OG SER A 7 20.647 -3.449 6.747 1.00 23.22 O ATOM 0 H SER A 7 16.668 -3.829 5.646 1.00 23.45 H new ATOM 0 HA SER A 7 19.000 -2.106 5.153 1.00 75.05 H new ATOM 0 HB2 SER A 7 18.956 -2.627 7.587 1.00 50.44 H new ATOM 0 HB3 SER A 7 18.848 -4.336 7.215 1.00 50.44 H new ATOM 0 HG SER A 7 21.030 -3.663 7.624 1.00 23.22 H new ATOM 108 N PRO A 8 19.781 -3.931 3.543 1.00 73.12 N ATOM 109 CA PRO A 8 20.587 -2.713 3.459 1.00 45.32 C ATOM 110 C PRO A 8 19.770 -1.531 2.933 1.00 52.12 C ATOM 111 O PRO A 8 18.770 -1.724 2.249 1.00 21.43 O ATOM 112 CB PRO A 8 21.694 -3.084 2.473 1.00 21.03 C ATOM 113 CG PRO A 8 21.087 -4.129 1.607 1.00 21.54 C ATOM 114 CD PRO A 8 20.136 -4.895 2.482 1.00 51.14 C ATOM 0 HA PRO A 8 20.963 -2.397 4.432 1.00 45.32 H new ATOM 0 HB2 PRO A 8 22.011 -2.220 1.889 1.00 21.03 H new ATOM 0 HB3 PRO A 8 22.576 -3.461 2.990 1.00 21.03 H new ATOM 0 HG2 PRO A 8 20.564 -3.680 0.763 1.00 21.54 H new ATOM 0 HG3 PRO A 8 21.853 -4.786 1.195 1.00 21.54 H new ATOM 0 HD2 PRO A 8 19.256 -5.222 1.927 1.00 51.14 H new ATOM 0 HD3 PRO A 8 20.603 -5.789 2.894 1.00 51.14 H new ATOM 122 N SER A 9 20.165 -0.326 3.295 1.00 63.04 N ATOM 123 CA SER A 9 19.492 0.885 2.834 1.00 63.32 C ATOM 124 C SER A 9 19.574 1.023 1.301 1.00 51.24 C ATOM 125 O SER A 9 18.746 1.682 0.663 1.00 34.11 O ATOM 126 CB SER A 9 20.107 2.091 3.541 1.00 2.43 C ATOM 127 OG SER A 9 21.525 2.032 3.483 1.00 30.31 O ATOM 0 H SER A 9 20.957 -0.153 3.914 1.00 63.04 H new ATOM 0 HA SER A 9 18.433 0.827 3.084 1.00 63.32 H new ATOM 0 HB2 SER A 9 19.756 3.011 3.074 1.00 2.43 H new ATOM 0 HB3 SER A 9 19.780 2.116 4.581 1.00 2.43 H new ATOM 0 HG SER A 9 21.904 2.812 3.939 1.00 30.31 H new ATOM 133 N SER A 10 20.556 0.377 0.730 1.00 72.31 N ATOM 134 CA SER A 10 20.767 0.375 -0.691 1.00 21.45 C ATOM 135 C SER A 10 21.577 -0.853 -1.087 1.00 40.14 C ATOM 136 O SER A 10 22.368 -1.358 -0.288 1.00 10.01 O ATOM 137 CB SER A 10 21.464 1.674 -1.114 1.00 64.33 C ATOM 138 OG SER A 10 22.646 1.886 -0.351 1.00 33.50 O ATOM 0 H SER A 10 21.242 -0.171 1.249 1.00 72.31 H new ATOM 0 HA SER A 10 19.809 0.327 -1.209 1.00 21.45 H new ATOM 0 HB2 SER A 10 21.713 1.629 -2.174 1.00 64.33 H new ATOM 0 HB3 SER A 10 20.785 2.516 -0.982 1.00 64.33 H new ATOM 0 HG SER A 10 23.076 2.719 -0.638 1.00 33.50 H new ATOM 144 N LEU A 11 21.374 -1.344 -2.285 1.00 52.43 N ATOM 145 CA LEU A 11 22.085 -2.516 -2.741 1.00 62.22 C ATOM 146 C LEU A 11 22.265 -2.424 -4.247 1.00 73.34 C ATOM 147 O LEU A 11 21.317 -2.133 -4.970 1.00 23.33 O ATOM 148 CB LEU A 11 21.289 -3.796 -2.316 1.00 74.23 C ATOM 149 CG LEU A 11 21.947 -5.196 -2.508 1.00 71.25 C ATOM 150 CD1 LEU A 11 21.114 -6.247 -1.805 1.00 24.23 C ATOM 151 CD2 LEU A 11 22.068 -5.581 -3.974 1.00 24.21 C ATOM 0 H LEU A 11 20.722 -0.951 -2.963 1.00 52.43 H new ATOM 0 HA LEU A 11 23.074 -2.577 -2.288 1.00 62.22 H new ATOM 0 HB2 LEU A 11 21.039 -3.692 -1.260 1.00 74.23 H new ATOM 0 HB3 LEU A 11 20.349 -3.796 -2.867 1.00 74.23 H new ATOM 0 HG LEU A 11 22.950 -5.141 -2.085 1.00 71.25 H new ATOM 0 HD11 LEU A 11 21.574 -7.226 -1.939 1.00 24.23 H new ATOM 0 HD12 LEU A 11 21.058 -6.015 -0.741 1.00 24.23 H new ATOM 0 HD13 LEU A 11 20.109 -6.257 -2.227 1.00 24.23 H new ATOM 0 HD21 LEU A 11 22.532 -6.564 -4.055 1.00 24.21 H new ATOM 0 HD22 LEU A 11 21.076 -5.610 -4.426 1.00 24.21 H new ATOM 0 HD23 LEU A 11 22.682 -4.846 -4.494 1.00 24.21 H new ATOM 163 N SER A 12 23.474 -2.637 -4.700 1.00 43.54 N ATOM 164 CA SER A 12 23.781 -2.625 -6.104 1.00 22.22 C ATOM 165 C SER A 12 24.201 -4.018 -6.558 1.00 52.21 C ATOM 166 O SER A 12 25.187 -4.565 -6.068 1.00 51.14 O ATOM 167 CB SER A 12 24.883 -1.601 -6.396 1.00 62.40 C ATOM 168 OG SER A 12 26.042 -1.837 -5.586 1.00 74.21 O ATOM 0 H SER A 12 24.277 -2.825 -4.100 1.00 43.54 H new ATOM 0 HA SER A 12 22.890 -2.335 -6.661 1.00 22.22 H new ATOM 0 HB2 SER A 12 25.157 -1.650 -7.450 1.00 62.40 H new ATOM 0 HB3 SER A 12 24.506 -0.595 -6.211 1.00 62.40 H new ATOM 0 HG SER A 12 26.136 -2.799 -5.422 1.00 74.21 H new ATOM 174 N ALA A 13 23.463 -4.585 -7.462 1.00 31.30 N ATOM 175 CA ALA A 13 23.768 -5.911 -7.964 1.00 30.21 C ATOM 176 C ALA A 13 23.661 -5.911 -9.464 1.00 60.50 C ATOM 177 O ALA A 13 22.986 -5.071 -10.024 1.00 21.33 O ATOM 178 CB ALA A 13 22.841 -6.951 -7.351 1.00 52.54 C ATOM 0 H ALA A 13 22.636 -4.155 -7.877 1.00 31.30 H new ATOM 0 HA ALA A 13 24.787 -6.175 -7.680 1.00 30.21 H new ATOM 0 HB1 ALA A 13 23.090 -7.937 -7.744 1.00 52.54 H new ATOM 0 HB2 ALA A 13 22.960 -6.951 -6.268 1.00 52.54 H new ATOM 0 HB3 ALA A 13 21.808 -6.711 -7.602 1.00 52.54 H new ATOM 184 N SER A 14 24.364 -6.795 -10.111 1.00 74.25 N ATOM 185 CA SER A 14 24.314 -6.874 -11.549 1.00 54.44 C ATOM 186 C SER A 14 23.056 -7.606 -12.033 1.00 41.21 C ATOM 187 O SER A 14 22.392 -8.300 -11.250 1.00 24.24 O ATOM 188 CB SER A 14 25.617 -7.472 -12.099 1.00 22.01 C ATOM 189 OG SER A 14 26.006 -8.645 -11.386 1.00 33.22 O ATOM 0 H SER A 14 24.982 -7.475 -9.667 1.00 74.25 H new ATOM 0 HA SER A 14 24.236 -5.864 -11.952 1.00 54.44 H new ATOM 0 HB2 SER A 14 25.488 -7.714 -13.154 1.00 22.01 H new ATOM 0 HB3 SER A 14 26.412 -6.729 -12.037 1.00 22.01 H new ATOM 0 HG SER A 14 25.213 -9.068 -10.995 1.00 33.22 H new ATOM 195 N VAL A 15 22.726 -7.434 -13.307 1.00 42.40 N ATOM 196 CA VAL A 15 21.526 -8.027 -13.891 1.00 11.02 C ATOM 197 C VAL A 15 21.542 -9.538 -13.763 1.00 23.42 C ATOM 198 O VAL A 15 22.500 -10.197 -14.151 1.00 52.20 O ATOM 199 CB VAL A 15 21.345 -7.625 -15.385 1.00 41.40 C ATOM 200 CG1 VAL A 15 20.118 -8.295 -15.995 1.00 50.12 C ATOM 201 CG2 VAL A 15 21.220 -6.126 -15.509 1.00 43.21 C ATOM 0 H VAL A 15 23.279 -6.882 -13.963 1.00 42.40 H new ATOM 0 HA VAL A 15 20.679 -7.634 -13.329 1.00 11.02 H new ATOM 0 HB VAL A 15 22.226 -7.963 -15.930 1.00 41.40 H new ATOM 0 HG11 VAL A 15 20.020 -7.994 -17.038 1.00 50.12 H new ATOM 0 HG12 VAL A 15 20.229 -9.378 -15.939 1.00 50.12 H new ATOM 0 HG13 VAL A 15 19.227 -7.993 -15.445 1.00 50.12 H new ATOM 0 HG21 VAL A 15 21.094 -5.857 -16.558 1.00 43.21 H new ATOM 0 HG22 VAL A 15 20.355 -5.785 -14.940 1.00 43.21 H new ATOM 0 HG23 VAL A 15 22.121 -5.652 -15.119 1.00 43.21 H new ATOM 211 N GLY A 16 20.495 -10.063 -13.201 1.00 0.32 N ATOM 212 CA GLY A 16 20.379 -11.489 -13.042 1.00 13.13 C ATOM 213 C GLY A 16 20.687 -11.960 -11.638 1.00 34.22 C ATOM 214 O GLY A 16 20.281 -13.047 -11.254 1.00 2.04 O ATOM 0 H GLY A 16 19.705 -9.527 -12.843 1.00 0.32 H new ATOM 0 HA2 GLY A 16 19.368 -11.796 -13.308 1.00 13.13 H new ATOM 0 HA3 GLY A 16 21.056 -11.982 -13.740 1.00 13.13 H new ATOM 218 N ASP A 17 21.395 -11.149 -10.874 1.00 41.11 N ATOM 219 CA ASP A 17 21.760 -11.512 -9.498 1.00 4.31 C ATOM 220 C ASP A 17 20.582 -11.496 -8.567 1.00 40.52 C ATOM 221 O ASP A 17 19.598 -10.790 -8.794 1.00 4.23 O ATOM 222 CB ASP A 17 22.865 -10.615 -8.937 1.00 44.14 C ATOM 223 CG ASP A 17 24.222 -10.905 -9.507 1.00 51.32 C ATOM 224 OD1 ASP A 17 24.476 -10.575 -10.673 1.00 3.04 O ATOM 225 OD2 ASP A 17 25.085 -11.451 -8.766 1.00 43.13 O ATOM 0 H ASP A 17 21.733 -10.234 -11.173 1.00 41.11 H new ATOM 0 HA ASP A 17 22.136 -12.533 -9.559 1.00 4.31 H new ATOM 0 HB2 ASP A 17 22.612 -9.574 -9.136 1.00 44.14 H new ATOM 0 HB3 ASP A 17 22.902 -10.733 -7.854 1.00 44.14 H new ATOM 230 N ARG A 18 20.680 -12.285 -7.523 1.00 41.21 N ATOM 231 CA ARG A 18 19.655 -12.337 -6.530 1.00 30.23 C ATOM 232 C ARG A 18 19.971 -11.351 -5.403 1.00 34.02 C ATOM 233 O ARG A 18 21.023 -11.435 -4.766 1.00 22.41 O ATOM 234 CB ARG A 18 19.485 -13.752 -5.978 1.00 45.02 C ATOM 235 CG ARG A 18 18.395 -13.834 -4.941 1.00 25.11 C ATOM 236 CD ARG A 18 18.212 -15.226 -4.374 1.00 2.33 C ATOM 237 NE ARG A 18 17.728 -16.179 -5.375 1.00 42.10 N ATOM 238 CZ ARG A 18 16.777 -17.093 -5.148 1.00 14.24 C ATOM 239 NH1 ARG A 18 16.172 -17.160 -3.954 1.00 64.24 N ATOM 240 NH2 ARG A 18 16.420 -17.926 -6.110 1.00 52.21 N ATOM 0 H ARG A 18 21.472 -12.903 -7.346 1.00 41.21 H new ATOM 0 HA ARG A 18 18.712 -12.053 -6.997 1.00 30.23 H new ATOM 0 HB2 ARG A 18 19.256 -14.434 -6.797 1.00 45.02 H new ATOM 0 HB3 ARG A 18 20.426 -14.084 -5.540 1.00 45.02 H new ATOM 0 HG2 ARG A 18 18.624 -13.145 -4.128 1.00 25.11 H new ATOM 0 HG3 ARG A 18 17.456 -13.503 -5.384 1.00 25.11 H new ATOM 0 HD2 ARG A 18 19.161 -15.578 -3.970 1.00 2.33 H new ATOM 0 HD3 ARG A 18 17.507 -15.187 -3.543 1.00 2.33 H new ATOM 0 HE ARG A 18 18.143 -16.144 -6.306 1.00 42.10 H new ATOM 0 HH11 ARG A 18 16.436 -16.512 -3.212 1.00 64.24 H new ATOM 0 HH12 ARG A 18 15.448 -17.859 -3.788 1.00 64.24 H new ATOM 0 HH21 ARG A 18 16.869 -17.872 -7.024 1.00 52.21 H new ATOM 0 HH22 ARG A 18 15.695 -18.623 -5.938 1.00 52.21 H new ATOM 254 N VAL A 19 19.073 -10.428 -5.169 1.00 2.50 N ATOM 255 CA VAL A 19 19.275 -9.393 -4.161 1.00 22.40 C ATOM 256 C VAL A 19 18.700 -9.847 -2.823 1.00 75.34 C ATOM 257 O VAL A 19 17.750 -10.644 -2.782 1.00 3.24 O ATOM 258 CB VAL A 19 18.633 -8.034 -4.571 1.00 32.31 C ATOM 259 CG1 VAL A 19 18.938 -7.692 -6.008 1.00 21.41 C ATOM 260 CG2 VAL A 19 17.146 -7.956 -4.262 1.00 62.23 C ATOM 0 H VAL A 19 18.183 -10.364 -5.663 1.00 2.50 H new ATOM 0 HA VAL A 19 20.350 -9.237 -4.072 1.00 22.40 H new ATOM 0 HB VAL A 19 19.099 -7.272 -3.947 1.00 32.31 H new ATOM 0 HG11 VAL A 19 18.475 -6.738 -6.261 1.00 21.41 H new ATOM 0 HG12 VAL A 19 20.017 -7.619 -6.144 1.00 21.41 H new ATOM 0 HG13 VAL A 19 18.542 -8.471 -6.659 1.00 21.41 H new ATOM 0 HG21 VAL A 19 16.760 -6.985 -4.572 1.00 62.23 H new ATOM 0 HG22 VAL A 19 16.620 -8.744 -4.802 1.00 62.23 H new ATOM 0 HG23 VAL A 19 16.990 -8.083 -3.191 1.00 62.23 H new ATOM 270 N THR A 20 19.283 -9.389 -1.748 1.00 61.54 N ATOM 271 CA THR A 20 18.788 -9.715 -0.443 1.00 30.22 C ATOM 272 C THR A 20 18.410 -8.436 0.310 1.00 2.35 C ATOM 273 O THR A 20 19.247 -7.574 0.545 1.00 14.35 O ATOM 274 CB THR A 20 19.848 -10.501 0.348 1.00 5.43 C ATOM 275 OG1 THR A 20 20.211 -11.685 -0.395 1.00 51.23 O ATOM 276 CG2 THR A 20 19.320 -10.909 1.718 1.00 42.53 C ATOM 0 H THR A 20 20.106 -8.786 -1.753 1.00 61.54 H new ATOM 0 HA THR A 20 17.900 -10.337 -0.550 1.00 30.22 H new ATOM 0 HB THR A 20 20.718 -9.861 0.492 1.00 5.43 H new ATOM 0 HG1 THR A 20 20.888 -12.189 0.103 1.00 51.23 H new ATOM 0 HG21 THR A 20 20.090 -11.463 2.255 1.00 42.53 H new ATOM 0 HG22 THR A 20 19.053 -10.017 2.285 1.00 42.53 H new ATOM 0 HG23 THR A 20 18.439 -11.539 1.596 1.00 42.53 H new ATOM 284 N ILE A 21 17.154 -8.323 0.648 1.00 14.22 N ATOM 285 CA ILE A 21 16.635 -7.203 1.393 1.00 22.24 C ATOM 286 C ILE A 21 16.003 -7.731 2.672 1.00 11.33 C ATOM 287 O ILE A 21 15.167 -8.608 2.625 1.00 54.05 O ATOM 288 CB ILE A 21 15.580 -6.419 0.549 1.00 33.12 C ATOM 289 CG1 ILE A 21 16.250 -5.744 -0.661 1.00 12.03 C ATOM 290 CG2 ILE A 21 14.862 -5.398 1.398 1.00 4.34 C ATOM 291 CD1 ILE A 21 15.308 -5.012 -1.606 1.00 22.32 C ATOM 0 H ILE A 21 16.448 -9.019 0.410 1.00 14.22 H new ATOM 0 HA ILE A 21 17.445 -6.514 1.633 1.00 22.24 H new ATOM 0 HB ILE A 21 14.842 -7.132 0.181 1.00 33.12 H new ATOM 0 HG12 ILE A 21 16.993 -5.035 -0.295 1.00 12.03 H new ATOM 0 HG13 ILE A 21 16.787 -6.504 -1.228 1.00 12.03 H new ATOM 0 HG21 ILE A 21 14.133 -4.865 0.788 1.00 4.34 H new ATOM 0 HG22 ILE A 21 14.350 -5.902 2.218 1.00 4.34 H new ATOM 0 HG23 ILE A 21 15.584 -4.689 1.802 1.00 4.34 H new ATOM 0 HD11 ILE A 21 15.881 -4.573 -2.423 1.00 22.32 H new ATOM 0 HD12 ILE A 21 14.580 -5.715 -2.010 1.00 22.32 H new ATOM 0 HD13 ILE A 21 14.788 -4.223 -1.063 1.00 22.32 H new ATOM 303 N THR A 22 16.407 -7.225 3.790 1.00 42.24 N ATOM 304 CA THR A 22 15.899 -7.719 5.045 1.00 51.43 C ATOM 305 C THR A 22 15.152 -6.638 5.808 1.00 52.23 C ATOM 306 O THR A 22 15.631 -5.499 5.918 1.00 1.01 O ATOM 307 CB THR A 22 17.038 -8.316 5.904 1.00 4.42 C ATOM 308 OG1 THR A 22 18.108 -7.357 6.043 1.00 23.31 O ATOM 309 CG2 THR A 22 17.582 -9.580 5.261 1.00 34.41 C ATOM 0 H THR A 22 17.087 -6.469 3.870 1.00 42.24 H new ATOM 0 HA THR A 22 15.188 -8.514 4.823 1.00 51.43 H new ATOM 0 HB THR A 22 16.634 -8.559 6.887 1.00 4.42 H new ATOM 0 HG1 THR A 22 17.857 -6.520 5.598 1.00 23.31 H new ATOM 0 HG21 THR A 22 18.383 -9.987 5.879 1.00 34.41 H new ATOM 0 HG22 THR A 22 16.783 -10.316 5.172 1.00 34.41 H new ATOM 0 HG23 THR A 22 17.971 -9.346 4.270 1.00 34.41 H new ATOM 317 N CYS A 23 13.989 -6.987 6.323 1.00 0.53 N ATOM 318 CA CYS A 23 13.197 -6.069 7.071 1.00 3.20 C ATOM 319 C CYS A 23 12.928 -6.629 8.449 1.00 42.14 C ATOM 320 O CYS A 23 12.638 -7.823 8.600 1.00 11.24 O ATOM 321 CB CYS A 23 11.885 -5.765 6.351 1.00 55.32 C ATOM 322 SG CYS A 23 10.832 -4.549 7.206 1.00 50.41 S ATOM 0 H CYS A 23 13.579 -7.916 6.227 1.00 0.53 H new ATOM 0 HA CYS A 23 13.749 -5.134 7.168 1.00 3.20 H new ATOM 0 HB2 CYS A 23 12.109 -5.396 5.350 1.00 55.32 H new ATOM 0 HB3 CYS A 23 11.326 -6.693 6.230 1.00 55.32 H new ATOM 327 N GLN A 24 13.049 -5.782 9.444 1.00 1.23 N ATOM 328 CA GLN A 24 12.825 -6.163 10.822 1.00 21.35 C ATOM 329 C GLN A 24 11.833 -5.210 11.450 1.00 42.41 C ATOM 330 O GLN A 24 12.048 -3.992 11.451 1.00 22.33 O ATOM 331 CB GLN A 24 14.129 -6.109 11.596 1.00 53.43 C ATOM 332 CG GLN A 24 15.223 -6.963 11.012 1.00 52.52 C ATOM 333 CD GLN A 24 16.503 -6.838 11.785 1.00 60.22 C ATOM 334 OE1 GLN A 24 17.331 -5.965 11.512 1.00 53.44 O ATOM 335 NE2 GLN A 24 16.692 -7.709 12.715 1.00 61.13 N ATOM 0 H GLN A 24 13.307 -4.803 9.321 1.00 1.23 H new ATOM 0 HA GLN A 24 12.433 -7.180 10.851 1.00 21.35 H new ATOM 0 HB2 GLN A 24 14.472 -5.075 11.638 1.00 53.43 H new ATOM 0 HB3 GLN A 24 13.944 -6.425 12.623 1.00 53.43 H new ATOM 0 HG2 GLN A 24 14.904 -8.005 11.003 1.00 52.52 H new ATOM 0 HG3 GLN A 24 15.395 -6.674 9.975 1.00 52.52 H new ATOM 0 HE21 GLN A 24 15.980 -8.413 12.907 1.00 61.13 H new ATOM 0 HE22 GLN A 24 17.554 -7.694 13.260 1.00 61.13 H new ATOM 344 N ALA A 25 10.771 -5.738 11.965 1.00 43.01 N ATOM 345 CA ALA A 25 9.738 -4.923 12.568 1.00 24.52 C ATOM 346 C ALA A 25 10.004 -4.706 14.062 1.00 45.20 C ATOM 347 O ALA A 25 10.794 -5.434 14.677 1.00 34.02 O ATOM 348 CB ALA A 25 8.387 -5.577 12.354 1.00 53.13 C ATOM 0 H ALA A 25 10.584 -6.741 11.986 1.00 43.01 H new ATOM 0 HA ALA A 25 9.742 -3.944 12.089 1.00 24.52 H new ATOM 0 HB1 ALA A 25 7.609 -4.963 12.808 1.00 53.13 H new ATOM 0 HB2 ALA A 25 8.195 -5.674 11.285 1.00 53.13 H new ATOM 0 HB3 ALA A 25 8.384 -6.565 12.814 1.00 53.13 H new ATOM 354 N SER A 26 9.378 -3.693 14.635 1.00 41.40 N ATOM 355 CA SER A 26 9.477 -3.440 16.060 1.00 41.53 C ATOM 356 C SER A 26 8.519 -4.367 16.821 1.00 1.25 C ATOM 357 O SER A 26 8.790 -4.800 17.945 1.00 13.21 O ATOM 358 CB SER A 26 9.184 -1.960 16.351 1.00 3.44 C ATOM 359 OG SER A 26 7.952 -1.558 15.760 1.00 13.31 O ATOM 0 H SER A 26 8.792 -3.028 14.130 1.00 41.40 H new ATOM 0 HA SER A 26 10.490 -3.652 16.401 1.00 41.53 H new ATOM 0 HB2 SER A 26 9.145 -1.798 17.428 1.00 3.44 H new ATOM 0 HB3 SER A 26 9.995 -1.342 15.965 1.00 3.44 H new ATOM 0 HG SER A 26 7.634 -0.738 16.193 1.00 13.31 H new ATOM 365 N GLN A 27 7.426 -4.690 16.180 1.00 35.43 N ATOM 366 CA GLN A 27 6.419 -5.568 16.720 1.00 14.41 C ATOM 367 C GLN A 27 6.328 -6.783 15.819 1.00 61.24 C ATOM 368 O GLN A 27 6.589 -6.679 14.633 1.00 24.51 O ATOM 369 CB GLN A 27 5.057 -4.836 16.796 1.00 63.44 C ATOM 370 CG GLN A 27 3.901 -5.703 17.281 1.00 65.40 C ATOM 371 CD GLN A 27 2.599 -4.951 17.445 1.00 23.44 C ATOM 372 OE1 GLN A 27 2.314 -4.409 18.509 1.00 62.41 O ATOM 373 NE2 GLN A 27 1.780 -4.938 16.419 1.00 64.55 N ATOM 0 H GLN A 27 7.206 -4.342 15.247 1.00 35.43 H new ATOM 0 HA GLN A 27 6.684 -5.876 17.731 1.00 14.41 H new ATOM 0 HB2 GLN A 27 5.156 -3.979 17.462 1.00 63.44 H new ATOM 0 HB3 GLN A 27 4.813 -4.446 15.808 1.00 63.44 H new ATOM 0 HG2 GLN A 27 3.751 -6.520 16.575 1.00 65.40 H new ATOM 0 HG3 GLN A 27 4.173 -6.153 18.236 1.00 65.40 H new ATOM 0 HE21 GLN A 27 2.046 -5.398 15.548 1.00 64.55 H new ATOM 0 HE22 GLN A 27 0.878 -4.468 16.493 1.00 64.55 H new ATOM 382 N ASP A 28 5.999 -7.926 16.379 1.00 5.30 N ATOM 383 CA ASP A 28 5.860 -9.137 15.582 1.00 22.10 C ATOM 384 C ASP A 28 4.603 -9.022 14.749 1.00 2.54 C ATOM 385 O ASP A 28 3.498 -8.927 15.292 1.00 43.14 O ATOM 386 CB ASP A 28 5.765 -10.361 16.479 1.00 12.13 C ATOM 387 CG ASP A 28 5.748 -11.661 15.715 1.00 50.51 C ATOM 388 OD1 ASP A 28 4.681 -12.058 15.183 1.00 32.13 O ATOM 389 OD2 ASP A 28 6.802 -12.320 15.663 1.00 34.41 O ATOM 0 H ASP A 28 5.823 -8.048 17.376 1.00 5.30 H new ATOM 0 HA ASP A 28 6.734 -9.249 14.940 1.00 22.10 H new ATOM 0 HB2 ASP A 28 6.609 -10.364 17.168 1.00 12.13 H new ATOM 0 HB3 ASP A 28 4.860 -10.291 17.083 1.00 12.13 H new ATOM 394 N ILE A 29 4.765 -9.014 13.452 1.00 22.44 N ATOM 395 CA ILE A 29 3.643 -8.833 12.542 1.00 41.02 C ATOM 396 C ILE A 29 3.275 -10.172 11.897 1.00 41.34 C ATOM 397 O ILE A 29 2.428 -10.255 11.006 1.00 71.51 O ATOM 398 CB ILE A 29 3.976 -7.776 11.456 1.00 75.40 C ATOM 399 CG1 ILE A 29 5.118 -8.248 10.570 1.00 70.40 C ATOM 400 CG2 ILE A 29 4.368 -6.461 12.126 1.00 34.15 C ATOM 401 CD1 ILE A 29 5.435 -7.301 9.438 1.00 21.32 C ATOM 0 H ILE A 29 5.667 -9.131 12.990 1.00 22.44 H new ATOM 0 HA ILE A 29 2.788 -8.468 13.111 1.00 41.02 H new ATOM 0 HB ILE A 29 3.091 -7.630 10.836 1.00 75.40 H new ATOM 0 HG12 ILE A 29 6.010 -8.381 11.182 1.00 70.40 H new ATOM 0 HG13 ILE A 29 4.866 -9.224 10.156 1.00 70.40 H new ATOM 0 HG21 ILE A 29 4.602 -5.719 11.362 1.00 34.15 H new ATOM 0 HG22 ILE A 29 3.540 -6.103 12.738 1.00 34.15 H new ATOM 0 HG23 ILE A 29 5.243 -6.621 12.757 1.00 34.15 H new ATOM 0 HD11 ILE A 29 6.259 -7.702 8.848 1.00 21.32 H new ATOM 0 HD12 ILE A 29 4.557 -7.186 8.803 1.00 21.32 H new ATOM 0 HD13 ILE A 29 5.718 -6.330 9.844 1.00 21.32 H new ATOM 413 N SER A 30 3.927 -11.203 12.380 1.00 22.23 N ATOM 414 CA SER A 30 3.748 -12.579 11.962 1.00 12.33 C ATOM 415 C SER A 30 3.934 -12.815 10.445 1.00 54.32 C ATOM 416 O SER A 30 5.046 -13.007 9.987 1.00 52.31 O ATOM 417 CB SER A 30 2.450 -13.160 12.517 1.00 32.12 C ATOM 418 OG SER A 30 2.455 -13.067 13.941 1.00 22.13 O ATOM 0 H SER A 30 4.632 -11.103 13.111 1.00 22.23 H new ATOM 0 HA SER A 30 4.568 -13.142 12.407 1.00 12.33 H new ATOM 0 HB2 SER A 30 1.595 -12.620 12.110 1.00 32.12 H new ATOM 0 HB3 SER A 30 2.345 -14.201 12.211 1.00 32.12 H new ATOM 0 HG SER A 30 3.321 -12.723 14.243 1.00 22.13 H new ATOM 424 N ASN A 31 2.870 -12.807 9.685 1.00 25.12 N ATOM 425 CA ASN A 31 2.986 -13.008 8.237 1.00 70.52 C ATOM 426 C ASN A 31 2.449 -11.811 7.504 1.00 73.30 C ATOM 427 O ASN A 31 2.459 -11.765 6.267 1.00 50.51 O ATOM 428 CB ASN A 31 2.213 -14.253 7.789 1.00 42.21 C ATOM 429 CG ASN A 31 0.710 -14.110 7.968 1.00 64.55 C ATOM 430 OD1 ASN A 31 0.165 -14.418 9.026 1.00 35.21 O ATOM 431 ND2 ASN A 31 0.033 -13.657 6.944 1.00 14.24 N ATOM 0 H ASN A 31 1.918 -12.667 10.025 1.00 25.12 H new ATOM 0 HA ASN A 31 4.042 -13.144 8.004 1.00 70.52 H new ATOM 0 HB2 ASN A 31 2.432 -14.453 6.740 1.00 42.21 H new ATOM 0 HB3 ASN A 31 2.561 -15.115 8.357 1.00 42.21 H new ATOM 0 HD21 ASN A 31 -0.979 -13.550 7.009 1.00 14.24 H new ATOM 0 HD22 ASN A 31 0.518 -13.411 6.081 1.00 14.24 H new ATOM 438 N TYR A 32 1.980 -10.844 8.252 1.00 1.14 N ATOM 439 CA TYR A 32 1.302 -9.732 7.668 1.00 50.13 C ATOM 440 C TYR A 32 2.290 -8.685 7.189 1.00 10.44 C ATOM 441 O TYR A 32 2.609 -7.742 7.902 1.00 33.11 O ATOM 442 CB TYR A 32 0.273 -9.141 8.649 1.00 2.23 C ATOM 443 CG TYR A 32 -0.706 -10.176 9.199 1.00 54.12 C ATOM 444 CD1 TYR A 32 -1.700 -10.721 8.400 1.00 30.23 C ATOM 445 CD2 TYR A 32 -0.613 -10.617 10.513 1.00 63.23 C ATOM 446 CE1 TYR A 32 -2.578 -11.667 8.892 1.00 13.54 C ATOM 447 CE2 TYR A 32 -1.483 -11.566 11.013 1.00 21.54 C ATOM 448 CZ TYR A 32 -2.464 -12.086 10.198 1.00 22.41 C ATOM 449 OH TYR A 32 -3.332 -13.038 10.692 1.00 51.12 O ATOM 0 H TYR A 32 2.059 -10.811 9.268 1.00 1.14 H new ATOM 0 HA TYR A 32 0.754 -10.085 6.794 1.00 50.13 H new ATOM 0 HB2 TYR A 32 0.801 -8.674 9.480 1.00 2.23 H new ATOM 0 HB3 TYR A 32 -0.288 -8.354 8.145 1.00 2.23 H new ATOM 0 HD1 TYR A 32 -1.789 -10.399 7.373 1.00 30.23 H new ATOM 0 HD2 TYR A 32 0.154 -10.210 11.156 1.00 63.23 H new ATOM 0 HE1 TYR A 32 -3.349 -12.075 8.256 1.00 13.54 H new ATOM 0 HE2 TYR A 32 -1.395 -11.898 12.037 1.00 21.54 H new ATOM 0 HH TYR A 32 -3.115 -13.223 11.630 1.00 51.12 H new ATOM 459 N LEU A 33 2.790 -8.883 5.985 1.00 53.42 N ATOM 460 CA LEU A 33 3.783 -8.020 5.418 1.00 65.50 C ATOM 461 C LEU A 33 3.550 -7.808 3.934 1.00 20.14 C ATOM 462 O LEU A 33 3.345 -8.779 3.188 1.00 75.13 O ATOM 463 CB LEU A 33 5.156 -8.647 5.606 1.00 13.42 C ATOM 464 CG LEU A 33 6.313 -7.887 4.990 1.00 14.41 C ATOM 465 CD1 LEU A 33 6.502 -6.555 5.651 1.00 64.22 C ATOM 466 CD2 LEU A 33 7.567 -8.692 5.053 1.00 42.34 C ATOM 0 H LEU A 33 2.511 -9.653 5.377 1.00 53.42 H new ATOM 0 HA LEU A 33 3.721 -7.056 5.923 1.00 65.50 H new ATOM 0 HB2 LEU A 33 5.343 -8.755 6.674 1.00 13.42 H new ATOM 0 HB3 LEU A 33 5.138 -9.651 5.183 1.00 13.42 H new ATOM 0 HG LEU A 33 6.074 -7.707 3.942 1.00 14.41 H new ATOM 0 HD11 LEU A 33 7.339 -6.034 5.187 1.00 64.22 H new ATOM 0 HD12 LEU A 33 5.596 -5.960 5.536 1.00 64.22 H new ATOM 0 HD13 LEU A 33 6.708 -6.701 6.711 1.00 64.22 H new ATOM 0 HD21 LEU A 33 8.385 -8.127 4.605 1.00 42.34 H new ATOM 0 HD22 LEU A 33 7.806 -8.913 6.093 1.00 42.34 H new ATOM 0 HD23 LEU A 33 7.428 -9.625 4.506 1.00 42.34 H new ATOM 478 N ASN A 34 3.565 -6.556 3.506 1.00 30.04 N ATOM 479 CA ASN A 34 3.504 -6.224 2.088 1.00 23.44 C ATOM 480 C ASN A 34 4.818 -5.607 1.656 1.00 62.40 C ATOM 481 O ASN A 34 5.454 -4.869 2.425 1.00 62.30 O ATOM 482 CB ASN A 34 2.348 -5.254 1.744 1.00 11.12 C ATOM 483 CG ASN A 34 0.954 -5.848 1.811 1.00 31.31 C ATOM 484 OD1 ASN A 34 0.773 -6.805 2.626 1.00 43.33 O flip ATOM 485 ND2 ASN A 34 0.050 -5.427 1.105 1.00 54.13 N flip ATOM 0 H ASN A 34 3.619 -5.746 4.124 1.00 30.04 H new ATOM 0 HA ASN A 34 3.317 -7.154 1.551 1.00 23.44 H new ATOM 0 HB2 ASN A 34 2.395 -4.405 2.425 1.00 11.12 H new ATOM 0 HB3 ASN A 34 2.510 -4.865 0.739 1.00 11.12 H new ATOM 0 HD21 ASN A 34 0.224 -4.657 0.459 1.00 54.13 H new ATOM 0 HD22 ASN A 34 -0.878 -5.846 1.162 1.00 54.13 H new ATOM 492 N TRP A 35 5.237 -5.920 0.457 1.00 61.12 N ATOM 493 CA TRP A 35 6.438 -5.346 -0.114 1.00 42.22 C ATOM 494 C TRP A 35 6.068 -4.454 -1.246 1.00 50.31 C ATOM 495 O TRP A 35 5.329 -4.857 -2.105 1.00 65.22 O ATOM 496 CB TRP A 35 7.406 -6.427 -0.608 1.00 5.15 C ATOM 497 CG TRP A 35 8.087 -7.143 0.491 1.00 54.24 C ATOM 498 CD1 TRP A 35 7.759 -8.352 1.050 1.00 62.20 C ATOM 499 CD2 TRP A 35 9.237 -6.668 1.178 1.00 34.41 C ATOM 500 NE1 TRP A 35 8.649 -8.638 2.061 1.00 32.15 N ATOM 501 CE2 TRP A 35 9.566 -7.609 2.159 1.00 32.40 C ATOM 502 CE3 TRP A 35 10.018 -5.515 1.049 1.00 22.42 C ATOM 503 CZ2 TRP A 35 10.657 -7.431 3.023 1.00 21.32 C ATOM 504 CZ3 TRP A 35 11.090 -5.336 1.888 1.00 2.11 C ATOM 505 CH2 TRP A 35 11.407 -6.281 2.864 1.00 61.15 C ATOM 0 H TRP A 35 4.758 -6.580 -0.155 1.00 61.12 H new ATOM 0 HA TRP A 35 6.944 -4.777 0.666 1.00 42.22 H new ATOM 0 HB2 TRP A 35 6.858 -7.146 -1.217 1.00 5.15 H new ATOM 0 HB3 TRP A 35 8.155 -5.968 -1.253 1.00 5.15 H new ATOM 0 HD1 TRP A 35 6.934 -8.979 0.746 1.00 62.20 H new ATOM 0 HE1 TRP A 35 8.634 -9.475 2.644 1.00 32.15 H new ATOM 0 HE3 TRP A 35 9.781 -4.775 0.299 1.00 22.42 H new ATOM 0 HZ2 TRP A 35 10.900 -8.162 3.780 1.00 21.32 H new ATOM 0 HZ3 TRP A 35 11.698 -4.449 1.791 1.00 2.11 H new ATOM 0 HH2 TRP A 35 12.256 -6.110 3.509 1.00 61.15 H new ATOM 516 N TYR A 36 6.592 -3.262 -1.257 1.00 23.13 N ATOM 517 CA TYR A 36 6.270 -2.294 -2.298 1.00 75.15 C ATOM 518 C TYR A 36 7.489 -1.819 -3.055 1.00 70.02 C ATOM 519 O TYR A 36 8.605 -1.763 -2.506 1.00 34.20 O ATOM 520 CB TYR A 36 5.561 -1.065 -1.721 1.00 62.33 C ATOM 521 CG TYR A 36 4.149 -1.281 -1.237 1.00 43.42 C ATOM 522 CD1 TYR A 36 3.877 -2.048 -0.129 1.00 23.14 C ATOM 523 CD2 TYR A 36 3.086 -0.673 -1.880 1.00 24.53 C ATOM 524 CE1 TYR A 36 2.595 -2.206 0.320 1.00 51.34 C ATOM 525 CE2 TYR A 36 1.799 -0.835 -1.434 1.00 33.21 C ATOM 526 CZ TYR A 36 1.564 -1.605 -0.327 1.00 20.43 C ATOM 527 OH TYR A 36 0.291 -1.773 0.140 1.00 74.51 O ATOM 0 H TYR A 36 7.251 -2.923 -0.556 1.00 23.13 H new ATOM 0 HA TYR A 36 5.611 -2.822 -2.987 1.00 75.15 H new ATOM 0 HB2 TYR A 36 6.155 -0.685 -0.889 1.00 62.33 H new ATOM 0 HB3 TYR A 36 5.547 -0.287 -2.484 1.00 62.33 H new ATOM 0 HD1 TYR A 36 4.688 -2.533 0.395 1.00 23.14 H new ATOM 0 HD2 TYR A 36 3.273 -0.060 -2.749 1.00 24.53 H new ATOM 0 HE1 TYR A 36 2.402 -2.812 1.193 1.00 51.34 H new ATOM 0 HE2 TYR A 36 0.979 -0.360 -1.951 1.00 33.21 H new ATOM 0 HH TYR A 36 -0.209 -0.937 0.034 1.00 74.51 H new ATOM 537 N GLN A 37 7.247 -1.440 -4.300 1.00 41.44 N ATOM 538 CA GLN A 37 8.234 -0.865 -5.187 1.00 72.52 C ATOM 539 C GLN A 37 7.822 0.569 -5.439 1.00 3.12 C ATOM 540 O GLN A 37 6.729 0.830 -5.936 1.00 33.44 O ATOM 541 CB GLN A 37 8.225 -1.605 -6.544 1.00 31.22 C ATOM 542 CG GLN A 37 9.157 -1.019 -7.597 1.00 24.52 C ATOM 543 CD GLN A 37 8.966 -1.654 -8.970 1.00 15.45 C ATOM 544 OE1 GLN A 37 8.144 -1.189 -9.771 1.00 62.24 O ATOM 545 NE2 GLN A 37 9.732 -2.669 -9.279 1.00 24.21 N ATOM 0 H GLN A 37 6.327 -1.529 -4.731 1.00 41.44 H new ATOM 0 HA GLN A 37 9.226 -0.939 -4.742 1.00 72.52 H new ATOM 0 HB2 GLN A 37 8.499 -2.647 -6.376 1.00 31.22 H new ATOM 0 HB3 GLN A 37 7.208 -1.602 -6.937 1.00 31.22 H new ATOM 0 HG2 GLN A 37 8.986 0.055 -7.671 1.00 24.52 H new ATOM 0 HG3 GLN A 37 10.190 -1.156 -7.278 1.00 24.52 H new ATOM 0 HE21 GLN A 37 10.400 -3.030 -8.598 1.00 24.21 H new ATOM 0 HE22 GLN A 37 9.661 -3.099 -10.201 1.00 24.21 H new ATOM 554 N GLN A 38 8.662 1.487 -5.059 1.00 73.40 N ATOM 555 CA GLN A 38 8.395 2.879 -5.286 1.00 51.34 C ATOM 556 C GLN A 38 9.432 3.405 -6.247 1.00 21.55 C ATOM 557 O GLN A 38 10.631 3.391 -5.953 1.00 10.54 O ATOM 558 CB GLN A 38 8.360 3.649 -3.931 1.00 63.43 C ATOM 559 CG GLN A 38 8.005 5.152 -4.004 1.00 61.12 C ATOM 560 CD GLN A 38 9.134 6.041 -4.512 1.00 2.42 C ATOM 561 OE1 GLN A 38 10.310 5.751 -4.307 1.00 33.02 O ATOM 562 NE2 GLN A 38 8.791 7.117 -5.159 1.00 70.32 N ATOM 0 H GLN A 38 9.545 1.295 -4.586 1.00 73.40 H new ATOM 0 HA GLN A 38 7.413 3.026 -5.736 1.00 51.34 H new ATOM 0 HB2 GLN A 38 7.638 3.159 -3.278 1.00 63.43 H new ATOM 0 HB3 GLN A 38 9.337 3.551 -3.457 1.00 63.43 H new ATOM 0 HG2 GLN A 38 7.139 5.277 -4.654 1.00 61.12 H new ATOM 0 HG3 GLN A 38 7.710 5.492 -3.011 1.00 61.12 H new ATOM 0 HE21 GLN A 38 7.805 7.328 -5.312 1.00 70.32 H new ATOM 0 HE22 GLN A 38 9.508 7.750 -5.513 1.00 70.32 H new ATOM 571 N LYS A 39 8.977 3.786 -7.413 1.00 5.20 N ATOM 572 CA LYS A 39 9.814 4.327 -8.432 1.00 55.52 C ATOM 573 C LYS A 39 9.284 5.682 -8.868 1.00 74.32 C ATOM 574 O LYS A 39 8.071 5.934 -8.784 1.00 62.42 O ATOM 575 CB LYS A 39 9.935 3.403 -9.634 1.00 53.42 C ATOM 576 CG LYS A 39 8.654 3.147 -10.373 1.00 22.20 C ATOM 577 CD LYS A 39 8.920 2.436 -11.675 1.00 24.04 C ATOM 578 CE LYS A 39 9.639 1.112 -11.461 1.00 20.53 C ATOM 579 NZ LYS A 39 9.833 0.373 -12.722 1.00 14.12 N ATOM 0 H LYS A 39 7.994 3.724 -7.678 1.00 5.20 H new ATOM 0 HA LYS A 39 10.813 4.438 -8.009 1.00 55.52 H new ATOM 0 HB2 LYS A 39 10.658 3.830 -10.329 1.00 53.42 H new ATOM 0 HB3 LYS A 39 10.340 2.448 -9.299 1.00 53.42 H new ATOM 0 HG2 LYS A 39 7.986 2.546 -9.755 1.00 22.20 H new ATOM 0 HG3 LYS A 39 8.146 4.092 -10.567 1.00 22.20 H new ATOM 0 HD2 LYS A 39 7.976 2.258 -12.191 1.00 24.04 H new ATOM 0 HD3 LYS A 39 9.521 3.075 -12.322 1.00 24.04 H new ATOM 0 HE2 LYS A 39 10.608 1.298 -10.998 1.00 20.53 H new ATOM 0 HE3 LYS A 39 9.066 0.498 -10.766 1.00 20.53 H new ATOM 0 HZ1 LYS A 39 10.628 -0.290 -12.617 1.00 14.12 H new ATOM 0 HZ2 LYS A 39 8.968 -0.157 -12.950 1.00 14.12 H new ATOM 0 HZ3 LYS A 39 10.040 1.044 -13.489 1.00 14.12 H new ATOM 593 N PRO A 40 10.171 6.570 -9.309 1.00 52.35 N ATOM 594 CA PRO A 40 9.795 7.912 -9.753 1.00 10.34 C ATOM 595 C PRO A 40 8.818 7.857 -10.931 1.00 53.53 C ATOM 596 O PRO A 40 9.066 7.170 -11.930 1.00 51.51 O ATOM 597 CB PRO A 40 11.124 8.547 -10.188 1.00 42.12 C ATOM 598 CG PRO A 40 12.061 7.400 -10.386 1.00 21.41 C ATOM 599 CD PRO A 40 11.609 6.320 -9.456 1.00 63.14 C ATOM 0 HA PRO A 40 9.289 8.476 -8.970 1.00 10.34 H new ATOM 0 HB2 PRO A 40 11.004 9.120 -11.107 1.00 42.12 H new ATOM 0 HB3 PRO A 40 11.498 9.235 -9.430 1.00 42.12 H new ATOM 0 HG2 PRO A 40 12.040 7.056 -11.420 1.00 21.41 H new ATOM 0 HG3 PRO A 40 13.088 7.695 -10.169 1.00 21.41 H new ATOM 0 HD2 PRO A 40 11.804 5.330 -9.867 1.00 63.14 H new ATOM 0 HD3 PRO A 40 12.125 6.374 -8.498 1.00 63.14 H new ATOM 607 N GLY A 41 7.705 8.554 -10.803 1.00 75.50 N ATOM 608 CA GLY A 41 6.702 8.558 -11.852 1.00 60.24 C ATOM 609 C GLY A 41 5.621 7.526 -11.606 1.00 63.21 C ATOM 610 O GLY A 41 4.667 7.411 -12.374 1.00 62.55 O ATOM 0 H GLY A 41 7.473 9.122 -9.988 1.00 75.50 H new ATOM 0 HA2 GLY A 41 6.250 9.548 -11.918 1.00 60.24 H new ATOM 0 HA3 GLY A 41 7.180 8.361 -12.812 1.00 60.24 H new ATOM 614 N LYS A 42 5.777 6.772 -10.544 1.00 61.20 N ATOM 615 CA LYS A 42 4.810 5.776 -10.148 1.00 62.44 C ATOM 616 C LYS A 42 4.355 5.954 -8.753 1.00 34.33 C ATOM 617 O LYS A 42 4.882 6.777 -7.990 1.00 71.14 O ATOM 618 CB LYS A 42 5.335 4.352 -10.276 1.00 43.31 C ATOM 619 CG LYS A 42 5.257 3.739 -11.641 1.00 51.23 C ATOM 620 CD LYS A 42 3.816 3.570 -12.091 1.00 22.55 C ATOM 621 CE LYS A 42 3.727 2.785 -13.385 1.00 14.03 C ATOM 622 NZ LYS A 42 4.234 1.397 -13.233 1.00 51.33 N ATOM 0 H LYS A 42 6.586 6.833 -9.925 1.00 61.20 H new ATOM 0 HA LYS A 42 3.978 5.923 -10.837 1.00 62.44 H new ATOM 0 HB2 LYS A 42 6.376 4.340 -9.954 1.00 43.31 H new ATOM 0 HB3 LYS A 42 4.780 3.719 -9.584 1.00 43.31 H new ATOM 0 HG2 LYS A 42 5.791 4.366 -12.354 1.00 51.23 H new ATOM 0 HG3 LYS A 42 5.754 2.769 -11.635 1.00 51.23 H new ATOM 0 HD2 LYS A 42 3.249 3.058 -11.314 1.00 22.55 H new ATOM 0 HD3 LYS A 42 3.359 4.550 -12.226 1.00 22.55 H new ATOM 0 HE2 LYS A 42 2.690 2.757 -13.721 1.00 14.03 H new ATOM 0 HE3 LYS A 42 4.299 3.297 -14.159 1.00 14.03 H new ATOM 0 HZ1 LYS A 42 3.886 0.812 -14.019 1.00 51.33 H new ATOM 0 HZ2 LYS A 42 5.274 1.404 -13.241 1.00 51.33 H new ATOM 0 HZ3 LYS A 42 3.897 1.001 -12.332 1.00 51.33 H new ATOM 636 N ALA A 43 3.375 5.196 -8.444 1.00 14.42 N ATOM 637 CA ALA A 43 2.869 5.056 -7.119 1.00 55.10 C ATOM 638 C ALA A 43 3.450 3.758 -6.623 1.00 73.25 C ATOM 639 O ALA A 43 3.773 2.893 -7.451 1.00 2.31 O ATOM 640 CB ALA A 43 1.352 4.982 -7.140 1.00 14.31 C ATOM 0 H ALA A 43 2.877 4.629 -9.130 1.00 14.42 H new ATOM 0 HA ALA A 43 3.137 5.899 -6.482 1.00 55.10 H new ATOM 0 HB1 ALA A 43 0.979 4.875 -6.121 1.00 14.31 H new ATOM 0 HB2 ALA A 43 0.949 5.894 -7.580 1.00 14.31 H new ATOM 0 HB3 ALA A 43 1.038 4.123 -7.733 1.00 14.31 H new ATOM 646 N PRO A 44 3.640 3.570 -5.326 1.00 40.04 N ATOM 647 CA PRO A 44 4.219 2.345 -4.855 1.00 64.02 C ATOM 648 C PRO A 44 3.242 1.180 -5.009 1.00 42.54 C ATOM 649 O PRO A 44 2.177 1.149 -4.388 1.00 72.21 O ATOM 650 CB PRO A 44 4.525 2.635 -3.370 1.00 30.00 C ATOM 651 CG PRO A 44 3.554 3.699 -2.988 1.00 60.12 C ATOM 652 CD PRO A 44 3.300 4.503 -4.236 1.00 0.41 C ATOM 0 HA PRO A 44 5.107 2.051 -5.415 1.00 64.02 H new ATOM 0 HB2 PRO A 44 4.397 1.743 -2.757 1.00 30.00 H new ATOM 0 HB3 PRO A 44 5.554 2.970 -3.235 1.00 30.00 H new ATOM 0 HG2 PRO A 44 2.629 3.264 -2.610 1.00 60.12 H new ATOM 0 HG3 PRO A 44 3.958 4.328 -2.195 1.00 60.12 H new ATOM 0 HD2 PRO A 44 2.262 4.830 -4.298 1.00 0.41 H new ATOM 0 HD3 PRO A 44 3.919 5.399 -4.268 1.00 0.41 H new ATOM 660 N LYS A 45 3.602 0.234 -5.837 1.00 23.43 N ATOM 661 CA LYS A 45 2.800 -0.936 -6.000 1.00 61.24 C ATOM 662 C LYS A 45 3.452 -2.048 -5.275 1.00 71.14 C ATOM 663 O LYS A 45 4.685 -2.191 -5.309 1.00 73.21 O ATOM 664 CB LYS A 45 2.536 -1.356 -7.462 1.00 44.42 C ATOM 665 CG LYS A 45 1.627 -2.594 -7.498 1.00 43.11 C ATOM 666 CD LYS A 45 1.362 -3.179 -8.866 1.00 73.05 C ATOM 667 CE LYS A 45 0.501 -4.427 -8.688 1.00 53.35 C ATOM 668 NZ LYS A 45 0.171 -5.118 -9.946 1.00 13.34 N ATOM 0 H LYS A 45 4.448 0.257 -6.407 1.00 23.43 H new ATOM 0 HA LYS A 45 1.817 -0.694 -5.595 1.00 61.24 H new ATOM 0 HB2 LYS A 45 2.068 -0.535 -8.006 1.00 44.42 H new ATOM 0 HB3 LYS A 45 3.480 -1.573 -7.963 1.00 44.42 H new ATOM 0 HG2 LYS A 45 2.074 -3.368 -6.874 1.00 43.11 H new ATOM 0 HG3 LYS A 45 0.671 -2.332 -7.045 1.00 43.11 H new ATOM 0 HD2 LYS A 45 0.853 -2.452 -9.499 1.00 73.05 H new ATOM 0 HD3 LYS A 45 2.300 -3.431 -9.361 1.00 73.05 H new ATOM 0 HE2 LYS A 45 1.022 -5.123 -8.030 1.00 53.35 H new ATOM 0 HE3 LYS A 45 -0.425 -4.147 -8.187 1.00 53.35 H new ATOM 0 HZ1 LYS A 45 -0.074 -6.108 -9.744 1.00 13.34 H new ATOM 0 HZ2 LYS A 45 -0.638 -4.647 -10.399 1.00 13.34 H new ATOM 0 HZ3 LYS A 45 0.991 -5.088 -10.584 1.00 13.34 H new ATOM 682 N LEU A 46 2.673 -2.800 -4.584 1.00 71.11 N ATOM 683 CA LEU A 46 3.185 -3.877 -3.859 1.00 30.11 C ATOM 684 C LEU A 46 3.462 -5.061 -4.768 1.00 42.53 C ATOM 685 O LEU A 46 2.746 -5.302 -5.743 1.00 14.42 O ATOM 686 CB LEU A 46 2.288 -4.200 -2.662 1.00 55.34 C ATOM 687 CG LEU A 46 0.926 -4.775 -2.942 1.00 60.41 C ATOM 688 CD1 LEU A 46 1.038 -6.248 -3.141 1.00 71.03 C ATOM 689 CD2 LEU A 46 -0.023 -4.438 -1.840 1.00 21.31 C ATOM 0 H LEU A 46 1.663 -2.676 -4.513 1.00 71.11 H new ATOM 0 HA LEU A 46 4.152 -3.602 -3.437 1.00 30.11 H new ATOM 0 HB2 LEU A 46 2.823 -4.902 -2.022 1.00 55.34 H new ATOM 0 HB3 LEU A 46 2.153 -3.284 -2.087 1.00 55.34 H new ATOM 0 HG LEU A 46 0.528 -4.335 -3.856 1.00 60.41 H new ATOM 0 HD11 LEU A 46 0.051 -6.664 -3.344 1.00 71.03 H new ATOM 0 HD12 LEU A 46 1.698 -6.452 -3.984 1.00 71.03 H new ATOM 0 HD13 LEU A 46 1.447 -6.707 -2.241 1.00 71.03 H new ATOM 0 HD21 LEU A 46 -1.002 -4.862 -2.061 1.00 21.31 H new ATOM 0 HD22 LEU A 46 0.348 -4.850 -0.902 1.00 21.31 H new ATOM 0 HD23 LEU A 46 -0.108 -3.355 -1.752 1.00 21.31 H new ATOM 701 N LEU A 47 4.516 -5.745 -4.464 1.00 52.02 N ATOM 702 CA LEU A 47 4.923 -6.912 -5.185 1.00 31.01 C ATOM 703 C LEU A 47 4.365 -8.104 -4.467 1.00 53.13 C ATOM 704 O LEU A 47 3.971 -9.096 -5.067 1.00 33.20 O ATOM 705 CB LEU A 47 6.475 -7.051 -5.205 1.00 4.23 C ATOM 706 CG LEU A 47 7.311 -5.890 -5.767 1.00 1.14 C ATOM 707 CD1 LEU A 47 6.851 -5.456 -7.147 1.00 1.34 C ATOM 708 CD2 LEU A 47 7.376 -4.739 -4.800 1.00 31.34 C ATOM 0 H LEU A 47 5.134 -5.504 -3.689 1.00 52.02 H new ATOM 0 HA LEU A 47 4.564 -6.839 -6.212 1.00 31.01 H new ATOM 0 HB2 LEU A 47 6.804 -7.231 -4.182 1.00 4.23 H new ATOM 0 HB3 LEU A 47 6.720 -7.944 -5.780 1.00 4.23 H new ATOM 0 HG LEU A 47 8.327 -6.264 -5.892 1.00 1.14 H new ATOM 0 HD11 LEU A 47 7.475 -4.634 -7.497 1.00 1.34 H new ATOM 0 HD12 LEU A 47 6.934 -6.294 -7.839 1.00 1.34 H new ATOM 0 HD13 LEU A 47 5.813 -5.128 -7.098 1.00 1.34 H new ATOM 0 HD21 LEU A 47 7.975 -3.936 -5.230 1.00 31.34 H new ATOM 0 HD22 LEU A 47 6.369 -4.374 -4.601 1.00 31.34 H new ATOM 0 HD23 LEU A 47 7.832 -5.072 -3.868 1.00 31.34 H new ATOM 720 N ILE A 48 4.305 -7.967 -3.162 1.00 73.14 N ATOM 721 CA ILE A 48 3.924 -9.023 -2.275 1.00 12.22 C ATOM 722 C ILE A 48 2.976 -8.478 -1.231 1.00 50.20 C ATOM 723 O ILE A 48 3.154 -7.359 -0.771 1.00 4.25 O ATOM 724 CB ILE A 48 5.179 -9.620 -1.590 1.00 62.03 C ATOM 725 CG1 ILE A 48 6.102 -10.244 -2.643 1.00 62.14 C ATOM 726 CG2 ILE A 48 4.803 -10.626 -0.525 1.00 64.05 C ATOM 727 CD1 ILE A 48 7.353 -10.845 -2.099 1.00 0.42 C ATOM 0 H ILE A 48 4.527 -7.094 -2.684 1.00 73.14 H new ATOM 0 HA ILE A 48 3.428 -9.811 -2.841 1.00 12.22 H new ATOM 0 HB ILE A 48 5.715 -8.813 -1.091 1.00 62.03 H new ATOM 0 HG12 ILE A 48 5.549 -11.015 -3.180 1.00 62.14 H new ATOM 0 HG13 ILE A 48 6.370 -9.478 -3.371 1.00 62.14 H new ATOM 0 HG21 ILE A 48 5.707 -11.025 -0.065 1.00 64.05 H new ATOM 0 HG22 ILE A 48 4.193 -10.139 0.236 1.00 64.05 H new ATOM 0 HG23 ILE A 48 4.237 -11.440 -0.977 1.00 64.05 H new ATOM 0 HD11 ILE A 48 7.942 -11.261 -2.916 1.00 0.42 H new ATOM 0 HD12 ILE A 48 7.933 -10.077 -1.588 1.00 0.42 H new ATOM 0 HD13 ILE A 48 7.100 -11.637 -1.394 1.00 0.42 H new ATOM 739 N TYR A 49 1.982 -9.265 -0.867 1.00 12.41 N ATOM 740 CA TYR A 49 0.965 -8.823 0.087 1.00 62.23 C ATOM 741 C TYR A 49 0.778 -9.774 1.278 1.00 32.30 C ATOM 742 O TYR A 49 0.016 -9.482 2.182 1.00 71.23 O ATOM 743 CB TYR A 49 -0.379 -8.573 -0.610 1.00 11.21 C ATOM 744 CG TYR A 49 -0.931 -9.763 -1.360 1.00 54.15 C ATOM 745 CD1 TYR A 49 -1.535 -10.811 -0.687 1.00 70.14 C ATOM 746 CD2 TYR A 49 -0.851 -9.832 -2.738 1.00 33.41 C ATOM 747 CE1 TYR A 49 -2.043 -11.885 -1.361 1.00 4.14 C ATOM 748 CE2 TYR A 49 -1.358 -10.909 -3.420 1.00 64.42 C ATOM 749 CZ TYR A 49 -1.953 -11.933 -2.731 1.00 74.35 C ATOM 750 OH TYR A 49 -2.477 -13.004 -3.418 1.00 52.21 O ATOM 0 H TYR A 49 1.851 -10.215 -1.214 1.00 12.41 H new ATOM 0 HA TYR A 49 1.339 -7.885 0.496 1.00 62.23 H new ATOM 0 HB2 TYR A 49 -1.108 -8.261 0.138 1.00 11.21 H new ATOM 0 HB3 TYR A 49 -0.263 -7.743 -1.307 1.00 11.21 H new ATOM 0 HD1 TYR A 49 -1.606 -10.779 0.390 1.00 70.14 H new ATOM 0 HD2 TYR A 49 -0.383 -9.027 -3.285 1.00 33.41 H new ATOM 0 HE1 TYR A 49 -2.513 -12.693 -0.819 1.00 4.14 H new ATOM 0 HE2 TYR A 49 -1.288 -10.950 -4.497 1.00 64.42 H new ATOM 0 HH TYR A 49 -2.330 -12.880 -4.379 1.00 52.21 H new ATOM 760 N ASP A 50 1.444 -10.898 1.264 1.00 43.55 N ATOM 761 CA ASP A 50 1.340 -11.845 2.380 1.00 53.51 C ATOM 762 C ASP A 50 2.669 -12.534 2.523 1.00 33.32 C ATOM 763 O ASP A 50 2.814 -13.678 2.113 1.00 15.31 O ATOM 764 CB ASP A 50 0.231 -12.904 2.128 1.00 74.53 C ATOM 765 CG ASP A 50 -0.121 -13.760 3.348 1.00 41.03 C ATOM 766 OD1 ASP A 50 0.590 -14.740 3.647 1.00 32.23 O ATOM 767 OD2 ASP A 50 -1.149 -13.477 4.004 1.00 74.32 O ATOM 0 H ASP A 50 2.062 -11.193 0.508 1.00 43.55 H new ATOM 0 HA ASP A 50 1.076 -11.303 3.288 1.00 53.51 H new ATOM 0 HB2 ASP A 50 -0.670 -12.394 1.786 1.00 74.53 H new ATOM 0 HB3 ASP A 50 0.551 -13.561 1.319 1.00 74.53 H new ATOM 772 N ALA A 51 3.672 -11.759 2.974 1.00 1.55 N ATOM 773 CA ALA A 51 5.086 -12.197 3.182 1.00 73.14 C ATOM 774 C ALA A 51 5.781 -12.697 1.898 1.00 14.20 C ATOM 775 O ALA A 51 6.806 -12.158 1.491 1.00 14.10 O ATOM 776 CB ALA A 51 5.223 -13.207 4.318 1.00 51.40 C ATOM 0 H ALA A 51 3.528 -10.778 3.215 1.00 1.55 H new ATOM 0 HA ALA A 51 5.616 -11.292 3.478 1.00 73.14 H new ATOM 0 HB1 ALA A 51 6.269 -13.492 4.427 1.00 51.40 H new ATOM 0 HB2 ALA A 51 4.870 -12.760 5.247 1.00 51.40 H new ATOM 0 HB3 ALA A 51 4.627 -14.092 4.092 1.00 51.40 H new ATOM 782 N SER A 52 5.224 -13.712 1.281 1.00 50.30 N ATOM 783 CA SER A 52 5.756 -14.285 0.076 1.00 11.45 C ATOM 784 C SER A 52 4.757 -14.198 -1.101 1.00 74.23 C ATOM 785 O SER A 52 5.138 -14.409 -2.242 1.00 44.32 O ATOM 786 CB SER A 52 6.093 -15.741 0.341 1.00 13.24 C ATOM 787 OG SER A 52 4.947 -16.433 0.806 1.00 44.02 O ATOM 0 H SER A 52 4.373 -14.168 1.611 1.00 50.30 H new ATOM 0 HA SER A 52 6.645 -13.721 -0.206 1.00 11.45 H new ATOM 0 HB2 SER A 52 6.463 -16.208 -0.572 1.00 13.24 H new ATOM 0 HB3 SER A 52 6.892 -15.808 1.080 1.00 13.24 H new ATOM 0 HG SER A 52 5.176 -17.371 0.972 1.00 44.02 H new ATOM 793 N ASN A 53 3.484 -13.882 -0.819 1.00 74.41 N ATOM 794 CA ASN A 53 2.442 -13.913 -1.874 1.00 65.24 C ATOM 795 C ASN A 53 2.565 -12.759 -2.852 1.00 0.10 C ATOM 796 O ASN A 53 2.424 -11.598 -2.460 1.00 20.54 O ATOM 797 CB ASN A 53 1.015 -13.919 -1.294 1.00 30.32 C ATOM 798 CG ASN A 53 0.635 -15.149 -0.469 1.00 71.44 C ATOM 799 OD1 ASN A 53 1.564 -15.723 0.244 1.00 54.33 O flip ATOM 800 ND2 ASN A 53 -0.519 -15.554 -0.459 1.00 25.42 N flip ATOM 0 H ASN A 53 3.150 -13.608 0.105 1.00 74.41 H new ATOM 0 HA ASN A 53 2.614 -14.848 -2.407 1.00 65.24 H new ATOM 0 HB2 ASN A 53 0.894 -13.034 -0.669 1.00 30.32 H new ATOM 0 HB3 ASN A 53 0.308 -13.826 -2.118 1.00 30.32 H new ATOM 0 HD21 ASN A 53 -1.228 -15.088 -1.025 1.00 25.42 H new ATOM 0 HD22 ASN A 53 -0.772 -16.358 0.116 1.00 25.42 H new ATOM 807 N LEU A 54 2.798 -13.087 -4.114 1.00 75.01 N ATOM 808 CA LEU A 54 2.926 -12.095 -5.186 1.00 65.13 C ATOM 809 C LEU A 54 1.578 -11.547 -5.600 1.00 23.41 C ATOM 810 O LEU A 54 0.556 -12.255 -5.576 1.00 21.52 O ATOM 811 CB LEU A 54 3.646 -12.665 -6.449 1.00 63.53 C ATOM 812 CG LEU A 54 5.167 -12.928 -6.388 1.00 31.44 C ATOM 813 CD1 LEU A 54 5.933 -11.657 -6.115 1.00 13.40 C ATOM 814 CD2 LEU A 54 5.528 -13.996 -5.384 1.00 53.34 C ATOM 0 H LEU A 54 2.905 -14.051 -4.431 1.00 75.01 H new ATOM 0 HA LEU A 54 3.537 -11.293 -4.771 1.00 65.13 H new ATOM 0 HB2 LEU A 54 3.159 -13.605 -6.709 1.00 63.53 H new ATOM 0 HB3 LEU A 54 3.464 -11.974 -7.272 1.00 63.53 H new ATOM 0 HG LEU A 54 5.457 -13.300 -7.371 1.00 31.44 H new ATOM 0 HD11 LEU A 54 7.000 -11.876 -6.078 1.00 13.40 H new ATOM 0 HD12 LEU A 54 5.738 -10.937 -6.909 1.00 13.40 H new ATOM 0 HD13 LEU A 54 5.615 -11.239 -5.160 1.00 13.40 H new ATOM 0 HD21 LEU A 54 6.608 -14.142 -5.381 1.00 53.34 H new ATOM 0 HD22 LEU A 54 5.201 -13.688 -4.391 1.00 53.34 H new ATOM 0 HD23 LEU A 54 5.036 -14.931 -5.654 1.00 53.34 H new ATOM 826 N GLU A 55 1.577 -10.296 -5.969 1.00 32.42 N ATOM 827 CA GLU A 55 0.381 -9.620 -6.457 1.00 71.52 C ATOM 828 C GLU A 55 0.268 -9.929 -7.974 1.00 34.20 C ATOM 829 O GLU A 55 1.254 -10.341 -8.602 1.00 20.23 O ATOM 830 CB GLU A 55 0.519 -8.097 -6.198 1.00 5.32 C ATOM 831 CG GLU A 55 -0.797 -7.298 -6.011 1.00 1.05 C ATOM 832 CD GLU A 55 -1.749 -7.353 -7.170 1.00 60.32 C ATOM 833 OE1 GLU A 55 -1.601 -6.557 -8.113 1.00 34.31 O ATOM 834 OE2 GLU A 55 -2.657 -8.223 -7.160 1.00 13.53 O ATOM 0 H GLU A 55 2.406 -9.702 -5.944 1.00 32.42 H new ATOM 0 HA GLU A 55 -0.518 -9.963 -5.946 1.00 71.52 H new ATOM 0 HB2 GLU A 55 1.131 -7.958 -5.307 1.00 5.32 H new ATOM 0 HB3 GLU A 55 1.067 -7.659 -7.032 1.00 5.32 H new ATOM 0 HG2 GLU A 55 -1.308 -7.673 -5.124 1.00 1.05 H new ATOM 0 HG3 GLU A 55 -0.546 -6.255 -5.817 1.00 1.05 H new ATOM 841 N THR A 56 -0.901 -9.777 -8.528 1.00 63.21 N ATOM 842 CA THR A 56 -1.154 -10.045 -9.922 1.00 74.34 C ATOM 843 C THR A 56 -0.327 -9.106 -10.822 1.00 3.13 C ATOM 844 O THR A 56 -0.269 -7.887 -10.600 1.00 14.03 O ATOM 845 CB THR A 56 -2.657 -9.879 -10.218 1.00 1.11 C ATOM 846 OG1 THR A 56 -3.400 -10.720 -9.323 1.00 41.15 O ATOM 847 CG2 THR A 56 -2.984 -10.270 -11.655 1.00 62.32 C ATOM 0 H THR A 56 -1.723 -9.457 -8.016 1.00 63.21 H new ATOM 0 HA THR A 56 -0.855 -11.070 -10.139 1.00 74.34 H new ATOM 0 HB THR A 56 -2.925 -8.832 -10.078 1.00 1.11 H new ATOM 0 HG1 THR A 56 -4.359 -10.621 -9.501 1.00 41.15 H new ATOM 0 HG21 THR A 56 -4.052 -10.142 -11.833 1.00 62.32 H new ATOM 0 HG22 THR A 56 -2.423 -9.636 -12.341 1.00 62.32 H new ATOM 0 HG23 THR A 56 -2.711 -11.312 -11.820 1.00 62.32 H new ATOM 855 N GLY A 57 0.340 -9.687 -11.801 1.00 14.25 N ATOM 856 CA GLY A 57 1.140 -8.912 -12.716 1.00 62.42 C ATOM 857 C GLY A 57 2.573 -8.823 -12.263 1.00 32.31 C ATOM 858 O GLY A 57 3.468 -8.523 -13.055 1.00 3.22 O ATOM 0 H GLY A 57 0.341 -10.691 -11.979 1.00 14.25 H new ATOM 0 HA2 GLY A 57 1.099 -9.363 -13.708 1.00 62.42 H new ATOM 0 HA3 GLY A 57 0.723 -7.909 -12.804 1.00 62.42 H new ATOM 862 N VAL A 58 2.794 -9.095 -10.997 1.00 62.43 N ATOM 863 CA VAL A 58 4.105 -9.040 -10.418 1.00 20.30 C ATOM 864 C VAL A 58 4.840 -10.342 -10.709 1.00 53.42 C ATOM 865 O VAL A 58 4.385 -11.411 -10.317 1.00 70.10 O ATOM 866 CB VAL A 58 4.026 -8.812 -8.901 1.00 33.54 C ATOM 867 CG1 VAL A 58 5.413 -8.720 -8.304 1.00 65.03 C ATOM 868 CG2 VAL A 58 3.221 -7.557 -8.599 1.00 70.13 C ATOM 0 H VAL A 58 2.060 -9.362 -10.341 1.00 62.43 H new ATOM 0 HA VAL A 58 4.647 -8.204 -10.859 1.00 20.30 H new ATOM 0 HB VAL A 58 3.519 -9.663 -8.446 1.00 33.54 H new ATOM 0 HG11 VAL A 58 5.336 -8.558 -7.229 1.00 65.03 H new ATOM 0 HG12 VAL A 58 5.953 -9.648 -8.494 1.00 65.03 H new ATOM 0 HG13 VAL A 58 5.950 -7.888 -8.759 1.00 65.03 H new ATOM 0 HG21 VAL A 58 3.172 -7.407 -7.521 1.00 70.13 H new ATOM 0 HG22 VAL A 58 3.701 -6.696 -9.064 1.00 70.13 H new ATOM 0 HG23 VAL A 58 2.212 -7.668 -8.996 1.00 70.13 H new ATOM 878 N PRO A 59 5.966 -10.264 -11.417 1.00 1.40 N ATOM 879 CA PRO A 59 6.730 -11.440 -11.814 1.00 21.54 C ATOM 880 C PRO A 59 7.282 -12.257 -10.642 1.00 3.30 C ATOM 881 O PRO A 59 7.593 -11.724 -9.568 1.00 13.24 O ATOM 882 CB PRO A 59 7.887 -10.881 -12.634 1.00 21.41 C ATOM 883 CG PRO A 59 7.945 -9.425 -12.326 1.00 54.04 C ATOM 884 CD PRO A 59 6.574 -9.015 -11.905 1.00 63.22 C ATOM 0 HA PRO A 59 6.086 -12.133 -12.355 1.00 21.54 H new ATOM 0 HB2 PRO A 59 8.824 -11.373 -12.372 1.00 21.41 H new ATOM 0 HB3 PRO A 59 7.727 -11.048 -13.699 1.00 21.41 H new ATOM 0 HG2 PRO A 59 8.667 -9.227 -11.534 1.00 54.04 H new ATOM 0 HG3 PRO A 59 8.266 -8.858 -13.200 1.00 54.04 H new ATOM 0 HD2 PRO A 59 6.606 -8.255 -11.125 1.00 63.22 H new ATOM 0 HD3 PRO A 59 6.009 -8.594 -12.737 1.00 63.22 H new ATOM 892 N SER A 60 7.449 -13.546 -10.895 1.00 50.01 N ATOM 893 CA SER A 60 7.979 -14.512 -9.941 1.00 13.15 C ATOM 894 C SER A 60 9.446 -14.248 -9.574 1.00 41.33 C ATOM 895 O SER A 60 10.021 -14.945 -8.742 1.00 53.13 O ATOM 896 CB SER A 60 7.773 -15.929 -10.457 1.00 52.02 C ATOM 897 OG SER A 60 6.382 -16.187 -10.620 1.00 13.43 O ATOM 0 H SER A 60 7.213 -13.962 -11.796 1.00 50.01 H new ATOM 0 HA SER A 60 7.418 -14.394 -9.014 1.00 13.15 H new ATOM 0 HB2 SER A 60 8.290 -16.058 -11.408 1.00 52.02 H new ATOM 0 HB3 SER A 60 8.206 -16.646 -9.759 1.00 52.02 H new ATOM 0 HG SER A 60 6.255 -17.100 -10.954 1.00 13.43 H new ATOM 903 N ARG A 61 10.056 -13.253 -10.218 1.00 15.42 N ATOM 904 CA ARG A 61 11.426 -12.868 -9.909 1.00 12.30 C ATOM 905 C ARG A 61 11.474 -12.237 -8.507 1.00 32.34 C ATOM 906 O ARG A 61 12.542 -12.062 -7.940 1.00 11.03 O ATOM 907 CB ARG A 61 11.972 -11.865 -10.951 1.00 61.15 C ATOM 908 CG ARG A 61 11.283 -10.505 -10.933 1.00 22.34 C ATOM 909 CD ARG A 61 11.798 -9.567 -12.023 1.00 64.24 C ATOM 910 NE ARG A 61 11.491 -10.058 -13.376 1.00 0.23 N ATOM 911 CZ ARG A 61 11.172 -9.274 -14.427 1.00 25.41 C ATOM 912 NH1 ARG A 61 10.993 -7.959 -14.260 1.00 50.40 N ATOM 913 NH2 ARG A 61 11.014 -9.814 -15.625 1.00 72.52 N ATOM 0 H ARG A 61 9.620 -12.701 -10.957 1.00 15.42 H new ATOM 0 HA ARG A 61 12.051 -13.761 -9.937 1.00 12.30 H new ATOM 0 HB2 ARG A 61 13.038 -11.721 -10.776 1.00 61.15 H new ATOM 0 HB3 ARG A 61 11.868 -12.299 -11.945 1.00 61.15 H new ATOM 0 HG2 ARG A 61 10.209 -10.645 -11.058 1.00 22.34 H new ATOM 0 HG3 ARG A 61 11.433 -10.040 -9.959 1.00 22.34 H new ATOM 0 HD2 ARG A 61 11.355 -8.580 -11.888 1.00 64.24 H new ATOM 0 HD3 ARG A 61 12.877 -9.450 -11.918 1.00 64.24 H new ATOM 0 HE ARG A 61 11.522 -11.066 -13.531 1.00 0.23 H new ATOM 0 HH11 ARG A 61 11.098 -7.544 -13.334 1.00 50.40 H new ATOM 0 HH12 ARG A 61 10.752 -7.372 -15.058 1.00 50.40 H new ATOM 0 HH21 ARG A 61 11.133 -10.819 -15.751 1.00 72.52 H new ATOM 0 HH22 ARG A 61 10.773 -9.225 -16.422 1.00 72.52 H new ATOM 927 N PHE A 62 10.310 -11.883 -7.982 1.00 63.43 N ATOM 928 CA PHE A 62 10.196 -11.349 -6.641 1.00 13.53 C ATOM 929 C PHE A 62 9.719 -12.449 -5.693 1.00 43.31 C ATOM 930 O PHE A 62 8.893 -13.295 -6.075 1.00 34.41 O ATOM 931 CB PHE A 62 9.210 -10.178 -6.601 1.00 22.43 C ATOM 932 CG PHE A 62 9.599 -9.003 -7.452 1.00 20.03 C ATOM 933 CD1 PHE A 62 10.617 -8.168 -7.059 1.00 70.41 C ATOM 934 CD2 PHE A 62 8.943 -8.737 -8.638 1.00 31.34 C ATOM 935 CE1 PHE A 62 10.981 -7.084 -7.829 1.00 44.04 C ATOM 936 CE2 PHE A 62 9.299 -7.653 -9.413 1.00 33.12 C ATOM 937 CZ PHE A 62 10.319 -6.826 -9.005 1.00 32.33 C ATOM 0 H PHE A 62 9.421 -11.959 -8.477 1.00 63.43 H new ATOM 0 HA PHE A 62 11.176 -10.987 -6.329 1.00 13.53 H new ATOM 0 HB2 PHE A 62 8.231 -10.534 -6.922 1.00 22.43 H new ATOM 0 HB3 PHE A 62 9.105 -9.843 -5.569 1.00 22.43 H new ATOM 0 HD1 PHE A 62 11.139 -8.364 -6.134 1.00 70.41 H new ATOM 0 HD2 PHE A 62 8.142 -9.385 -8.962 1.00 31.34 H new ATOM 0 HE1 PHE A 62 11.785 -6.439 -7.508 1.00 44.04 H new ATOM 0 HE2 PHE A 62 8.778 -7.454 -10.338 1.00 33.12 H new ATOM 0 HZ PHE A 62 10.599 -5.975 -9.608 1.00 32.33 H new ATOM 947 N SER A 63 10.239 -12.457 -4.484 1.00 64.43 N ATOM 948 CA SER A 63 9.845 -13.424 -3.491 1.00 32.41 C ATOM 949 C SER A 63 10.265 -12.925 -2.106 1.00 34.21 C ATOM 950 O SER A 63 11.224 -12.167 -1.984 1.00 51.44 O ATOM 951 CB SER A 63 10.507 -14.784 -3.797 1.00 35.25 C ATOM 952 OG SER A 63 10.054 -15.802 -2.916 1.00 71.41 O ATOM 0 H SER A 63 10.945 -11.793 -4.166 1.00 64.43 H new ATOM 0 HA SER A 63 8.763 -13.552 -3.510 1.00 32.41 H new ATOM 0 HB2 SER A 63 10.289 -15.071 -4.826 1.00 35.25 H new ATOM 0 HB3 SER A 63 11.590 -14.688 -3.715 1.00 35.25 H new ATOM 0 HG SER A 63 10.493 -16.649 -3.141 1.00 71.41 H new ATOM 958 N GLY A 64 9.530 -13.306 -1.085 1.00 30.22 N ATOM 959 CA GLY A 64 9.886 -12.946 0.252 1.00 23.10 C ATOM 960 C GLY A 64 9.847 -14.143 1.170 1.00 1.42 C ATOM 961 O GLY A 64 9.038 -15.049 0.979 1.00 72.21 O ATOM 0 H GLY A 64 8.681 -13.866 -1.165 1.00 30.22 H new ATOM 0 HA2 GLY A 64 10.885 -12.511 0.260 1.00 23.10 H new ATOM 0 HA3 GLY A 64 9.202 -12.181 0.619 1.00 23.10 H new ATOM 965 N SER A 65 10.720 -14.165 2.121 1.00 53.11 N ATOM 966 CA SER A 65 10.812 -15.224 3.080 1.00 41.21 C ATOM 967 C SER A 65 10.847 -14.670 4.491 1.00 13.21 C ATOM 968 O SER A 65 11.065 -13.471 4.686 1.00 45.21 O ATOM 969 CB SER A 65 12.053 -16.070 2.793 1.00 61.14 C ATOM 970 OG SER A 65 13.216 -15.261 2.606 1.00 23.52 O ATOM 0 H SER A 65 11.411 -13.427 2.260 1.00 53.11 H new ATOM 0 HA SER A 65 9.928 -15.857 2.996 1.00 41.21 H new ATOM 0 HB2 SER A 65 12.220 -16.761 3.619 1.00 61.14 H new ATOM 0 HB3 SER A 65 11.883 -16.674 1.901 1.00 61.14 H new ATOM 0 HG SER A 65 13.989 -15.836 2.426 1.00 23.52 H new ATOM 976 N GLY A 66 10.617 -15.524 5.457 1.00 61.34 N ATOM 977 CA GLY A 66 10.669 -15.103 6.823 1.00 23.24 C ATOM 978 C GLY A 66 9.300 -14.877 7.384 1.00 42.52 C ATOM 979 O GLY A 66 8.320 -14.791 6.630 1.00 42.21 O ATOM 0 H GLY A 66 10.393 -16.509 5.318 1.00 61.34 H new ATOM 0 HA2 GLY A 66 11.186 -15.857 7.417 1.00 23.24 H new ATOM 0 HA3 GLY A 66 11.250 -14.184 6.899 1.00 23.24 H new ATOM 983 N SER A 67 9.219 -14.783 8.681 1.00 5.13 N ATOM 984 CA SER A 67 7.985 -14.577 9.360 1.00 31.32 C ATOM 985 C SER A 67 8.241 -14.154 10.787 1.00 43.13 C ATOM 986 O SER A 67 9.327 -14.381 11.326 1.00 44.33 O ATOM 987 CB SER A 67 7.111 -15.838 9.291 1.00 63.24 C ATOM 988 OG SER A 67 7.809 -16.997 9.753 1.00 15.43 O ATOM 0 H SER A 67 10.026 -14.849 9.301 1.00 5.13 H new ATOM 0 HA SER A 67 7.438 -13.775 8.865 1.00 31.32 H new ATOM 0 HB2 SER A 67 6.214 -15.691 9.892 1.00 63.24 H new ATOM 0 HB3 SER A 67 6.784 -15.997 8.264 1.00 63.24 H new ATOM 0 HG SER A 67 7.220 -17.778 9.695 1.00 15.43 H new ATOM 994 N GLY A 68 7.278 -13.520 11.373 1.00 14.42 N ATOM 995 CA GLY A 68 7.392 -13.089 12.716 1.00 22.22 C ATOM 996 C GLY A 68 7.815 -11.655 12.801 1.00 13.12 C ATOM 997 O GLY A 68 6.991 -10.740 12.665 1.00 63.30 O ATOM 0 H GLY A 68 6.390 -13.289 10.927 1.00 14.42 H new ATOM 0 HA2 GLY A 68 6.435 -13.217 13.222 1.00 22.22 H new ATOM 0 HA3 GLY A 68 8.116 -13.714 13.239 1.00 22.22 H new ATOM 1001 N THR A 69 9.078 -11.447 13.008 1.00 64.22 N ATOM 1002 CA THR A 69 9.606 -10.125 13.155 1.00 35.32 C ATOM 1003 C THR A 69 10.654 -9.847 12.063 1.00 1.43 C ATOM 1004 O THR A 69 10.816 -8.700 11.625 1.00 23.53 O ATOM 1005 CB THR A 69 10.259 -9.988 14.535 1.00 32.32 C ATOM 1006 OG1 THR A 69 9.399 -10.612 15.511 1.00 0.42 O ATOM 1007 CG2 THR A 69 10.372 -8.529 14.908 1.00 72.23 C ATOM 0 H THR A 69 9.774 -12.190 13.080 1.00 64.22 H new ATOM 0 HA THR A 69 8.793 -9.405 13.058 1.00 35.32 H new ATOM 0 HB THR A 69 11.246 -10.451 14.511 1.00 32.32 H new ATOM 0 HG1 THR A 69 9.803 -10.535 16.400 1.00 0.42 H new ATOM 0 HG21 THR A 69 10.837 -8.439 15.890 1.00 72.23 H new ATOM 0 HG22 THR A 69 10.983 -8.011 14.169 1.00 72.23 H new ATOM 0 HG23 THR A 69 9.378 -8.082 14.935 1.00 72.23 H new ATOM 1015 N ASP A 70 11.345 -10.901 11.621 1.00 73.03 N ATOM 1016 CA ASP A 70 12.376 -10.758 10.595 1.00 70.41 C ATOM 1017 C ASP A 70 11.893 -11.333 9.285 1.00 41.01 C ATOM 1018 O ASP A 70 11.346 -12.448 9.245 1.00 4.23 O ATOM 1019 CB ASP A 70 13.678 -11.470 11.002 1.00 2.01 C ATOM 1020 CG ASP A 70 14.340 -10.896 12.237 1.00 70.32 C ATOM 1021 OD1 ASP A 70 15.027 -9.875 12.130 1.00 32.35 O ATOM 1022 OD2 ASP A 70 14.217 -11.488 13.328 1.00 73.21 O ATOM 0 H ASP A 70 11.209 -11.855 11.956 1.00 73.03 H new ATOM 0 HA ASP A 70 12.579 -9.693 10.483 1.00 70.41 H new ATOM 0 HB2 ASP A 70 13.463 -12.524 11.176 1.00 2.01 H new ATOM 0 HB3 ASP A 70 14.381 -11.421 10.171 1.00 2.01 H new ATOM 1027 N PHE A 71 12.099 -10.589 8.222 1.00 12.51 N ATOM 1028 CA PHE A 71 11.673 -10.978 6.885 1.00 52.03 C ATOM 1029 C PHE A 71 12.770 -10.688 5.889 1.00 72.12 C ATOM 1030 O PHE A 71 13.572 -9.769 6.088 1.00 72.24 O ATOM 1031 CB PHE A 71 10.424 -10.204 6.480 1.00 71.33 C ATOM 1032 CG PHE A 71 9.233 -10.429 7.365 1.00 22.22 C ATOM 1033 CD1 PHE A 71 9.039 -9.652 8.494 1.00 23.32 C ATOM 1034 CD2 PHE A 71 8.305 -11.405 7.061 1.00 74.53 C ATOM 1035 CE1 PHE A 71 7.949 -9.850 9.298 1.00 13.32 C ATOM 1036 CE2 PHE A 71 7.208 -11.604 7.863 1.00 53.45 C ATOM 1037 CZ PHE A 71 7.031 -10.824 8.985 1.00 41.23 C ATOM 0 H PHE A 71 12.572 -9.686 8.255 1.00 12.51 H new ATOM 0 HA PHE A 71 11.453 -12.045 6.893 1.00 52.03 H new ATOM 0 HB2 PHE A 71 10.659 -9.140 6.473 1.00 71.33 H new ATOM 0 HB3 PHE A 71 10.158 -10.478 5.459 1.00 71.33 H new ATOM 0 HD1 PHE A 71 9.754 -8.882 8.743 1.00 23.32 H new ATOM 0 HD2 PHE A 71 8.443 -12.019 6.183 1.00 74.53 H new ATOM 0 HE1 PHE A 71 7.810 -9.241 10.179 1.00 13.32 H new ATOM 0 HE2 PHE A 71 6.487 -12.369 7.615 1.00 53.45 H new ATOM 0 HZ PHE A 71 6.170 -10.978 9.619 1.00 41.23 H new ATOM 1047 N THR A 72 12.795 -11.436 4.827 1.00 4.33 N ATOM 1048 CA THR A 72 13.788 -11.271 3.808 1.00 34.12 C ATOM 1049 C THR A 72 13.138 -11.271 2.416 1.00 32.25 C ATOM 1050 O THR A 72 12.560 -12.249 1.990 1.00 63.13 O ATOM 1051 CB THR A 72 14.845 -12.392 3.893 1.00 50.14 C ATOM 1052 OG1 THR A 72 15.425 -12.409 5.217 1.00 75.32 O ATOM 1053 CG2 THR A 72 15.952 -12.182 2.863 1.00 73.42 C ATOM 0 H THR A 72 12.124 -12.182 4.642 1.00 4.33 H new ATOM 0 HA THR A 72 14.280 -10.311 3.967 1.00 34.12 H new ATOM 0 HB THR A 72 14.353 -13.342 3.686 1.00 50.14 H new ATOM 0 HG1 THR A 72 16.095 -13.122 5.271 1.00 75.32 H new ATOM 0 HG21 THR A 72 16.683 -12.986 2.945 1.00 73.42 H new ATOM 0 HG22 THR A 72 15.522 -12.184 1.861 1.00 73.42 H new ATOM 0 HG23 THR A 72 16.442 -11.226 3.046 1.00 73.42 H new ATOM 1061 N PHE A 73 13.229 -10.167 1.756 1.00 70.14 N ATOM 1062 CA PHE A 73 12.740 -10.006 0.414 1.00 73.30 C ATOM 1063 C PHE A 73 13.879 -10.245 -0.534 1.00 11.43 C ATOM 1064 O PHE A 73 14.989 -9.740 -0.329 1.00 51.32 O ATOM 1065 CB PHE A 73 12.178 -8.601 0.239 1.00 52.23 C ATOM 1066 CG PHE A 73 11.835 -8.206 -1.167 1.00 4.12 C ATOM 1067 CD1 PHE A 73 10.661 -8.619 -1.776 1.00 22.00 C ATOM 1068 CD2 PHE A 73 12.700 -7.412 -1.870 1.00 11.22 C ATOM 1069 CE1 PHE A 73 10.378 -8.228 -3.071 1.00 15.25 C ATOM 1070 CE2 PHE A 73 12.432 -7.021 -3.146 1.00 5.31 C ATOM 1071 CZ PHE A 73 11.275 -7.424 -3.754 1.00 1.03 C ATOM 0 H PHE A 73 13.656 -9.324 2.139 1.00 70.14 H new ATOM 0 HA PHE A 73 11.941 -10.719 0.209 1.00 73.30 H new ATOM 0 HB2 PHE A 73 11.281 -8.510 0.851 1.00 52.23 H new ATOM 0 HB3 PHE A 73 12.904 -7.888 0.630 1.00 52.23 H new ATOM 0 HD1 PHE A 73 9.966 -9.247 -1.238 1.00 22.00 H new ATOM 0 HD2 PHE A 73 13.617 -7.088 -1.401 1.00 11.22 H new ATOM 0 HE1 PHE A 73 9.463 -8.548 -3.547 1.00 15.25 H new ATOM 0 HE2 PHE A 73 13.132 -6.393 -3.678 1.00 5.31 H new ATOM 0 HZ PHE A 73 11.061 -7.115 -4.767 1.00 1.03 H new ATOM 1081 N THR A 74 13.644 -11.016 -1.526 1.00 45.44 N ATOM 1082 CA THR A 74 14.661 -11.323 -2.432 1.00 14.43 C ATOM 1083 C THR A 74 14.178 -11.162 -3.882 1.00 3.23 C ATOM 1084 O THR A 74 13.014 -11.447 -4.207 1.00 3.12 O ATOM 1085 CB THR A 74 15.204 -12.754 -2.159 1.00 0.52 C ATOM 1086 OG1 THR A 74 16.338 -13.005 -2.959 1.00 34.43 O ATOM 1087 CG2 THR A 74 14.145 -13.821 -2.427 1.00 73.23 C ATOM 0 H THR A 74 12.741 -11.447 -1.726 1.00 45.44 H new ATOM 0 HA THR A 74 15.481 -10.619 -2.291 1.00 14.43 H new ATOM 0 HB THR A 74 15.478 -12.804 -1.105 1.00 0.52 H new ATOM 0 HG1 THR A 74 16.892 -12.198 -3.004 1.00 34.43 H new ATOM 0 HG21 THR A 74 14.563 -14.807 -2.225 1.00 73.23 H new ATOM 0 HG22 THR A 74 13.285 -13.651 -1.779 1.00 73.23 H new ATOM 0 HG23 THR A 74 13.830 -13.767 -3.469 1.00 73.23 H new ATOM 1095 N ILE A 75 15.042 -10.650 -4.723 1.00 3.45 N ATOM 1096 CA ILE A 75 14.773 -10.590 -6.134 1.00 2.55 C ATOM 1097 C ILE A 75 15.703 -11.589 -6.779 1.00 54.15 C ATOM 1098 O ILE A 75 16.908 -11.399 -6.757 1.00 42.45 O ATOM 1099 CB ILE A 75 15.036 -9.164 -6.718 1.00 12.42 C ATOM 1100 CG1 ILE A 75 14.117 -8.137 -6.046 1.00 55.41 C ATOM 1101 CG2 ILE A 75 14.830 -9.147 -8.232 1.00 33.04 C ATOM 1102 CD1 ILE A 75 14.351 -6.704 -6.492 1.00 70.00 C ATOM 0 H ILE A 75 15.946 -10.266 -4.449 1.00 3.45 H new ATOM 0 HA ILE A 75 13.725 -10.815 -6.329 1.00 2.55 H new ATOM 0 HB ILE A 75 16.073 -8.898 -6.512 1.00 12.42 H new ATOM 0 HG12 ILE A 75 13.081 -8.405 -6.252 1.00 55.41 H new ATOM 0 HG13 ILE A 75 14.253 -8.196 -4.966 1.00 55.41 H new ATOM 0 HG21 ILE A 75 15.019 -8.144 -8.614 1.00 33.04 H new ATOM 0 HG22 ILE A 75 15.519 -9.849 -8.701 1.00 33.04 H new ATOM 0 HG23 ILE A 75 13.805 -9.436 -8.463 1.00 33.04 H new ATOM 0 HD11 ILE A 75 13.660 -6.043 -5.969 1.00 70.00 H new ATOM 0 HD12 ILE A 75 15.376 -6.414 -6.261 1.00 70.00 H new ATOM 0 HD13 ILE A 75 14.185 -6.626 -7.566 1.00 70.00 H new ATOM 1114 N SER A 76 15.146 -12.644 -7.316 1.00 63.34 N ATOM 1115 CA SER A 76 15.913 -13.724 -7.897 1.00 45.23 C ATOM 1116 C SER A 76 16.490 -13.333 -9.258 1.00 21.04 C ATOM 1117 O SER A 76 17.641 -13.637 -9.567 1.00 73.11 O ATOM 1118 CB SER A 76 15.010 -14.945 -8.029 1.00 72.32 C ATOM 1119 OG SER A 76 14.397 -15.240 -6.778 1.00 52.24 O ATOM 0 H SER A 76 14.137 -12.782 -7.364 1.00 63.34 H new ATOM 0 HA SER A 76 16.757 -13.952 -7.246 1.00 45.23 H new ATOM 0 HB2 SER A 76 14.245 -14.761 -8.783 1.00 72.32 H new ATOM 0 HB3 SER A 76 15.592 -15.802 -8.368 1.00 72.32 H new ATOM 0 HG SER A 76 13.818 -16.025 -6.874 1.00 52.24 H new ATOM 1125 N SER A 77 15.698 -12.666 -10.059 1.00 32.40 N ATOM 1126 CA SER A 77 16.150 -12.206 -11.342 1.00 62.45 C ATOM 1127 C SER A 77 16.123 -10.695 -11.365 1.00 31.13 C ATOM 1128 O SER A 77 15.068 -10.099 -11.612 1.00 44.22 O ATOM 1129 CB SER A 77 15.271 -12.774 -12.453 1.00 61.20 C ATOM 1130 OG SER A 77 15.214 -14.189 -12.381 1.00 12.01 O ATOM 0 H SER A 77 14.730 -12.429 -9.840 1.00 32.40 H new ATOM 0 HA SER A 77 17.170 -12.551 -11.511 1.00 62.45 H new ATOM 0 HB2 SER A 77 14.265 -12.361 -12.373 1.00 61.20 H new ATOM 0 HB3 SER A 77 15.664 -12.471 -13.424 1.00 61.20 H new ATOM 0 HG SER A 77 14.644 -14.531 -13.101 1.00 12.01 H new ATOM 1136 N LEU A 78 17.236 -10.077 -11.052 1.00 2.44 N ATOM 1137 CA LEU A 78 17.295 -8.634 -11.030 1.00 41.31 C ATOM 1138 C LEU A 78 17.288 -8.087 -12.455 1.00 14.21 C ATOM 1139 O LEU A 78 18.123 -8.475 -13.278 1.00 2.33 O ATOM 1140 CB LEU A 78 18.525 -8.165 -10.268 1.00 73.24 C ATOM 1141 CG LEU A 78 18.601 -6.676 -10.029 1.00 71.54 C ATOM 1142 CD1 LEU A 78 17.398 -6.233 -9.225 1.00 13.13 C ATOM 1143 CD2 LEU A 78 19.877 -6.329 -9.300 1.00 74.15 C ATOM 0 H LEU A 78 18.109 -10.546 -10.810 1.00 2.44 H new ATOM 0 HA LEU A 78 16.415 -8.251 -10.514 1.00 41.31 H new ATOM 0 HB2 LEU A 78 18.552 -8.674 -9.304 1.00 73.24 H new ATOM 0 HB3 LEU A 78 19.414 -8.475 -10.817 1.00 73.24 H new ATOM 0 HG LEU A 78 18.601 -6.157 -10.987 1.00 71.54 H new ATOM 0 HD11 LEU A 78 17.452 -5.158 -9.052 1.00 13.13 H new ATOM 0 HD12 LEU A 78 16.487 -6.467 -9.775 1.00 13.13 H new ATOM 0 HD13 LEU A 78 17.388 -6.755 -8.268 1.00 13.13 H new ATOM 0 HD21 LEU A 78 19.920 -5.253 -9.134 1.00 74.15 H new ATOM 0 HD22 LEU A 78 19.900 -6.846 -8.340 1.00 74.15 H new ATOM 0 HD23 LEU A 78 20.734 -6.638 -9.899 1.00 74.15 H new ATOM 1155 N GLN A 79 16.346 -7.206 -12.744 1.00 61.30 N ATOM 1156 CA GLN A 79 16.160 -6.682 -14.085 1.00 34.21 C ATOM 1157 C GLN A 79 16.228 -5.160 -14.102 1.00 4.20 C ATOM 1158 O GLN A 79 15.738 -4.531 -13.209 1.00 43.12 O ATOM 1159 CB GLN A 79 14.814 -7.146 -14.656 1.00 74.22 C ATOM 1160 CG GLN A 79 14.677 -8.648 -14.774 1.00 5.04 C ATOM 1161 CD GLN A 79 15.725 -9.261 -15.677 1.00 14.34 C ATOM 1162 OE1 GLN A 79 16.193 -8.636 -16.634 1.00 41.35 O ATOM 1163 NE2 GLN A 79 16.106 -10.461 -15.374 1.00 32.40 N ATOM 0 H GLN A 79 15.690 -6.835 -12.057 1.00 61.30 H new ATOM 0 HA GLN A 79 16.969 -7.067 -14.705 1.00 34.21 H new ATOM 0 HB2 GLN A 79 14.013 -6.768 -14.021 1.00 74.22 H new ATOM 0 HB3 GLN A 79 14.677 -6.701 -15.642 1.00 74.22 H new ATOM 0 HG2 GLN A 79 14.752 -9.094 -13.782 1.00 5.04 H new ATOM 0 HG3 GLN A 79 13.686 -8.889 -15.158 1.00 5.04 H new ATOM 0 HE21 GLN A 79 15.693 -10.941 -14.574 1.00 32.40 H new ATOM 0 HE22 GLN A 79 16.820 -10.926 -15.935 1.00 32.40 H new ATOM 1172 N PRO A 80 16.805 -4.562 -15.177 1.00 2.12 N ATOM 1173 CA PRO A 80 16.964 -3.076 -15.341 1.00 73.44 C ATOM 1174 C PRO A 80 15.680 -2.276 -15.055 1.00 42.14 C ATOM 1175 O PRO A 80 15.716 -1.128 -14.627 1.00 70.35 O ATOM 1176 CB PRO A 80 17.354 -2.940 -16.814 1.00 64.44 C ATOM 1177 CG PRO A 80 18.077 -4.207 -17.113 1.00 55.32 C ATOM 1178 CD PRO A 80 17.355 -5.283 -16.349 1.00 15.34 C ATOM 0 HA PRO A 80 17.689 -2.674 -14.634 1.00 73.44 H new ATOM 0 HB2 PRO A 80 16.477 -2.821 -17.450 1.00 64.44 H new ATOM 0 HB3 PRO A 80 17.988 -2.069 -16.980 1.00 64.44 H new ATOM 0 HG2 PRO A 80 18.072 -4.417 -18.183 1.00 55.32 H new ATOM 0 HG3 PRO A 80 19.121 -4.143 -16.806 1.00 55.32 H new ATOM 0 HD2 PRO A 80 16.566 -5.739 -16.947 1.00 15.34 H new ATOM 0 HD3 PRO A 80 18.030 -6.084 -16.048 1.00 15.34 H new ATOM 1186 N GLU A 81 14.573 -2.914 -15.292 1.00 1.34 N ATOM 1187 CA GLU A 81 13.256 -2.327 -15.231 1.00 62.34 C ATOM 1188 C GLU A 81 12.741 -2.221 -13.788 1.00 5.34 C ATOM 1189 O GLU A 81 11.654 -1.664 -13.543 1.00 60.12 O ATOM 1190 CB GLU A 81 12.329 -3.233 -16.047 1.00 20.14 C ATOM 1191 CG GLU A 81 12.345 -4.678 -15.543 1.00 74.00 C ATOM 1192 CD GLU A 81 11.611 -5.643 -16.420 1.00 3.44 C ATOM 1193 OE1 GLU A 81 12.179 -6.078 -17.420 1.00 12.03 O ATOM 1194 OE2 GLU A 81 10.477 -6.020 -16.088 1.00 44.12 O ATOM 0 H GLU A 81 14.556 -3.902 -15.545 1.00 1.34 H new ATOM 0 HA GLU A 81 13.287 -1.313 -15.629 1.00 62.34 H new ATOM 0 HB2 GLU A 81 11.311 -2.845 -16.001 1.00 20.14 H new ATOM 0 HB3 GLU A 81 12.632 -3.211 -17.094 1.00 20.14 H new ATOM 0 HG2 GLU A 81 13.380 -5.006 -15.448 1.00 74.00 H new ATOM 0 HG3 GLU A 81 11.908 -4.707 -14.545 1.00 74.00 H new ATOM 1201 N ASP A 82 13.497 -2.737 -12.842 1.00 32.30 N ATOM 1202 CA ASP A 82 13.018 -2.804 -11.476 1.00 74.53 C ATOM 1203 C ASP A 82 13.546 -1.655 -10.629 1.00 45.23 C ATOM 1204 O ASP A 82 12.940 -1.336 -9.615 1.00 5.30 O ATOM 1205 CB ASP A 82 13.439 -4.135 -10.839 1.00 23.44 C ATOM 1206 CG ASP A 82 14.680 -4.042 -9.973 1.00 53.43 C ATOM 1207 OD1 ASP A 82 15.772 -3.872 -10.515 1.00 15.33 O ATOM 1208 OD2 ASP A 82 14.533 -4.131 -8.738 1.00 55.22 O ATOM 0 H ASP A 82 14.434 -3.112 -12.989 1.00 32.30 H new ATOM 0 HA ASP A 82 11.931 -2.728 -11.509 1.00 74.53 H new ATOM 0 HB2 ASP A 82 12.615 -4.513 -10.234 1.00 23.44 H new ATOM 0 HB3 ASP A 82 13.615 -4.864 -11.630 1.00 23.44 H new ATOM 1213 N ILE A 83 14.641 -1.008 -11.101 1.00 34.22 N ATOM 1214 CA ILE A 83 15.368 0.046 -10.339 1.00 72.11 C ATOM 1215 C ILE A 83 14.420 1.020 -9.650 1.00 51.45 C ATOM 1216 O ILE A 83 13.799 1.885 -10.296 1.00 14.14 O ATOM 1217 CB ILE A 83 16.383 0.836 -11.229 1.00 61.05 C ATOM 1218 CG1 ILE A 83 17.413 -0.119 -11.850 1.00 32.41 C ATOM 1219 CG2 ILE A 83 17.097 1.919 -10.414 1.00 21.43 C ATOM 1220 CD1 ILE A 83 18.207 -0.884 -10.833 1.00 4.44 C ATOM 0 H ILE A 83 15.046 -1.199 -12.017 1.00 34.22 H new ATOM 0 HA ILE A 83 15.931 -0.487 -9.572 1.00 72.11 H new ATOM 0 HB ILE A 83 15.822 1.319 -12.030 1.00 61.05 H new ATOM 0 HG12 ILE A 83 16.897 -0.824 -12.502 1.00 32.41 H new ATOM 0 HG13 ILE A 83 18.096 0.454 -12.477 1.00 32.41 H new ATOM 0 HG21 ILE A 83 17.797 2.454 -11.055 1.00 21.43 H new ATOM 0 HG22 ILE A 83 16.362 2.619 -10.016 1.00 21.43 H new ATOM 0 HG23 ILE A 83 17.640 1.456 -9.590 1.00 21.43 H new ATOM 0 HD11 ILE A 83 18.915 -1.539 -11.341 1.00 4.44 H new ATOM 0 HD12 ILE A 83 18.751 -0.186 -10.196 1.00 4.44 H new ATOM 0 HD13 ILE A 83 17.533 -1.484 -10.221 1.00 4.44 H new ATOM 1232 N ALA A 84 14.300 0.853 -8.349 1.00 20.21 N ATOM 1233 CA ALA A 84 13.394 1.616 -7.538 1.00 63.50 C ATOM 1234 C ALA A 84 13.767 1.456 -6.077 1.00 25.40 C ATOM 1235 O ALA A 84 14.858 0.976 -5.751 1.00 45.13 O ATOM 1236 CB ALA A 84 11.979 1.109 -7.759 1.00 45.32 C ATOM 0 H ALA A 84 14.843 0.168 -7.823 1.00 20.21 H new ATOM 0 HA ALA A 84 13.453 2.669 -7.813 1.00 63.50 H new ATOM 0 HB1 ALA A 84 11.286 1.685 -7.145 1.00 45.32 H new ATOM 0 HB2 ALA A 84 11.712 1.221 -8.810 1.00 45.32 H new ATOM 0 HB3 ALA A 84 11.922 0.057 -7.480 1.00 45.32 H new ATOM 1242 N THR A 85 12.893 1.878 -5.203 1.00 10.25 N ATOM 1243 CA THR A 85 13.099 1.719 -3.796 1.00 35.20 C ATOM 1244 C THR A 85 12.065 0.720 -3.228 1.00 73.13 C ATOM 1245 O THR A 85 10.846 0.948 -3.310 1.00 14.52 O ATOM 1246 CB THR A 85 12.995 3.081 -3.091 1.00 12.52 C ATOM 1247 OG1 THR A 85 13.910 3.995 -3.728 1.00 43.30 O ATOM 1248 CG2 THR A 85 13.355 2.961 -1.615 1.00 51.22 C ATOM 0 H THR A 85 12.019 2.342 -5.451 1.00 10.25 H new ATOM 0 HA THR A 85 14.098 1.321 -3.618 1.00 35.20 H new ATOM 0 HB THR A 85 11.969 3.442 -3.165 1.00 12.52 H new ATOM 0 HG1 THR A 85 13.855 4.870 -3.291 1.00 43.30 H new ATOM 0 HG21 THR A 85 13.273 3.939 -1.140 1.00 51.22 H new ATOM 0 HG22 THR A 85 12.672 2.263 -1.130 1.00 51.22 H new ATOM 0 HG23 THR A 85 14.377 2.595 -1.518 1.00 51.22 H new ATOM 1256 N TYR A 86 12.558 -0.364 -2.657 1.00 25.00 N ATOM 1257 CA TYR A 86 11.716 -1.431 -2.122 1.00 31.21 C ATOM 1258 C TYR A 86 11.640 -1.349 -0.621 1.00 74.51 C ATOM 1259 O TYR A 86 12.636 -1.154 0.043 1.00 20.33 O ATOM 1260 CB TYR A 86 12.247 -2.802 -2.540 1.00 23.14 C ATOM 1261 CG TYR A 86 12.185 -3.057 -4.024 1.00 34.40 C ATOM 1262 CD1 TYR A 86 13.168 -2.576 -4.882 1.00 22.44 C ATOM 1263 CD2 TYR A 86 11.137 -3.778 -4.570 1.00 13.34 C ATOM 1264 CE1 TYR A 86 13.100 -2.811 -6.236 1.00 11.01 C ATOM 1265 CE2 TYR A 86 11.067 -4.014 -5.920 1.00 70.32 C ATOM 1266 CZ TYR A 86 12.047 -3.531 -6.744 1.00 1.23 C ATOM 1267 OH TYR A 86 11.974 -3.763 -8.076 1.00 23.23 O ATOM 0 H TYR A 86 13.558 -0.535 -2.548 1.00 25.00 H new ATOM 0 HA TYR A 86 10.714 -1.303 -2.532 1.00 31.21 H new ATOM 0 HB2 TYR A 86 13.281 -2.896 -2.208 1.00 23.14 H new ATOM 0 HB3 TYR A 86 11.675 -3.574 -2.025 1.00 23.14 H new ATOM 0 HD1 TYR A 86 13.996 -2.010 -4.480 1.00 22.44 H new ATOM 0 HD2 TYR A 86 10.362 -4.161 -3.923 1.00 13.34 H new ATOM 0 HE1 TYR A 86 13.868 -2.432 -6.894 1.00 11.01 H new ATOM 0 HE2 TYR A 86 10.242 -4.578 -6.330 1.00 70.32 H new ATOM 0 HH TYR A 86 12.815 -4.160 -8.385 1.00 23.23 H new ATOM 1277 N HIS A 87 10.455 -1.490 -0.094 1.00 33.42 N ATOM 1278 CA HIS A 87 10.219 -1.376 1.346 1.00 33.25 C ATOM 1279 C HIS A 87 9.079 -2.194 1.832 1.00 64.13 C ATOM 1280 O HIS A 87 8.130 -2.471 1.092 1.00 32.14 O ATOM 1281 CB HIS A 87 10.108 0.087 1.852 1.00 60.15 C ATOM 1282 CG HIS A 87 9.566 1.059 0.867 1.00 72.23 C ATOM 1283 ND1 HIS A 87 10.217 2.227 0.567 1.00 62.24 N ATOM 1284 CD2 HIS A 87 8.466 1.029 0.079 1.00 55.04 C ATOM 1285 CE1 HIS A 87 9.565 2.862 -0.361 1.00 62.21 C ATOM 1286 NE2 HIS A 87 8.492 2.164 -0.683 1.00 0.01 N ATOM 0 H HIS A 87 9.615 -1.688 -0.639 1.00 33.42 H new ATOM 0 HA HIS A 87 11.124 -1.795 1.787 1.00 33.25 H new ATOM 0 HB2 HIS A 87 9.474 0.101 2.738 1.00 60.15 H new ATOM 0 HB3 HIS A 87 11.097 0.423 2.163 1.00 60.15 H new ATOM 0 HD1 HIS A 87 11.080 2.549 1.005 1.00 62.24 H new ATOM 0 HD2 HIS A 87 7.712 0.256 0.056 1.00 55.04 H new ATOM 0 HE1 HIS A 87 9.854 3.807 -0.797 1.00 62.21 H new ATOM 1295 N CYS A 88 9.193 -2.565 3.070 1.00 3.54 N ATOM 1296 CA CYS A 88 8.244 -3.369 3.771 1.00 72.21 C ATOM 1297 C CYS A 88 7.234 -2.500 4.502 1.00 44.45 C ATOM 1298 O CYS A 88 7.556 -1.373 4.923 1.00 51.22 O ATOM 1299 CB CYS A 88 9.021 -4.223 4.768 1.00 23.10 C ATOM 1300 SG CYS A 88 10.233 -3.273 5.741 1.00 70.43 S ATOM 0 H CYS A 88 9.992 -2.301 3.647 1.00 3.54 H new ATOM 0 HA CYS A 88 7.690 -3.994 3.071 1.00 72.21 H new ATOM 0 HB2 CYS A 88 8.318 -4.706 5.447 1.00 23.10 H new ATOM 0 HB3 CYS A 88 9.540 -5.016 4.230 1.00 23.10 H new ATOM 1305 N GLN A 89 6.024 -2.994 4.604 1.00 60.31 N ATOM 1306 CA GLN A 89 4.972 -2.344 5.353 1.00 22.45 C ATOM 1307 C GLN A 89 4.181 -3.403 6.086 1.00 40.02 C ATOM 1308 O GLN A 89 4.050 -4.534 5.589 1.00 42.21 O ATOM 1309 CB GLN A 89 4.079 -1.462 4.444 1.00 74.14 C ATOM 1310 CG GLN A 89 3.152 -2.177 3.460 1.00 30.23 C ATOM 1311 CD GLN A 89 1.812 -2.644 4.050 1.00 70.25 C ATOM 1312 OE1 GLN A 89 1.668 -3.758 4.530 1.00 33.11 O ATOM 1313 NE2 GLN A 89 0.833 -1.784 4.005 1.00 42.34 N ATOM 0 H GLN A 89 5.737 -3.869 4.165 1.00 60.31 H new ATOM 0 HA GLN A 89 5.409 -1.661 6.081 1.00 22.45 H new ATOM 0 HB2 GLN A 89 3.465 -0.830 5.086 1.00 74.14 H new ATOM 0 HB3 GLN A 89 4.730 -0.800 3.873 1.00 74.14 H new ATOM 0 HG2 GLN A 89 2.950 -1.508 2.624 1.00 30.23 H new ATOM 0 HG3 GLN A 89 3.675 -3.044 3.056 1.00 30.23 H new ATOM 0 HE21 GLN A 89 0.983 -0.861 3.598 1.00 42.34 H new ATOM 0 HE22 GLN A 89 -0.083 -2.034 4.377 1.00 42.34 H new ATOM 1322 N GLN A 90 3.750 -3.095 7.267 1.00 32.04 N ATOM 1323 CA GLN A 90 2.950 -4.013 8.046 1.00 53.43 C ATOM 1324 C GLN A 90 1.457 -3.765 7.881 1.00 30.25 C ATOM 1325 O GLN A 90 1.035 -2.666 7.533 1.00 52.25 O ATOM 1326 CB GLN A 90 3.370 -4.016 9.531 1.00 14.03 C ATOM 1327 CG GLN A 90 3.691 -2.644 10.161 1.00 43.03 C ATOM 1328 CD GLN A 90 2.595 -1.588 10.068 1.00 44.13 C ATOM 1329 OE1 GLN A 90 2.538 -0.864 9.119 1.00 25.54 O ATOM 1330 NE2 GLN A 90 1.792 -1.430 11.088 1.00 63.12 N ATOM 0 H GLN A 90 3.937 -2.204 7.727 1.00 32.04 H new ATOM 0 HA GLN A 90 3.144 -5.010 7.651 1.00 53.43 H new ATOM 0 HB2 GLN A 90 2.571 -4.478 10.110 1.00 14.03 H new ATOM 0 HB3 GLN A 90 4.248 -4.653 9.635 1.00 14.03 H new ATOM 0 HG2 GLN A 90 3.930 -2.798 11.213 1.00 43.03 H new ATOM 0 HG3 GLN A 90 4.588 -2.250 9.684 1.00 43.03 H new ATOM 0 HE21 GLN A 90 1.856 -2.058 11.889 1.00 63.12 H new ATOM 0 HE22 GLN A 90 1.102 -0.679 11.082 1.00 63.12 H new ATOM 1339 N TYR A 91 0.661 -4.796 8.090 1.00 2.22 N ATOM 1340 CA TYR A 91 -0.782 -4.637 8.062 1.00 3.23 C ATOM 1341 C TYR A 91 -1.417 -5.438 9.191 1.00 24.23 C ATOM 1342 O TYR A 91 -2.577 -5.845 9.132 1.00 21.03 O ATOM 1343 CB TYR A 91 -1.414 -4.955 6.675 1.00 0.04 C ATOM 1344 CG TYR A 91 -1.363 -6.393 6.208 1.00 51.13 C ATOM 1345 CD1 TYR A 91 -0.259 -6.890 5.574 1.00 10.03 C ATOM 1346 CD2 TYR A 91 -2.454 -7.242 6.389 1.00 73.12 C ATOM 1347 CE1 TYR A 91 -0.220 -8.192 5.133 1.00 14.33 C ATOM 1348 CE2 TYR A 91 -2.421 -8.547 5.951 1.00 52.43 C ATOM 1349 CZ TYR A 91 -1.295 -9.016 5.322 1.00 71.15 C ATOM 1350 OH TYR A 91 -1.238 -10.312 4.894 1.00 32.45 O ATOM 0 H TYR A 91 0.984 -5.745 8.279 1.00 2.22 H new ATOM 0 HA TYR A 91 -0.997 -3.581 8.226 1.00 3.23 H new ATOM 0 HB2 TYR A 91 -2.458 -4.644 6.700 1.00 0.04 H new ATOM 0 HB3 TYR A 91 -0.916 -4.338 5.927 1.00 0.04 H new ATOM 0 HD1 TYR A 91 0.597 -6.250 5.417 1.00 10.03 H new ATOM 0 HD2 TYR A 91 -3.340 -6.870 6.881 1.00 73.12 H new ATOM 0 HE1 TYR A 91 0.663 -8.565 4.636 1.00 14.33 H new ATOM 0 HE2 TYR A 91 -3.272 -9.195 6.101 1.00 52.43 H new ATOM 0 HH TYR A 91 -0.868 -10.341 3.987 1.00 32.45 H new ATOM 1360 N ASP A 92 -0.663 -5.591 10.243 1.00 1.02 N ATOM 1361 CA ASP A 92 -1.094 -6.331 11.412 1.00 53.41 C ATOM 1362 C ASP A 92 -1.744 -5.377 12.426 1.00 31.21 C ATOM 1363 O ASP A 92 -2.635 -5.773 13.182 1.00 42.01 O ATOM 1364 CB ASP A 92 0.116 -7.004 12.062 1.00 64.25 C ATOM 1365 CG ASP A 92 1.028 -6.004 12.706 1.00 63.41 C ATOM 1366 OD1 ASP A 92 1.513 -5.119 11.981 1.00 50.43 O ATOM 1367 OD2 ASP A 92 1.260 -6.097 13.942 1.00 41.02 O ATOM 0 H ASP A 92 0.278 -5.205 10.321 1.00 1.02 H new ATOM 0 HA ASP A 92 -1.820 -7.085 11.109 1.00 53.41 H new ATOM 0 HB2 ASP A 92 -0.224 -7.720 12.810 1.00 64.25 H new ATOM 0 HB3 ASP A 92 0.667 -7.567 11.309 1.00 64.25 H new ATOM 1372 N ASN A 93 -1.298 -4.126 12.438 1.00 43.33 N ATOM 1373 CA ASN A 93 -1.806 -3.141 13.382 1.00 12.31 C ATOM 1374 C ASN A 93 -1.831 -1.770 12.718 1.00 21.01 C ATOM 1375 O ASN A 93 -0.921 -1.428 11.960 1.00 24.15 O ATOM 1376 CB ASN A 93 -0.877 -3.086 14.611 1.00 44.45 C ATOM 1377 CG ASN A 93 -1.415 -2.232 15.745 1.00 1.12 C ATOM 1378 OD1 ASN A 93 -2.630 -2.152 15.963 1.00 71.01 O ATOM 1379 ND2 ASN A 93 -0.530 -1.586 16.469 1.00 73.11 N ATOM 0 H ASN A 93 -0.584 -3.771 11.802 1.00 43.33 H new ATOM 0 HA ASN A 93 -2.813 -3.420 13.691 1.00 12.31 H new ATOM 0 HB2 ASN A 93 -0.713 -4.099 14.977 1.00 44.45 H new ATOM 0 HB3 ASN A 93 0.094 -2.697 14.304 1.00 44.45 H new ATOM 0 HD21 ASN A 93 -0.837 -0.994 17.241 1.00 73.11 H new ATOM 0 HD22 ASN A 93 0.464 -1.676 16.259 1.00 73.11 H new ATOM 1386 N LEU A 94 -2.853 -0.995 12.986 1.00 61.20 N ATOM 1387 CA LEU A 94 -2.968 0.337 12.409 1.00 23.11 C ATOM 1388 C LEU A 94 -2.450 1.424 13.356 1.00 64.22 C ATOM 1389 O LEU A 94 -2.451 1.236 14.582 1.00 24.11 O ATOM 1390 CB LEU A 94 -4.412 0.634 11.944 1.00 53.04 C ATOM 1391 CG LEU A 94 -4.815 0.084 10.575 1.00 15.34 C ATOM 1392 CD1 LEU A 94 -6.304 0.118 10.399 1.00 23.12 C ATOM 1393 CD2 LEU A 94 -4.210 0.944 9.495 1.00 73.32 C ATOM 0 H LEU A 94 -3.623 -1.258 13.601 1.00 61.20 H new ATOM 0 HA LEU A 94 -2.329 0.353 11.526 1.00 23.11 H new ATOM 0 HB2 LEU A 94 -5.099 0.233 12.689 1.00 53.04 H new ATOM 0 HB3 LEU A 94 -4.551 1.715 11.932 1.00 53.04 H new ATOM 0 HG LEU A 94 -4.461 -0.945 10.509 1.00 15.34 H new ATOM 0 HD11 LEU A 94 -6.563 -0.278 9.417 1.00 23.12 H new ATOM 0 HD12 LEU A 94 -6.776 -0.489 11.172 1.00 23.12 H new ATOM 0 HD13 LEU A 94 -6.657 1.146 10.480 1.00 23.12 H new ATOM 0 HD21 LEU A 94 -4.495 0.555 8.518 1.00 73.32 H new ATOM 0 HD22 LEU A 94 -4.573 1.967 9.598 1.00 73.32 H new ATOM 0 HD23 LEU A 94 -3.124 0.933 9.587 1.00 73.32 H new ATOM 1405 N PRO A 95 -1.996 2.587 12.810 1.00 1.10 N ATOM 1406 CA PRO A 95 -1.966 2.864 11.350 1.00 50.42 C ATOM 1407 C PRO A 95 -0.864 2.073 10.645 1.00 35.31 C ATOM 1408 O PRO A 95 0.111 1.700 11.262 1.00 45.32 O ATOM 1409 CB PRO A 95 -1.649 4.361 11.286 1.00 0.05 C ATOM 1410 CG PRO A 95 -0.891 4.634 12.536 1.00 15.32 C ATOM 1411 CD PRO A 95 -1.481 3.734 13.584 1.00 74.51 C ATOM 0 HA PRO A 95 -2.897 2.583 10.858 1.00 50.42 H new ATOM 0 HB2 PRO A 95 -1.059 4.604 10.403 1.00 0.05 H new ATOM 0 HB3 PRO A 95 -2.560 4.958 11.235 1.00 0.05 H new ATOM 0 HG2 PRO A 95 0.171 4.431 12.400 1.00 15.32 H new ATOM 0 HG3 PRO A 95 -0.981 5.681 12.826 1.00 15.32 H new ATOM 0 HD2 PRO A 95 -0.732 3.422 14.312 1.00 74.51 H new ATOM 0 HD3 PRO A 95 -2.276 4.232 14.138 1.00 74.51 H new ATOM 1419 N TYR A 96 -1.023 1.805 9.368 1.00 0.14 N ATOM 1420 CA TYR A 96 0.001 1.075 8.653 1.00 23.01 C ATOM 1421 C TYR A 96 1.078 2.029 8.220 1.00 73.40 C ATOM 1422 O TYR A 96 0.794 3.132 7.774 1.00 60.21 O ATOM 1423 CB TYR A 96 -0.550 0.297 7.455 1.00 42.31 C ATOM 1424 CG TYR A 96 -1.633 -0.700 7.802 1.00 53.43 C ATOM 1425 CD1 TYR A 96 -1.568 -1.461 8.964 1.00 71.15 C ATOM 1426 CD2 TYR A 96 -2.732 -0.867 6.974 1.00 41.22 C ATOM 1427 CE1 TYR A 96 -2.569 -2.363 9.281 1.00 43.31 C ATOM 1428 CE2 TYR A 96 -3.733 -1.760 7.281 1.00 72.13 C ATOM 1429 CZ TYR A 96 -3.650 -2.506 8.432 1.00 12.35 C ATOM 1430 OH TYR A 96 -4.645 -3.400 8.726 1.00 22.35 O ATOM 0 H TYR A 96 -1.834 2.075 8.812 1.00 0.14 H new ATOM 0 HA TYR A 96 0.415 0.330 9.333 1.00 23.01 H new ATOM 0 HB2 TYR A 96 -0.945 1.006 6.728 1.00 42.31 H new ATOM 0 HB3 TYR A 96 0.272 -0.231 6.971 1.00 42.31 H new ATOM 0 HD1 TYR A 96 -0.724 -1.347 9.629 1.00 71.15 H new ATOM 0 HD2 TYR A 96 -2.804 -0.284 6.068 1.00 41.22 H new ATOM 0 HE1 TYR A 96 -2.506 -2.951 10.185 1.00 43.31 H new ATOM 0 HE2 TYR A 96 -4.580 -1.874 6.620 1.00 72.13 H new ATOM 0 HH TYR A 96 -4.252 -4.281 8.901 1.00 22.35 H new ATOM 1440 N THR A 97 2.287 1.630 8.396 1.00 1.24 N ATOM 1441 CA THR A 97 3.422 2.432 8.097 1.00 21.24 C ATOM 1442 C THR A 97 4.429 1.658 7.255 1.00 54.04 C ATOM 1443 O THR A 97 4.438 0.428 7.250 1.00 72.12 O ATOM 1444 CB THR A 97 4.087 2.913 9.411 1.00 52.20 C ATOM 1445 OG1 THR A 97 4.366 1.768 10.259 1.00 73.43 O ATOM 1446 CG2 THR A 97 3.155 3.838 10.168 1.00 3.15 C ATOM 0 H THR A 97 2.522 0.708 8.763 1.00 1.24 H new ATOM 0 HA THR A 97 3.091 3.297 7.522 1.00 21.24 H new ATOM 0 HB THR A 97 5.006 3.441 9.157 1.00 52.20 H new ATOM 0 HG1 THR A 97 5.324 1.737 10.462 1.00 73.43 H new ATOM 0 HG21 THR A 97 3.637 4.167 11.089 1.00 3.15 H new ATOM 0 HG22 THR A 97 2.922 4.705 9.550 1.00 3.15 H new ATOM 0 HG23 THR A 97 2.234 3.308 10.410 1.00 3.15 H new ATOM 1454 N PHE A 98 5.266 2.375 6.575 1.00 11.22 N ATOM 1455 CA PHE A 98 6.293 1.800 5.748 1.00 61.40 C ATOM 1456 C PHE A 98 7.632 1.999 6.362 1.00 1.43 C ATOM 1457 O PHE A 98 7.829 2.901 7.193 1.00 63.13 O ATOM 1458 CB PHE A 98 6.347 2.502 4.398 1.00 53.23 C ATOM 1459 CG PHE A 98 5.333 2.123 3.377 1.00 2.40 C ATOM 1460 CD1 PHE A 98 3.977 2.243 3.604 1.00 14.55 C ATOM 1461 CD2 PHE A 98 5.764 1.653 2.163 1.00 21.45 C ATOM 1462 CE1 PHE A 98 3.076 1.893 2.624 1.00 21.43 C ATOM 1463 CE2 PHE A 98 4.886 1.307 1.186 1.00 1.03 C ATOM 1464 CZ PHE A 98 3.531 1.422 1.407 1.00 62.34 C ATOM 0 H PHE A 98 5.260 3.395 6.575 1.00 11.22 H new ATOM 0 HA PHE A 98 6.056 0.741 5.640 1.00 61.40 H new ATOM 0 HB2 PHE A 98 6.260 3.574 4.574 1.00 53.23 H new ATOM 0 HB3 PHE A 98 7.334 2.329 3.970 1.00 53.23 H new ATOM 0 HD1 PHE A 98 3.621 2.613 4.554 1.00 14.55 H new ATOM 0 HD2 PHE A 98 6.824 1.556 1.980 1.00 21.45 H new ATOM 0 HE1 PHE A 98 2.016 1.986 2.806 1.00 21.43 H new ATOM 0 HE2 PHE A 98 5.250 0.942 0.237 1.00 1.03 H new ATOM 0 HZ PHE A 98 2.829 1.146 0.634 1.00 62.34 H new ATOM 1474 N GLY A 99 8.547 1.166 5.962 1.00 14.04 N ATOM 1475 CA GLY A 99 9.898 1.348 6.324 1.00 14.10 C ATOM 1476 C GLY A 99 10.579 2.208 5.292 1.00 50.11 C ATOM 1477 O GLY A 99 9.999 2.458 4.215 1.00 12.25 O ATOM 0 H GLY A 99 8.367 0.349 5.379 1.00 14.04 H new ATOM 0 HA2 GLY A 99 9.963 1.818 7.306 1.00 14.10 H new ATOM 0 HA3 GLY A 99 10.400 0.383 6.398 1.00 14.10 H new ATOM 1481 N GLN A 100 11.774 2.656 5.607 1.00 42.51 N ATOM 1482 CA GLN A 100 12.612 3.479 4.727 1.00 75.44 C ATOM 1483 C GLN A 100 12.674 2.881 3.312 1.00 22.45 C ATOM 1484 O GLN A 100 12.169 3.458 2.330 1.00 35.41 O ATOM 1485 CB GLN A 100 14.017 3.522 5.336 1.00 61.12 C ATOM 1486 CG GLN A 100 15.074 4.236 4.518 1.00 22.31 C ATOM 1487 CD GLN A 100 16.435 4.098 5.162 1.00 61.00 C ATOM 1488 OE1 GLN A 100 16.856 4.930 5.969 1.00 11.53 O ATOM 1489 NE2 GLN A 100 17.121 3.031 4.833 1.00 22.21 N ATOM 0 H GLN A 100 12.213 2.459 6.506 1.00 42.51 H new ATOM 0 HA GLN A 100 12.192 4.481 4.644 1.00 75.44 H new ATOM 0 HB2 GLN A 100 13.954 4.004 6.312 1.00 61.12 H new ATOM 0 HB3 GLN A 100 14.349 2.498 5.507 1.00 61.12 H new ATOM 0 HG2 GLN A 100 15.100 3.823 3.510 1.00 22.31 H new ATOM 0 HG3 GLN A 100 14.816 5.291 4.424 1.00 22.31 H new ATOM 0 HE21 GLN A 100 16.738 2.366 4.161 1.00 22.21 H new ATOM 0 HE22 GLN A 100 18.038 2.866 5.249 1.00 22.21 H new ATOM 1498 N GLY A 101 13.233 1.719 3.219 1.00 74.52 N ATOM 1499 CA GLY A 101 13.353 1.088 1.958 1.00 21.10 C ATOM 1500 C GLY A 101 14.770 0.935 1.531 1.00 3.42 C ATOM 1501 O GLY A 101 15.668 1.585 2.071 1.00 1.20 O ATOM 0 H GLY A 101 13.612 1.192 4.005 1.00 74.52 H new ATOM 0 HA2 GLY A 101 12.881 0.106 2.000 1.00 21.10 H new ATOM 0 HA3 GLY A 101 12.812 1.670 1.211 1.00 21.10 H new ATOM 1505 N THR A 102 14.966 0.057 0.606 1.00 21.35 N ATOM 1506 CA THR A 102 16.228 -0.186 0.023 1.00 21.21 C ATOM 1507 C THR A 102 16.217 0.412 -1.360 1.00 23.23 C ATOM 1508 O THR A 102 15.324 0.102 -2.173 1.00 54.05 O ATOM 1509 CB THR A 102 16.462 -1.703 -0.101 1.00 21.52 C ATOM 1510 OG1 THR A 102 16.342 -2.314 1.189 1.00 13.22 O ATOM 1511 CG2 THR A 102 17.838 -2.012 -0.697 1.00 14.24 C ATOM 0 H THR A 102 14.221 -0.528 0.227 1.00 21.35 H new ATOM 0 HA THR A 102 17.015 0.251 0.638 1.00 21.21 H new ATOM 0 HB THR A 102 15.707 -2.109 -0.775 1.00 21.52 H new ATOM 0 HG1 THR A 102 17.170 -2.177 1.694 1.00 13.22 H new ATOM 0 HG21 THR A 102 17.969 -3.092 -0.770 1.00 14.24 H new ATOM 0 HG22 THR A 102 17.912 -1.570 -1.690 1.00 14.24 H new ATOM 0 HG23 THR A 102 18.614 -1.595 -0.056 1.00 14.24 H new ATOM 1519 N LYS A 103 17.147 1.272 -1.623 1.00 40.23 N ATOM 1520 CA LYS A 103 17.290 1.830 -2.926 1.00 3.13 C ATOM 1521 C LYS A 103 18.126 0.838 -3.718 1.00 13.51 C ATOM 1522 O LYS A 103 19.272 0.545 -3.360 1.00 44.44 O ATOM 1523 CB LYS A 103 17.915 3.252 -2.822 1.00 23.30 C ATOM 1524 CG LYS A 103 18.013 4.070 -4.123 1.00 33.31 C ATOM 1525 CD LYS A 103 19.109 3.588 -5.052 1.00 63.53 C ATOM 1526 CE LYS A 103 20.501 3.783 -4.441 1.00 71.03 C ATOM 1527 NZ LYS A 103 20.799 5.207 -4.140 1.00 51.33 N ATOM 0 H LYS A 103 17.828 1.606 -0.941 1.00 40.23 H new ATOM 0 HA LYS A 103 16.340 1.976 -3.440 1.00 3.13 H new ATOM 0 HB2 LYS A 103 17.331 3.827 -2.104 1.00 23.30 H new ATOM 0 HB3 LYS A 103 18.919 3.151 -2.409 1.00 23.30 H new ATOM 0 HG2 LYS A 103 17.057 4.025 -4.645 1.00 33.31 H new ATOM 0 HG3 LYS A 103 18.191 5.116 -3.874 1.00 33.31 H new ATOM 0 HD2 LYS A 103 18.956 2.533 -5.278 1.00 63.53 H new ATOM 0 HD3 LYS A 103 19.048 4.128 -5.997 1.00 63.53 H new ATOM 0 HE2 LYS A 103 20.576 3.198 -3.524 1.00 71.03 H new ATOM 0 HE3 LYS A 103 21.253 3.396 -5.129 1.00 71.03 H new ATOM 0 HZ1 LYS A 103 21.814 5.314 -3.940 1.00 51.33 H new ATOM 0 HZ2 LYS A 103 20.543 5.796 -4.958 1.00 51.33 H new ATOM 0 HZ3 LYS A 103 20.249 5.509 -3.311 1.00 51.33 H new ATOM 1541 N LEU A 104 17.558 0.316 -4.759 1.00 15.31 N ATOM 1542 CA LEU A 104 18.171 -0.759 -5.491 1.00 33.24 C ATOM 1543 C LEU A 104 18.859 -0.200 -6.721 1.00 45.40 C ATOM 1544 O LEU A 104 18.327 0.689 -7.386 1.00 52.42 O ATOM 1545 CB LEU A 104 17.057 -1.793 -5.857 1.00 3.20 C ATOM 1546 CG LEU A 104 17.466 -3.178 -6.426 1.00 54.41 C ATOM 1547 CD1 LEU A 104 18.062 -3.089 -7.813 1.00 44.13 C ATOM 1548 CD2 LEU A 104 18.411 -3.898 -5.474 1.00 15.53 C ATOM 0 H LEU A 104 16.657 0.619 -5.129 1.00 15.31 H new ATOM 0 HA LEU A 104 18.932 -1.264 -4.896 1.00 33.24 H new ATOM 0 HB2 LEU A 104 16.465 -1.969 -4.959 1.00 3.20 H new ATOM 0 HB3 LEU A 104 16.398 -1.321 -6.585 1.00 3.20 H new ATOM 0 HG LEU A 104 16.550 -3.761 -6.517 1.00 54.41 H new ATOM 0 HD11 LEU A 104 18.329 -4.088 -8.159 1.00 44.13 H new ATOM 0 HD12 LEU A 104 17.333 -2.651 -8.495 1.00 44.13 H new ATOM 0 HD13 LEU A 104 18.954 -2.464 -7.786 1.00 44.13 H new ATOM 0 HD21 LEU A 104 18.683 -4.866 -5.895 1.00 15.53 H new ATOM 0 HD22 LEU A 104 19.310 -3.298 -5.331 1.00 15.53 H new ATOM 0 HD23 LEU A 104 17.917 -4.046 -4.514 1.00 15.53 H new ATOM 1560 N GLU A 105 20.058 -0.694 -6.988 1.00 20.15 N ATOM 1561 CA GLU A 105 20.822 -0.290 -8.139 1.00 25.23 C ATOM 1562 C GLU A 105 21.326 -1.506 -8.860 1.00 43.31 C ATOM 1563 O GLU A 105 21.538 -2.567 -8.253 1.00 72.42 O ATOM 1564 CB GLU A 105 22.062 0.491 -7.745 1.00 4.52 C ATOM 1565 CG GLU A 105 21.844 1.686 -6.891 1.00 10.32 C ATOM 1566 CD GLU A 105 23.124 2.432 -6.692 1.00 64.34 C ATOM 1567 OE1 GLU A 105 23.947 2.023 -5.856 1.00 13.31 O ATOM 1568 OE2 GLU A 105 23.343 3.429 -7.395 1.00 53.10 O ATOM 0 H GLU A 105 20.523 -1.389 -6.404 1.00 20.15 H new ATOM 0 HA GLU A 105 20.162 0.322 -8.754 1.00 25.23 H new ATOM 0 HB2 GLU A 105 22.739 -0.184 -7.222 1.00 4.52 H new ATOM 0 HB3 GLU A 105 22.569 0.809 -8.656 1.00 4.52 H new ATOM 0 HG2 GLU A 105 21.104 2.340 -7.353 1.00 10.32 H new ATOM 0 HG3 GLU A 105 21.441 1.381 -5.925 1.00 10.32 H new ATOM 1575 N ILE A 106 21.548 -1.356 -10.117 1.00 44.10 N ATOM 1576 CA ILE A 106 22.156 -2.375 -10.902 1.00 51.10 C ATOM 1577 C ILE A 106 23.551 -1.955 -11.288 1.00 45.22 C ATOM 1578 O ILE A 106 23.754 -0.920 -11.934 1.00 10.10 O ATOM 1579 CB ILE A 106 21.295 -2.787 -12.123 1.00 23.04 C ATOM 1580 CG1 ILE A 106 20.122 -3.652 -11.638 1.00 72.22 C ATOM 1581 CG2 ILE A 106 22.121 -3.534 -13.175 1.00 62.32 C ATOM 1582 CD1 ILE A 106 19.131 -3.993 -12.702 1.00 3.42 C ATOM 0 H ILE A 106 21.310 -0.512 -10.638 1.00 44.10 H new ATOM 0 HA ILE A 106 22.227 -3.276 -10.293 1.00 51.10 H new ATOM 0 HB ILE A 106 20.915 -1.885 -12.602 1.00 23.04 H new ATOM 0 HG12 ILE A 106 20.517 -4.576 -11.216 1.00 72.22 H new ATOM 0 HG13 ILE A 106 19.607 -3.128 -10.833 1.00 72.22 H new ATOM 0 HG21 ILE A 106 21.481 -3.805 -14.015 1.00 62.32 H new ATOM 0 HG22 ILE A 106 22.928 -2.892 -13.527 1.00 62.32 H new ATOM 0 HG23 ILE A 106 22.542 -4.437 -12.733 1.00 62.32 H new ATOM 0 HD11 ILE A 106 18.336 -4.605 -12.276 1.00 3.42 H new ATOM 0 HD12 ILE A 106 18.705 -3.076 -13.109 1.00 3.42 H new ATOM 0 HD13 ILE A 106 19.628 -4.547 -13.498 1.00 3.42 H new ATOM 1594 N LYS A 107 24.510 -2.736 -10.860 1.00 61.33 N ATOM 1595 CA LYS A 107 25.889 -2.451 -11.104 1.00 44.53 C ATOM 1596 C LYS A 107 26.374 -3.231 -12.300 1.00 21.32 C ATOM 1597 O LYS A 107 25.804 -4.271 -12.645 1.00 73.30 O ATOM 1598 CB LYS A 107 26.759 -2.776 -9.881 1.00 53.15 C ATOM 1599 CG LYS A 107 26.790 -4.225 -9.508 1.00 13.31 C ATOM 1600 CD LYS A 107 27.745 -4.473 -8.371 1.00 42.10 C ATOM 1601 CE LYS A 107 27.880 -5.946 -8.145 1.00 11.22 C ATOM 1602 NZ LYS A 107 28.858 -6.283 -7.082 1.00 31.42 N ATOM 0 H LYS A 107 24.348 -3.592 -10.329 1.00 61.33 H new ATOM 0 HA LYS A 107 25.977 -1.383 -11.304 1.00 44.53 H new ATOM 0 HB2 LYS A 107 27.778 -2.443 -10.077 1.00 53.15 H new ATOM 0 HB3 LYS A 107 26.394 -2.202 -9.029 1.00 53.15 H new ATOM 0 HG2 LYS A 107 25.790 -4.552 -9.224 1.00 13.31 H new ATOM 0 HG3 LYS A 107 27.087 -4.820 -10.372 1.00 13.31 H new ATOM 0 HD2 LYS A 107 28.718 -4.038 -8.598 1.00 42.10 H new ATOM 0 HD3 LYS A 107 27.383 -3.987 -7.465 1.00 42.10 H new ATOM 0 HE2 LYS A 107 26.906 -6.358 -7.879 1.00 11.22 H new ATOM 0 HE3 LYS A 107 28.185 -6.424 -9.076 1.00 11.22 H new ATOM 0 HZ1 LYS A 107 28.908 -7.316 -6.971 1.00 31.42 H new ATOM 0 HZ2 LYS A 107 29.796 -5.917 -7.344 1.00 31.42 H new ATOM 0 HZ3 LYS A 107 28.557 -5.853 -6.184 1.00 31.42 H new ATOM 1616 N ARG A 108 27.394 -2.738 -12.925 1.00 55.14 N ATOM 1617 CA ARG A 108 27.976 -3.396 -14.077 1.00 74.24 C ATOM 1618 C ARG A 108 28.921 -4.510 -13.642 1.00 31.24 C ATOM 1619 O ARG A 108 29.386 -4.529 -12.487 1.00 72.13 O ATOM 1620 CB ARG A 108 28.710 -2.391 -14.959 1.00 3.43 C ATOM 1621 CG ARG A 108 27.819 -1.312 -15.566 1.00 41.25 C ATOM 1622 CD ARG A 108 26.788 -1.909 -16.512 1.00 44.12 C ATOM 1623 NE ARG A 108 27.431 -2.649 -17.605 1.00 53.44 N ATOM 1624 CZ ARG A 108 26.799 -3.353 -18.547 1.00 62.24 C ATOM 1625 NH1 ARG A 108 25.470 -3.409 -18.574 1.00 43.13 N ATOM 1626 NH2 ARG A 108 27.504 -3.996 -19.463 1.00 72.25 N ATOM 0 H ARG A 108 27.856 -1.868 -12.660 1.00 55.14 H new ATOM 0 HA ARG A 108 27.167 -3.838 -14.658 1.00 74.24 H new ATOM 0 HB2 ARG A 108 29.490 -1.910 -14.369 1.00 3.43 H new ATOM 0 HB3 ARG A 108 29.207 -2.930 -15.766 1.00 3.43 H new ATOM 0 HG2 ARG A 108 27.312 -0.767 -14.770 1.00 41.25 H new ATOM 0 HG3 ARG A 108 28.434 -0.591 -16.104 1.00 41.25 H new ATOM 0 HD2 ARG A 108 26.127 -2.576 -15.959 1.00 44.12 H new ATOM 0 HD3 ARG A 108 26.167 -1.114 -16.925 1.00 44.12 H new ATOM 0 HE ARG A 108 28.450 -2.623 -17.648 1.00 53.44 H new ATOM 0 HH11 ARG A 108 24.924 -2.911 -17.871 1.00 43.13 H new ATOM 0 HH12 ARG A 108 24.997 -3.950 -19.298 1.00 43.13 H new ATOM 0 HH21 ARG A 108 28.523 -3.952 -19.446 1.00 72.25 H new ATOM 0 HH22 ARG A 108 27.029 -4.536 -20.186 1.00 72.25 H new ATOM 1641 N ASP B 201 7.096 11.509 8.740 1.00 32.53 N ATOM 1642 CA ASP B 201 5.829 10.887 8.411 1.00 4.10 C ATOM 1643 C ASP B 201 4.739 11.934 8.363 1.00 74.20 C ATOM 1644 O ASP B 201 4.780 12.936 9.090 1.00 62.11 O ATOM 1645 CB ASP B 201 5.456 9.784 9.418 1.00 23.31 C ATOM 1646 CG ASP B 201 5.185 10.295 10.815 1.00 44.25 C ATOM 1647 OD1 ASP B 201 6.147 10.403 11.624 1.00 31.44 O ATOM 1648 OD2 ASP B 201 4.014 10.573 11.135 1.00 65.05 O ATOM 0 HA ASP B 201 5.932 10.420 7.432 1.00 4.10 H new ATOM 0 HB2 ASP B 201 4.572 9.259 9.056 1.00 23.31 H new ATOM 0 HB3 ASP B 201 6.265 9.055 9.459 1.00 23.31 H new ATOM 1653 N ILE B 202 3.819 11.738 7.474 1.00 11.55 N ATOM 1654 CA ILE B 202 2.693 12.621 7.294 1.00 14.43 C ATOM 1655 C ILE B 202 1.446 11.990 7.909 1.00 41.43 C ATOM 1656 O ILE B 202 1.182 10.827 7.696 1.00 3.14 O ATOM 1657 CB ILE B 202 2.504 12.884 5.792 1.00 44.22 C ATOM 1658 CG1 ILE B 202 3.742 13.604 5.253 1.00 62.04 C ATOM 1659 CG2 ILE B 202 1.240 13.707 5.524 1.00 41.11 C ATOM 1660 CD1 ILE B 202 3.834 13.620 3.769 1.00 1.43 C ATOM 0 H ILE B 202 3.822 10.944 6.834 1.00 11.55 H new ATOM 0 HA ILE B 202 2.870 13.573 7.795 1.00 14.43 H new ATOM 0 HB ILE B 202 2.382 11.930 5.279 1.00 44.22 H new ATOM 0 HG12 ILE B 202 3.740 14.631 5.618 1.00 62.04 H new ATOM 0 HG13 ILE B 202 4.633 13.124 5.657 1.00 62.04 H new ATOM 0 HG21 ILE B 202 1.136 13.875 4.452 1.00 41.11 H new ATOM 0 HG22 ILE B 202 0.369 13.166 5.893 1.00 41.11 H new ATOM 0 HG23 ILE B 202 1.315 14.666 6.036 1.00 41.11 H new ATOM 0 HD11 ILE B 202 4.738 14.148 3.466 1.00 1.43 H new ATOM 0 HD12 ILE B 202 3.869 12.597 3.396 1.00 1.43 H new ATOM 0 HD13 ILE B 202 2.962 14.127 3.356 1.00 1.43 H new ATOM 1672 N GLN B 203 0.709 12.752 8.668 1.00 64.21 N ATOM 1673 CA GLN B 203 -0.471 12.256 9.355 1.00 34.42 C ATOM 1674 C GLN B 203 -1.723 12.390 8.502 1.00 21.22 C ATOM 1675 O GLN B 203 -2.102 13.489 8.115 1.00 73.33 O ATOM 1676 CB GLN B 203 -0.652 12.991 10.670 1.00 2.14 C ATOM 1677 CG GLN B 203 0.434 12.708 11.681 1.00 31.45 C ATOM 1678 CD GLN B 203 0.203 13.432 12.972 1.00 61.12 C ATOM 1679 OE1 GLN B 203 -0.438 12.913 13.882 1.00 51.30 O ATOM 1680 NE2 GLN B 203 0.700 14.624 13.064 1.00 30.43 N ATOM 0 H GLN B 203 0.903 13.740 8.834 1.00 64.21 H new ATOM 0 HA GLN B 203 -0.320 11.194 9.549 1.00 34.42 H new ATOM 0 HB2 GLN B 203 -0.684 14.063 10.475 1.00 2.14 H new ATOM 0 HB3 GLN B 203 -1.616 12.717 11.099 1.00 2.14 H new ATOM 0 HG2 GLN B 203 0.482 11.636 11.871 1.00 31.45 H new ATOM 0 HG3 GLN B 203 1.399 13.002 11.268 1.00 31.45 H new ATOM 0 HE21 GLN B 203 1.227 15.019 12.285 1.00 30.43 H new ATOM 0 HE22 GLN B 203 0.565 15.168 13.916 1.00 30.43 H new ATOM 1689 N MET B 204 -2.360 11.275 8.227 1.00 24.21 N ATOM 1690 CA MET B 204 -3.561 11.250 7.415 1.00 34.41 C ATOM 1691 C MET B 204 -4.783 11.121 8.322 1.00 44.13 C ATOM 1692 O MET B 204 -5.019 10.073 8.922 1.00 70.23 O ATOM 1693 CB MET B 204 -3.513 10.082 6.418 1.00 2.14 C ATOM 1694 CG MET B 204 -2.258 10.056 5.549 1.00 11.14 C ATOM 1695 SD MET B 204 -2.015 11.565 4.585 1.00 72.11 S ATOM 1696 CE MET B 204 -3.428 11.532 3.487 1.00 71.40 C ATOM 0 H MET B 204 -2.062 10.358 8.559 1.00 24.21 H new ATOM 0 HA MET B 204 -3.628 12.179 6.848 1.00 34.41 H new ATOM 0 HB2 MET B 204 -3.579 9.144 6.970 1.00 2.14 H new ATOM 0 HB3 MET B 204 -4.389 10.134 5.771 1.00 2.14 H new ATOM 0 HG2 MET B 204 -1.388 9.898 6.186 1.00 11.14 H new ATOM 0 HG3 MET B 204 -2.314 9.206 4.869 1.00 11.14 H new ATOM 0 HE1 MET B 204 -3.099 11.722 2.465 1.00 71.40 H new ATOM 0 HE2 MET B 204 -3.906 10.554 3.539 1.00 71.40 H new ATOM 0 HE3 MET B 204 -4.140 12.300 3.787 1.00 71.40 H new ATOM 1706 N THR B 205 -5.525 12.181 8.440 1.00 13.24 N ATOM 1707 CA THR B 205 -6.692 12.246 9.304 1.00 1.15 C ATOM 1708 C THR B 205 -7.971 11.952 8.492 1.00 63.44 C ATOM 1709 O THR B 205 -8.205 12.590 7.474 1.00 71.33 O ATOM 1710 CB THR B 205 -6.780 13.669 9.896 1.00 2.01 C ATOM 1711 OG1 THR B 205 -5.543 13.976 10.582 1.00 64.44 O ATOM 1712 CG2 THR B 205 -7.956 13.817 10.858 1.00 61.50 C ATOM 0 H THR B 205 -5.343 13.048 7.934 1.00 13.24 H new ATOM 0 HA THR B 205 -6.603 11.506 10.099 1.00 1.15 H new ATOM 0 HB THR B 205 -6.941 14.367 9.075 1.00 2.01 H new ATOM 0 HG1 THR B 205 -5.593 14.879 10.958 1.00 64.44 H new ATOM 0 HG21 THR B 205 -7.979 14.834 11.250 1.00 61.50 H new ATOM 0 HG22 THR B 205 -8.887 13.611 10.329 1.00 61.50 H new ATOM 0 HG23 THR B 205 -7.843 13.113 11.682 1.00 61.50 H new ATOM 1720 N GLN B 206 -8.786 11.004 8.936 1.00 61.30 N ATOM 1721 CA GLN B 206 -10.005 10.670 8.209 1.00 33.53 C ATOM 1722 C GLN B 206 -11.242 10.931 9.023 1.00 5.33 C ATOM 1723 O GLN B 206 -11.338 10.537 10.195 1.00 40.02 O ATOM 1724 CB GLN B 206 -10.023 9.223 7.758 1.00 44.21 C ATOM 1725 CG GLN B 206 -8.899 8.844 6.846 1.00 41.52 C ATOM 1726 CD GLN B 206 -9.040 7.441 6.354 1.00 75.54 C ATOM 1727 OE1 GLN B 206 -8.549 6.523 7.112 1.00 30.31 O flip ATOM 1728 NE2 GLN B 206 -9.607 7.185 5.314 1.00 41.31 N flip ATOM 0 H GLN B 206 -8.629 10.459 9.784 1.00 61.30 H new ATOM 0 HA GLN B 206 -10.007 11.320 7.334 1.00 33.53 H new ATOM 0 HB2 GLN B 206 -9.992 8.581 8.638 1.00 44.21 H new ATOM 0 HB3 GLN B 206 -10.968 9.025 7.252 1.00 44.21 H new ATOM 0 HG2 GLN B 206 -8.872 9.527 5.997 1.00 41.52 H new ATOM 0 HG3 GLN B 206 -7.950 8.952 7.372 1.00 41.52 H new ATOM 0 HE21 GLN B 206 -9.983 7.939 4.739 1.00 41.31 H new ATOM 0 HE22 GLN B 206 -9.708 6.216 5.013 1.00 41.31 H new ATOM 1737 N SER B 207 -12.165 11.599 8.418 1.00 15.10 N ATOM 1738 CA SER B 207 -13.440 11.837 8.985 1.00 51.11 C ATOM 1739 C SER B 207 -14.457 11.718 7.847 1.00 73.13 C ATOM 1740 O SER B 207 -14.195 12.197 6.730 1.00 73.34 O ATOM 1741 CB SER B 207 -13.483 13.224 9.647 1.00 43.43 C ATOM 1742 OG SER B 207 -14.686 13.419 10.382 1.00 45.32 O ATOM 0 H SER B 207 -12.045 12.004 7.490 1.00 15.10 H new ATOM 0 HA SER B 207 -13.669 11.116 9.769 1.00 51.11 H new ATOM 0 HB2 SER B 207 -12.627 13.336 10.313 1.00 43.43 H new ATOM 0 HB3 SER B 207 -13.395 13.995 8.882 1.00 43.43 H new ATOM 0 HG SER B 207 -14.679 14.310 10.791 1.00 45.32 H new ATOM 1748 N PRO B 208 -15.594 11.055 8.063 1.00 21.34 N ATOM 1749 CA PRO B 208 -15.939 10.421 9.340 1.00 25.23 C ATOM 1750 C PRO B 208 -15.096 9.167 9.605 1.00 73.01 C ATOM 1751 O PRO B 208 -14.617 8.530 8.673 1.00 63.11 O ATOM 1752 CB PRO B 208 -17.412 10.049 9.158 1.00 1.40 C ATOM 1753 CG PRO B 208 -17.564 9.858 7.694 1.00 25.13 C ATOM 1754 CD PRO B 208 -16.647 10.858 7.054 1.00 31.25 C ATOM 0 HA PRO B 208 -15.754 11.076 10.191 1.00 25.23 H new ATOM 0 HB2 PRO B 208 -17.664 9.141 9.706 1.00 1.40 H new ATOM 0 HB3 PRO B 208 -18.070 10.836 9.527 1.00 1.40 H new ATOM 0 HG2 PRO B 208 -17.299 8.842 7.403 1.00 25.13 H new ATOM 0 HG3 PRO B 208 -18.596 10.019 7.384 1.00 25.13 H new ATOM 0 HD2 PRO B 208 -16.238 10.484 6.115 1.00 31.25 H new ATOM 0 HD3 PRO B 208 -17.165 11.790 6.827 1.00 31.25 H new ATOM 1762 N SER B 209 -14.893 8.844 10.867 1.00 54.32 N ATOM 1763 CA SER B 209 -14.141 7.656 11.251 1.00 1.41 C ATOM 1764 C SER B 209 -14.956 6.388 10.968 1.00 41.54 C ATOM 1765 O SER B 209 -14.433 5.279 10.948 1.00 13.14 O ATOM 1766 CB SER B 209 -13.755 7.745 12.722 1.00 13.33 C ATOM 1767 OG SER B 209 -12.971 8.914 12.953 1.00 53.11 O ATOM 0 H SER B 209 -15.241 9.391 11.654 1.00 54.32 H new ATOM 0 HA SER B 209 -13.229 7.602 10.656 1.00 1.41 H new ATOM 0 HB2 SER B 209 -14.652 7.771 13.340 1.00 13.33 H new ATOM 0 HB3 SER B 209 -13.193 6.857 13.013 1.00 13.33 H new ATOM 0 HG SER B 209 -12.864 9.050 13.917 1.00 53.11 H new ATOM 1773 N SER B 210 -16.227 6.569 10.743 1.00 61.31 N ATOM 1774 CA SER B 210 -17.107 5.497 10.400 1.00 4.21 C ATOM 1775 C SER B 210 -18.301 6.050 9.653 1.00 33.13 C ATOM 1776 O SER B 210 -18.802 7.124 9.988 1.00 15.52 O ATOM 1777 CB SER B 210 -17.537 4.735 11.654 1.00 22.55 C ATOM 1778 OG SER B 210 -18.075 5.621 12.635 1.00 11.13 O ATOM 0 H SER B 210 -16.683 7.480 10.794 1.00 61.31 H new ATOM 0 HA SER B 210 -16.587 4.791 9.752 1.00 4.21 H new ATOM 0 HB2 SER B 210 -18.282 3.985 11.390 1.00 22.55 H new ATOM 0 HB3 SER B 210 -16.682 4.202 12.071 1.00 22.55 H new ATOM 0 HG SER B 210 -18.344 5.109 13.426 1.00 11.13 H new ATOM 1784 N LEU B 211 -18.749 5.343 8.662 1.00 51.33 N ATOM 1785 CA LEU B 211 -19.824 5.817 7.836 1.00 20.15 C ATOM 1786 C LEU B 211 -20.764 4.672 7.531 1.00 31.44 C ATOM 1787 O LEU B 211 -20.324 3.598 7.131 1.00 40.11 O ATOM 1788 CB LEU B 211 -19.216 6.450 6.545 1.00 34.13 C ATOM 1789 CG LEU B 211 -20.151 7.147 5.518 1.00 61.31 C ATOM 1790 CD1 LEU B 211 -19.313 7.898 4.513 1.00 2.34 C ATOM 1791 CD2 LEU B 211 -21.013 6.147 4.764 1.00 32.52 C ATOM 0 H LEU B 211 -18.385 4.427 8.401 1.00 51.33 H new ATOM 0 HA LEU B 211 -20.406 6.585 8.347 1.00 20.15 H new ATOM 0 HB2 LEU B 211 -18.473 7.183 6.860 1.00 34.13 H new ATOM 0 HB3 LEU B 211 -18.681 5.661 6.016 1.00 34.13 H new ATOM 0 HG LEU B 211 -20.804 7.821 6.073 1.00 61.31 H new ATOM 0 HD11 LEU B 211 -19.965 8.389 3.790 1.00 2.34 H new ATOM 0 HD12 LEU B 211 -18.712 8.648 5.028 1.00 2.34 H new ATOM 0 HD13 LEU B 211 -18.656 7.201 3.994 1.00 2.34 H new ATOM 0 HD21 LEU B 211 -21.651 6.677 4.057 1.00 32.52 H new ATOM 0 HD22 LEU B 211 -20.373 5.450 4.223 1.00 32.52 H new ATOM 0 HD23 LEU B 211 -21.634 5.596 5.471 1.00 32.52 H new ATOM 1803 N SER B 212 -22.035 4.891 7.751 1.00 2.22 N ATOM 1804 CA SER B 212 -23.029 3.916 7.425 1.00 43.44 C ATOM 1805 C SER B 212 -23.952 4.475 6.356 1.00 50.15 C ATOM 1806 O SER B 212 -24.542 5.558 6.523 1.00 61.53 O ATOM 1807 CB SER B 212 -23.828 3.535 8.653 1.00 63.22 C ATOM 1808 OG SER B 212 -22.964 3.110 9.698 1.00 11.01 O ATOM 0 H SER B 212 -22.404 5.750 8.160 1.00 2.22 H new ATOM 0 HA SER B 212 -22.535 3.020 7.049 1.00 43.44 H new ATOM 0 HB2 SER B 212 -24.420 4.387 8.987 1.00 63.22 H new ATOM 0 HB3 SER B 212 -24.528 2.737 8.405 1.00 63.22 H new ATOM 0 HG SER B 212 -23.496 2.869 10.485 1.00 11.01 H new ATOM 1814 N ALA B 213 -24.057 3.770 5.270 1.00 14.11 N ATOM 1815 CA ALA B 213 -24.898 4.195 4.160 1.00 30.35 C ATOM 1816 C ALA B 213 -25.614 3.003 3.582 1.00 44.44 C ATOM 1817 O ALA B 213 -25.168 1.888 3.748 1.00 31.11 O ATOM 1818 CB ALA B 213 -24.082 4.912 3.098 1.00 74.42 C ATOM 0 H ALA B 213 -23.571 2.887 5.116 1.00 14.11 H new ATOM 0 HA ALA B 213 -25.639 4.903 4.531 1.00 30.35 H new ATOM 0 HB1 ALA B 213 -24.736 5.218 2.281 1.00 74.42 H new ATOM 0 HB2 ALA B 213 -23.610 5.792 3.534 1.00 74.42 H new ATOM 0 HB3 ALA B 213 -23.313 4.241 2.715 1.00 74.42 H new ATOM 1824 N SER B 214 -26.734 3.222 2.969 1.00 71.24 N ATOM 1825 CA SER B 214 -27.500 2.143 2.389 1.00 42.21 C ATOM 1826 C SER B 214 -26.971 1.717 0.999 1.00 41.02 C ATOM 1827 O SER B 214 -26.208 2.447 0.362 1.00 44.21 O ATOM 1828 CB SER B 214 -28.977 2.515 2.379 1.00 51.32 C ATOM 1829 OG SER B 214 -29.177 3.819 1.852 1.00 71.41 O ATOM 0 H SER B 214 -27.150 4.146 2.852 1.00 71.24 H new ATOM 0 HA SER B 214 -27.379 1.257 3.012 1.00 42.21 H new ATOM 0 HB2 SER B 214 -29.533 1.791 1.784 1.00 51.32 H new ATOM 0 HB3 SER B 214 -29.374 2.465 3.393 1.00 51.32 H new ATOM 0 HG SER B 214 -28.785 3.873 0.955 1.00 71.41 H new ATOM 1835 N VAL B 215 -27.377 0.524 0.554 1.00 52.13 N ATOM 1836 CA VAL B 215 -26.925 -0.052 -0.726 1.00 13.54 C ATOM 1837 C VAL B 215 -27.241 0.857 -1.909 1.00 13.41 C ATOM 1838 O VAL B 215 -28.381 1.311 -2.083 1.00 42.35 O ATOM 1839 CB VAL B 215 -27.545 -1.461 -0.984 1.00 70.43 C ATOM 1840 CG1 VAL B 215 -27.093 -2.033 -2.327 1.00 65.14 C ATOM 1841 CG2 VAL B 215 -27.169 -2.412 0.125 1.00 35.20 C ATOM 0 H VAL B 215 -28.027 -0.072 1.066 1.00 52.13 H new ATOM 0 HA VAL B 215 -25.843 -0.152 -0.639 1.00 13.54 H new ATOM 0 HB VAL B 215 -28.628 -1.344 -1.009 1.00 70.43 H new ATOM 0 HG11 VAL B 215 -27.543 -3.015 -2.474 1.00 65.14 H new ATOM 0 HG12 VAL B 215 -27.406 -1.366 -3.130 1.00 65.14 H new ATOM 0 HG13 VAL B 215 -26.007 -2.127 -2.335 1.00 65.14 H new ATOM 0 HG21 VAL B 215 -27.609 -3.390 -0.070 1.00 35.20 H new ATOM 0 HG22 VAL B 215 -26.084 -2.505 0.172 1.00 35.20 H new ATOM 0 HG23 VAL B 215 -27.542 -2.029 1.075 1.00 35.20 H new ATOM 1851 N GLY B 216 -26.231 1.114 -2.706 1.00 1.04 N ATOM 1852 CA GLY B 216 -26.400 1.923 -3.889 1.00 13.44 C ATOM 1853 C GLY B 216 -26.102 3.383 -3.667 1.00 35.01 C ATOM 1854 O GLY B 216 -25.945 4.129 -4.624 1.00 72.10 O ATOM 0 H GLY B 216 -25.281 0.773 -2.556 1.00 1.04 H new ATOM 0 HA2 GLY B 216 -25.748 1.543 -4.675 1.00 13.44 H new ATOM 0 HA3 GLY B 216 -27.424 1.820 -4.247 1.00 13.44 H new ATOM 1858 N ASP B 217 -26.011 3.789 -2.419 1.00 1.45 N ATOM 1859 CA ASP B 217 -25.755 5.186 -2.074 1.00 71.10 C ATOM 1860 C ASP B 217 -24.318 5.575 -2.267 1.00 40.41 C ATOM 1861 O ASP B 217 -23.427 4.723 -2.298 1.00 11.54 O ATOM 1862 CB ASP B 217 -26.216 5.521 -0.653 1.00 1.41 C ATOM 1863 CG ASP B 217 -27.714 5.596 -0.526 1.00 71.32 C ATOM 1864 OD1 ASP B 217 -28.386 4.548 -0.520 1.00 65.11 O ATOM 1865 OD2 ASP B 217 -28.252 6.721 -0.411 1.00 62.14 O ATOM 0 H ASP B 217 -26.110 3.171 -1.614 1.00 1.45 H new ATOM 0 HA ASP B 217 -26.350 5.777 -2.771 1.00 71.10 H new ATOM 0 HB2 ASP B 217 -25.835 4.766 0.035 1.00 1.41 H new ATOM 0 HB3 ASP B 217 -25.783 6.474 -0.351 1.00 1.41 H new ATOM 1870 N ARG B 218 -24.092 6.858 -2.426 1.00 24.43 N ATOM 1871 CA ARG B 218 -22.768 7.373 -2.599 1.00 1.32 C ATOM 1872 C ARG B 218 -22.206 7.825 -1.259 1.00 0.32 C ATOM 1873 O ARG B 218 -22.797 8.668 -0.592 1.00 32.11 O ATOM 1874 CB ARG B 218 -22.756 8.528 -3.602 1.00 42.23 C ATOM 1875 CG ARG B 218 -21.369 9.077 -3.845 1.00 21.34 C ATOM 1876 CD ARG B 218 -21.352 10.200 -4.863 1.00 34.11 C ATOM 1877 NE ARG B 218 -21.799 9.744 -6.180 1.00 73.12 N ATOM 1878 CZ ARG B 218 -21.069 9.782 -7.297 1.00 2.35 C ATOM 1879 NH1 ARG B 218 -19.818 10.240 -7.277 1.00 11.22 N ATOM 1880 NH2 ARG B 218 -21.591 9.354 -8.424 1.00 12.50 N ATOM 0 H ARG B 218 -24.825 7.568 -2.438 1.00 24.43 H new ATOM 0 HA ARG B 218 -22.138 6.577 -2.997 1.00 1.32 H new ATOM 0 HB2 ARG B 218 -23.178 8.187 -4.547 1.00 42.23 H new ATOM 0 HB3 ARG B 218 -23.400 9.328 -3.236 1.00 42.23 H new ATOM 0 HG2 ARG B 218 -20.957 9.440 -2.904 1.00 21.34 H new ATOM 0 HG3 ARG B 218 -20.719 8.272 -4.188 1.00 21.34 H new ATOM 0 HD2 ARG B 218 -21.995 11.011 -4.521 1.00 34.11 H new ATOM 0 HD3 ARG B 218 -20.343 10.605 -4.941 1.00 34.11 H new ATOM 0 HE ARG B 218 -22.744 9.367 -6.250 1.00 73.12 H new ATOM 0 HH11 ARG B 218 -19.408 10.566 -6.402 1.00 11.22 H new ATOM 0 HH12 ARG B 218 -19.270 10.264 -8.137 1.00 11.22 H new ATOM 0 HH21 ARG B 218 -22.546 8.997 -8.440 1.00 12.50 H new ATOM 0 HH22 ARG B 218 -21.041 9.379 -9.283 1.00 12.50 H new ATOM 1894 N VAL B 219 -21.080 7.264 -0.870 1.00 33.44 N ATOM 1895 CA VAL B 219 -20.469 7.591 0.413 1.00 41.24 C ATOM 1896 C VAL B 219 -19.445 8.711 0.237 1.00 23.31 C ATOM 1897 O VAL B 219 -18.846 8.850 -0.847 1.00 11.22 O ATOM 1898 CB VAL B 219 -19.775 6.360 1.085 1.00 14.22 C ATOM 1899 CG1 VAL B 219 -20.630 5.119 1.017 1.00 71.20 C ATOM 1900 CG2 VAL B 219 -18.355 6.116 0.590 1.00 23.42 C ATOM 0 H VAL B 219 -20.564 6.578 -1.421 1.00 33.44 H new ATOM 0 HA VAL B 219 -21.276 7.914 1.070 1.00 41.24 H new ATOM 0 HB VAL B 219 -19.672 6.619 2.139 1.00 14.22 H new ATOM 0 HG11 VAL B 219 -20.108 4.291 1.496 1.00 71.20 H new ATOM 0 HG12 VAL B 219 -21.574 5.299 1.532 1.00 71.20 H new ATOM 0 HG13 VAL B 219 -20.827 4.870 -0.026 1.00 71.20 H new ATOM 0 HG21 VAL B 219 -17.936 5.248 1.099 1.00 23.42 H new ATOM 0 HG22 VAL B 219 -18.370 5.934 -0.485 1.00 23.42 H new ATOM 0 HG23 VAL B 219 -17.741 6.991 0.801 1.00 23.42 H new ATOM 1910 N THR B 220 -19.273 9.511 1.258 1.00 41.41 N ATOM 1911 CA THR B 220 -18.286 10.557 1.231 1.00 14.02 C ATOM 1912 C THR B 220 -17.308 10.391 2.414 1.00 72.01 C ATOM 1913 O THR B 220 -17.705 10.477 3.577 1.00 11.41 O ATOM 1914 CB THR B 220 -18.979 11.939 1.308 1.00 50.13 C ATOM 1915 OG1 THR B 220 -19.908 12.062 0.214 1.00 41.31 O ATOM 1916 CG2 THR B 220 -17.966 13.075 1.238 1.00 4.12 C ATOM 0 H THR B 220 -19.809 9.456 2.124 1.00 41.41 H new ATOM 0 HA THR B 220 -17.727 10.492 0.298 1.00 14.02 H new ATOM 0 HB THR B 220 -19.501 12.008 2.262 1.00 50.13 H new ATOM 0 HG1 THR B 220 -20.352 12.935 0.258 1.00 41.31 H new ATOM 0 HG21 THR B 220 -18.487 14.031 1.295 1.00 4.12 H new ATOM 0 HG22 THR B 220 -17.268 12.992 2.071 1.00 4.12 H new ATOM 0 HG23 THR B 220 -17.417 13.016 0.298 1.00 4.12 H new ATOM 1924 N ILE B 221 -16.053 10.157 2.098 1.00 63.14 N ATOM 1925 CA ILE B 221 -14.994 10.003 3.089 1.00 24.22 C ATOM 1926 C ILE B 221 -13.933 11.075 2.840 1.00 70.31 C ATOM 1927 O ILE B 221 -13.429 11.190 1.730 1.00 1.21 O ATOM 1928 CB ILE B 221 -14.323 8.583 2.982 1.00 12.25 C ATOM 1929 CG1 ILE B 221 -15.331 7.465 3.328 1.00 14.01 C ATOM 1930 CG2 ILE B 221 -13.097 8.496 3.885 1.00 70.33 C ATOM 1931 CD1 ILE B 221 -14.815 6.038 3.142 1.00 51.04 C ATOM 0 H ILE B 221 -15.729 10.066 1.135 1.00 63.14 H new ATOM 0 HA ILE B 221 -15.425 10.107 4.085 1.00 24.22 H new ATOM 0 HB ILE B 221 -14.002 8.442 1.950 1.00 12.25 H new ATOM 0 HG12 ILE B 221 -15.643 7.588 4.365 1.00 14.01 H new ATOM 0 HG13 ILE B 221 -16.219 7.596 2.710 1.00 14.01 H new ATOM 0 HG21 ILE B 221 -12.649 7.506 3.796 1.00 70.33 H new ATOM 0 HG22 ILE B 221 -12.371 9.252 3.586 1.00 70.33 H new ATOM 0 HG23 ILE B 221 -13.394 8.668 4.920 1.00 70.33 H new ATOM 0 HD11 ILE B 221 -15.598 5.330 3.412 1.00 51.04 H new ATOM 0 HD12 ILE B 221 -14.532 5.886 2.100 1.00 51.04 H new ATOM 0 HD13 ILE B 221 -13.946 5.879 3.781 1.00 51.04 H new ATOM 1943 N THR B 222 -13.604 11.858 3.834 1.00 1.41 N ATOM 1944 CA THR B 222 -12.606 12.877 3.645 1.00 41.11 C ATOM 1945 C THR B 222 -11.339 12.577 4.430 1.00 2.42 C ATOM 1946 O THR B 222 -11.393 12.160 5.593 1.00 13.22 O ATOM 1947 CB THR B 222 -13.134 14.305 3.959 1.00 4.01 C ATOM 1948 OG1 THR B 222 -13.655 14.371 5.292 1.00 34.30 O ATOM 1949 CG2 THR B 222 -14.221 14.713 2.973 1.00 63.22 C ATOM 0 H THR B 222 -14.006 11.811 4.770 1.00 1.41 H new ATOM 0 HA THR B 222 -12.356 12.861 2.584 1.00 41.11 H new ATOM 0 HB THR B 222 -12.294 14.994 3.867 1.00 4.01 H new ATOM 0 HG1 THR B 222 -13.560 13.497 5.724 1.00 34.30 H new ATOM 0 HG21 THR B 222 -14.574 15.716 3.214 1.00 63.22 H new ATOM 0 HG22 THR B 222 -13.816 14.705 1.961 1.00 63.22 H new ATOM 0 HG23 THR B 222 -15.052 14.011 3.037 1.00 63.22 H new ATOM 1957 N CYS B 223 -10.216 12.771 3.789 1.00 64.35 N ATOM 1958 CA CYS B 223 -8.943 12.553 4.395 1.00 52.43 C ATOM 1959 C CYS B 223 -8.147 13.837 4.328 1.00 53.45 C ATOM 1960 O CYS B 223 -8.163 14.532 3.312 1.00 11.40 O ATOM 1961 CB CYS B 223 -8.199 11.407 3.696 1.00 44.02 C ATOM 1962 SG CYS B 223 -6.546 11.063 4.378 1.00 44.10 S ATOM 0 H CYS B 223 -10.167 13.088 2.821 1.00 64.35 H new ATOM 0 HA CYS B 223 -9.077 12.265 5.438 1.00 52.43 H new ATOM 0 HB2 CYS B 223 -8.803 10.502 3.764 1.00 44.02 H new ATOM 0 HB3 CYS B 223 -8.100 11.646 2.637 1.00 44.02 H new ATOM 1967 N GLN B 224 -7.498 14.159 5.408 1.00 71.25 N ATOM 1968 CA GLN B 224 -6.720 15.366 5.538 1.00 64.11 C ATOM 1969 C GLN B 224 -5.312 15.023 5.956 1.00 60.11 C ATOM 1970 O GLN B 224 -5.101 14.429 7.018 1.00 15.01 O ATOM 1971 CB GLN B 224 -7.357 16.269 6.585 1.00 44.24 C ATOM 1972 CG GLN B 224 -8.742 16.756 6.221 1.00 65.24 C ATOM 1973 CD GLN B 224 -9.402 17.506 7.350 1.00 22.43 C ATOM 1974 OE1 GLN B 224 -10.108 16.919 8.175 1.00 13.23 O ATOM 1975 NE2 GLN B 224 -9.162 18.772 7.422 1.00 52.34 N ATOM 0 H GLN B 224 -7.492 13.578 6.246 1.00 71.25 H new ATOM 0 HA GLN B 224 -6.693 15.883 4.579 1.00 64.11 H new ATOM 0 HB2 GLN B 224 -7.410 15.729 7.531 1.00 44.24 H new ATOM 0 HB3 GLN B 224 -6.711 17.132 6.746 1.00 44.24 H new ATOM 0 HG2 GLN B 224 -8.678 17.403 5.346 1.00 65.24 H new ATOM 0 HG3 GLN B 224 -9.362 15.904 5.943 1.00 65.24 H new ATOM 0 HE21 GLN B 224 -8.573 19.220 6.720 1.00 52.34 H new ATOM 0 HE22 GLN B 224 -9.561 19.324 8.181 1.00 52.34 H new ATOM 1984 N ALA B 225 -4.369 15.372 5.135 1.00 62.43 N ATOM 1985 CA ALA B 225 -2.975 15.121 5.421 1.00 72.34 C ATOM 1986 C ALA B 225 -2.417 16.236 6.295 1.00 43.12 C ATOM 1987 O ALA B 225 -2.996 17.314 6.367 1.00 1.31 O ATOM 1988 CB ALA B 225 -2.196 15.028 4.122 1.00 15.41 C ATOM 0 H ALA B 225 -4.537 15.840 4.244 1.00 62.43 H new ATOM 0 HA ALA B 225 -2.880 14.177 5.957 1.00 72.34 H new ATOM 0 HB1 ALA B 225 -1.145 14.839 4.341 1.00 15.41 H new ATOM 0 HB2 ALA B 225 -2.593 14.213 3.517 1.00 15.41 H new ATOM 0 HB3 ALA B 225 -2.289 15.966 3.574 1.00 15.41 H new ATOM 1994 N SER B 226 -1.324 15.977 6.974 1.00 55.53 N ATOM 1995 CA SER B 226 -0.695 16.988 7.790 1.00 72.45 C ATOM 1996 C SER B 226 0.211 17.874 6.923 1.00 0.54 C ATOM 1997 O SER B 226 0.557 19.001 7.287 1.00 54.23 O ATOM 1998 CB SER B 226 0.095 16.321 8.909 1.00 1.13 C ATOM 1999 OG SER B 226 1.070 15.430 8.384 1.00 10.42 O ATOM 0 H SER B 226 -0.852 15.073 6.977 1.00 55.53 H new ATOM 0 HA SER B 226 -1.458 17.624 8.238 1.00 72.45 H new ATOM 0 HB2 SER B 226 0.583 17.082 9.518 1.00 1.13 H new ATOM 0 HB3 SER B 226 -0.585 15.776 9.564 1.00 1.13 H new ATOM 0 HG SER B 226 1.836 15.388 8.993 1.00 10.42 H new ATOM 2005 N GLN B 227 0.571 17.352 5.771 1.00 71.31 N ATOM 2006 CA GLN B 227 1.419 18.024 4.817 1.00 51.31 C ATOM 2007 C GLN B 227 0.728 17.974 3.474 1.00 15.13 C ATOM 2008 O GLN B 227 -0.021 17.044 3.215 1.00 52.22 O ATOM 2009 CB GLN B 227 2.799 17.313 4.740 1.00 73.02 C ATOM 2010 CG GLN B 227 3.779 17.930 3.740 1.00 73.31 C ATOM 2011 CD GLN B 227 5.138 17.249 3.706 1.00 41.10 C ATOM 2012 OE1 GLN B 227 5.312 16.295 2.815 1.00 21.41 O flip ATOM 2013 NE2 GLN B 227 6.042 17.607 4.459 1.00 33.34 N flip ATOM 0 H GLN B 227 0.273 16.425 5.466 1.00 71.31 H new ATOM 0 HA GLN B 227 1.589 19.058 5.116 1.00 51.31 H new ATOM 0 HB2 GLN B 227 3.255 17.325 5.730 1.00 73.02 H new ATOM 0 HB3 GLN B 227 2.640 16.268 4.475 1.00 73.02 H new ATOM 0 HG2 GLN B 227 3.339 17.890 2.744 1.00 73.31 H new ATOM 0 HG3 GLN B 227 3.918 18.983 3.985 1.00 73.31 H new ATOM 0 HE21 GLN B 227 5.876 18.349 5.139 1.00 33.34 H new ATOM 0 HE22 GLN B 227 6.958 17.162 4.404 1.00 33.34 H new ATOM 2022 N ASP B 228 0.940 18.973 2.649 1.00 14.24 N ATOM 2023 CA ASP B 228 0.385 18.972 1.301 1.00 41.01 C ATOM 2024 C ASP B 228 1.055 17.875 0.512 1.00 21.40 C ATOM 2025 O ASP B 228 2.275 17.832 0.440 1.00 43.12 O ATOM 2026 CB ASP B 228 0.635 20.314 0.619 1.00 30.22 C ATOM 2027 CG ASP B 228 0.158 20.364 -0.828 1.00 74.22 C ATOM 2028 OD1 ASP B 228 0.845 19.811 -1.723 1.00 53.21 O ATOM 2029 OD2 ASP B 228 -0.886 20.988 -1.100 1.00 65.41 O ATOM 0 H ASP B 228 1.491 19.799 2.880 1.00 14.24 H new ATOM 0 HA ASP B 228 -0.691 18.806 1.350 1.00 41.01 H new ATOM 0 HB2 ASP B 228 0.133 21.098 1.185 1.00 30.22 H new ATOM 0 HB3 ASP B 228 1.702 20.533 0.648 1.00 30.22 H new ATOM 2034 N ILE B 229 0.275 16.995 -0.055 1.00 1.12 N ATOM 2035 CA ILE B 229 0.817 15.861 -0.793 1.00 52.41 C ATOM 2036 C ILE B 229 0.348 15.912 -2.251 1.00 50.15 C ATOM 2037 O ILE B 229 0.552 14.984 -3.031 1.00 64.55 O ATOM 2038 CB ILE B 229 0.388 14.518 -0.138 1.00 64.41 C ATOM 2039 CG1 ILE B 229 -1.126 14.367 -0.175 1.00 72.15 C ATOM 2040 CG2 ILE B 229 0.877 14.462 1.305 1.00 24.40 C ATOM 2041 CD1 ILE B 229 -1.626 13.073 0.413 1.00 30.42 C ATOM 0 H ILE B 229 -0.744 17.032 -0.026 1.00 1.12 H new ATOM 0 HA ILE B 229 1.905 15.921 -0.766 1.00 52.41 H new ATOM 0 HB ILE B 229 0.836 13.699 -0.701 1.00 64.41 H new ATOM 0 HG12 ILE B 229 -1.577 15.199 0.366 1.00 72.15 H new ATOM 0 HG13 ILE B 229 -1.463 14.439 -1.209 1.00 72.15 H new ATOM 0 HG21 ILE B 229 0.572 13.518 1.756 1.00 24.40 H new ATOM 0 HG22 ILE B 229 1.964 14.539 1.324 1.00 24.40 H new ATOM 0 HG23 ILE B 229 0.445 15.289 1.868 1.00 24.40 H new ATOM 0 HD11 ILE B 229 -2.714 13.041 0.350 1.00 30.42 H new ATOM 0 HD12 ILE B 229 -1.205 12.235 -0.142 1.00 30.42 H new ATOM 0 HD13 ILE B 229 -1.321 13.006 1.457 1.00 30.42 H new ATOM 2053 N SER B 230 -0.258 17.028 -2.586 1.00 62.32 N ATOM 2054 CA SER B 230 -0.815 17.313 -3.901 1.00 3.41 C ATOM 2055 C SER B 230 -1.787 16.239 -4.435 1.00 43.52 C ATOM 2056 O SER B 230 -2.961 16.277 -4.130 1.00 60.25 O ATOM 2057 CB SER B 230 0.260 17.715 -4.915 1.00 34.51 C ATOM 2058 OG SER B 230 0.923 18.902 -4.496 1.00 25.10 O ATOM 0 H SER B 230 -0.385 17.797 -1.928 1.00 62.32 H new ATOM 0 HA SER B 230 -1.448 18.188 -3.755 1.00 3.41 H new ATOM 0 HB2 SER B 230 0.984 16.907 -5.026 1.00 34.51 H new ATOM 0 HB3 SER B 230 -0.195 17.872 -5.893 1.00 34.51 H new ATOM 0 HG SER B 230 0.726 19.071 -3.551 1.00 25.10 H new ATOM 2064 N ASN B 231 -1.304 15.304 -5.226 1.00 12.03 N ATOM 2065 CA ASN B 231 -2.173 14.254 -5.776 1.00 60.12 C ATOM 2066 C ASN B 231 -1.696 12.892 -5.334 1.00 23.03 C ATOM 2067 O ASN B 231 -2.277 11.868 -5.697 1.00 40.35 O ATOM 2068 CB ASN B 231 -2.202 14.314 -7.315 1.00 12.44 C ATOM 2069 CG ASN B 231 -0.857 13.977 -7.949 1.00 61.25 C ATOM 2070 OD1 ASN B 231 -0.010 14.852 -8.125 1.00 60.12 O ATOM 2071 ND2 ASN B 231 -0.670 12.737 -8.335 1.00 71.02 N ATOM 0 H ASN B 231 -0.326 15.239 -5.508 1.00 12.03 H new ATOM 0 HA ASN B 231 -3.182 14.423 -5.399 1.00 60.12 H new ATOM 0 HB2 ASN B 231 -2.957 13.620 -7.686 1.00 12.44 H new ATOM 0 HB3 ASN B 231 -2.505 15.313 -7.629 1.00 12.44 H new ATOM 0 HD21 ASN B 231 0.200 12.472 -8.797 1.00 71.02 H new ATOM 0 HD22 ASN B 231 -1.394 12.038 -8.173 1.00 71.02 H new ATOM 2078 N TYR B 232 -0.651 12.873 -4.544 1.00 43.15 N ATOM 2079 CA TYR B 232 -0.030 11.633 -4.180 1.00 22.32 C ATOM 2080 C TYR B 232 -0.740 10.991 -3.000 1.00 73.03 C ATOM 2081 O TYR B 232 -0.353 11.164 -1.850 1.00 35.55 O ATOM 2082 CB TYR B 232 1.472 11.832 -3.923 1.00 42.40 C ATOM 2083 CG TYR B 232 2.190 12.457 -5.113 1.00 4.23 C ATOM 2084 CD1 TYR B 232 2.552 11.693 -6.204 1.00 70.51 C ATOM 2085 CD2 TYR B 232 2.475 13.821 -5.149 1.00 74.14 C ATOM 2086 CE1 TYR B 232 3.180 12.253 -7.295 1.00 54.02 C ATOM 2087 CE2 TYR B 232 3.097 14.392 -6.243 1.00 22.54 C ATOM 2088 CZ TYR B 232 3.447 13.599 -7.313 1.00 63.41 C ATOM 2089 OH TYR B 232 4.060 14.156 -8.415 1.00 1.34 O ATOM 0 H TYR B 232 -0.216 13.704 -4.143 1.00 43.15 H new ATOM 0 HA TYR B 232 -0.123 10.940 -5.016 1.00 22.32 H new ATOM 0 HB2 TYR B 232 1.606 12.467 -3.047 1.00 42.40 H new ATOM 0 HB3 TYR B 232 1.928 10.870 -3.692 1.00 42.40 H new ATOM 0 HD1 TYR B 232 2.339 10.634 -6.202 1.00 70.51 H new ATOM 0 HD2 TYR B 232 2.205 14.442 -4.308 1.00 74.14 H new ATOM 0 HE1 TYR B 232 3.462 11.634 -8.134 1.00 54.02 H new ATOM 0 HE2 TYR B 232 3.307 15.451 -6.259 1.00 22.54 H new ATOM 0 HH TYR B 232 4.178 15.118 -8.272 1.00 1.34 H new ATOM 2099 N LEU B 233 -1.799 10.268 -3.317 1.00 10.54 N ATOM 2100 CA LEU B 233 -2.646 9.644 -2.334 1.00 42.35 C ATOM 2101 C LEU B 233 -3.117 8.266 -2.812 1.00 52.12 C ATOM 2102 O LEU B 233 -3.526 8.118 -3.968 1.00 73.43 O ATOM 2103 CB LEU B 233 -3.872 10.524 -2.151 1.00 31.35 C ATOM 2104 CG LEU B 233 -4.905 10.041 -1.157 1.00 20.12 C ATOM 2105 CD1 LEU B 233 -4.376 10.098 0.247 1.00 11.04 C ATOM 2106 CD2 LEU B 233 -6.174 10.822 -1.286 1.00 75.33 C ATOM 0 H LEU B 233 -2.093 10.100 -4.279 1.00 10.54 H new ATOM 0 HA LEU B 233 -2.088 9.524 -1.405 1.00 42.35 H new ATOM 0 HB2 LEU B 233 -3.538 11.515 -1.843 1.00 31.35 H new ATOM 0 HB3 LEU B 233 -4.358 10.639 -3.120 1.00 31.35 H new ATOM 0 HG LEU B 233 -5.126 8.998 -1.384 1.00 20.12 H new ATOM 0 HD11 LEU B 233 -5.141 9.745 0.939 1.00 11.04 H new ATOM 0 HD12 LEU B 233 -3.492 9.465 0.329 1.00 11.04 H new ATOM 0 HD13 LEU B 233 -4.110 11.126 0.494 1.00 11.04 H new ATOM 0 HD21 LEU B 233 -6.901 10.457 -0.561 1.00 75.33 H new ATOM 0 HD22 LEU B 233 -5.973 11.877 -1.098 1.00 75.33 H new ATOM 0 HD23 LEU B 233 -6.574 10.703 -2.293 1.00 75.33 H new ATOM 2118 N ASN B 234 -3.041 7.262 -1.945 1.00 45.21 N ATOM 2119 CA ASN B 234 -3.625 5.945 -2.232 1.00 32.31 C ATOM 2120 C ASN B 234 -4.761 5.665 -1.275 1.00 33.34 C ATOM 2121 O ASN B 234 -4.779 6.179 -0.149 1.00 40.42 O ATOM 2122 CB ASN B 234 -2.604 4.780 -2.150 1.00 43.32 C ATOM 2123 CG ASN B 234 -1.618 4.697 -3.290 1.00 53.21 C ATOM 2124 OD1 ASN B 234 -1.293 5.791 -3.857 1.00 4.50 O flip ATOM 2125 ND2 ASN B 234 -1.160 3.629 -3.649 1.00 62.23 N flip ATOM 0 H ASN B 234 -2.582 7.329 -1.037 1.00 45.21 H new ATOM 0 HA ASN B 234 -3.980 5.991 -3.261 1.00 32.31 H new ATOM 0 HB2 ASN B 234 -2.047 4.873 -1.218 1.00 43.32 H new ATOM 0 HB3 ASN B 234 -3.155 3.841 -2.100 1.00 43.32 H new ATOM 0 HD21 ASN B 234 -1.439 2.770 -3.176 1.00 62.23 H new ATOM 0 HD22 ASN B 234 -0.497 3.593 -4.423 1.00 62.23 H new ATOM 2132 N TRP B 235 -5.710 4.880 -1.718 1.00 12.12 N ATOM 2133 CA TRP B 235 -6.824 4.464 -0.888 1.00 11.51 C ATOM 2134 C TRP B 235 -6.838 2.972 -0.781 1.00 33.21 C ATOM 2135 O TRP B 235 -6.767 2.302 -1.779 1.00 74.40 O ATOM 2136 CB TRP B 235 -8.159 4.948 -1.463 1.00 72.33 C ATOM 2137 CG TRP B 235 -8.370 6.410 -1.324 1.00 41.11 C ATOM 2138 CD1 TRP B 235 -8.125 7.393 -2.251 1.00 2.45 C ATOM 2139 CD2 TRP B 235 -8.888 7.058 -0.160 1.00 10.41 C ATOM 2140 NE1 TRP B 235 -8.454 8.616 -1.712 1.00 14.14 N ATOM 2141 CE2 TRP B 235 -8.922 8.432 -0.425 1.00 32.02 C ATOM 2142 CE3 TRP B 235 -9.325 6.590 1.091 1.00 34.43 C ATOM 2143 CZ2 TRP B 235 -9.379 9.360 0.520 1.00 65.32 C ATOM 2144 CZ3 TRP B 235 -9.781 7.495 2.026 1.00 23.35 C ATOM 2145 CH2 TRP B 235 -9.806 8.871 1.738 1.00 21.32 C ATOM 0 H TRP B 235 -5.737 4.507 -2.667 1.00 12.12 H new ATOM 0 HA TRP B 235 -6.697 4.909 0.099 1.00 11.51 H new ATOM 0 HB2 TRP B 235 -8.209 4.681 -2.519 1.00 72.33 H new ATOM 0 HB3 TRP B 235 -8.972 4.423 -0.963 1.00 72.33 H new ATOM 0 HD1 TRP B 235 -7.736 7.232 -3.245 1.00 2.45 H new ATOM 0 HE1 TRP B 235 -8.366 9.515 -2.187 1.00 14.14 H new ATOM 0 HE3 TRP B 235 -9.304 5.534 1.317 1.00 34.43 H new ATOM 0 HZ2 TRP B 235 -9.396 10.418 0.304 1.00 65.32 H new ATOM 0 HZ3 TRP B 235 -10.122 7.144 2.989 1.00 23.35 H new ATOM 0 HH2 TRP B 235 -10.167 9.561 2.486 1.00 21.32 H new ATOM 2156 N TYR B 236 -6.941 2.458 0.420 1.00 12.15 N ATOM 2157 CA TYR B 236 -6.943 1.012 0.640 1.00 5.14 C ATOM 2158 C TYR B 236 -8.193 0.533 1.359 1.00 71.12 C ATOM 2159 O TYR B 236 -8.751 1.247 2.215 1.00 30.54 O ATOM 2160 CB TYR B 236 -5.728 0.564 1.459 1.00 42.02 C ATOM 2161 CG TYR B 236 -4.391 0.682 0.780 1.00 64.22 C ATOM 2162 CD1 TYR B 236 -3.819 1.912 0.533 1.00 74.22 C ATOM 2163 CD2 TYR B 236 -3.683 -0.451 0.413 1.00 52.31 C ATOM 2164 CE1 TYR B 236 -2.590 2.015 -0.054 1.00 50.35 C ATOM 2165 CE2 TYR B 236 -2.446 -0.351 -0.182 1.00 0.14 C ATOM 2166 CZ TYR B 236 -1.905 0.898 -0.409 1.00 2.42 C ATOM 2167 OH TYR B 236 -0.676 1.024 -0.994 1.00 45.53 O ATOM 0 H TYR B 236 -7.025 3.013 1.271 1.00 12.15 H new ATOM 0 HA TYR B 236 -6.910 0.570 -0.356 1.00 5.14 H new ATOM 0 HB2 TYR B 236 -5.699 1.150 2.378 1.00 42.02 H new ATOM 0 HB3 TYR B 236 -5.875 -0.476 1.749 1.00 42.02 H new ATOM 0 HD1 TYR B 236 -4.352 2.810 0.809 1.00 74.22 H new ATOM 0 HD2 TYR B 236 -4.108 -1.427 0.596 1.00 52.31 H new ATOM 0 HE1 TYR B 236 -2.161 2.989 -0.237 1.00 50.35 H new ATOM 0 HE2 TYR B 236 -1.905 -1.241 -0.468 1.00 0.14 H new ATOM 0 HH TYR B 236 0.017 1.035 -0.301 1.00 45.53 H new ATOM 2177 N GLN B 237 -8.594 -0.690 1.038 1.00 53.13 N ATOM 2178 CA GLN B 237 -9.720 -1.365 1.664 1.00 32.14 C ATOM 2179 C GLN B 237 -9.188 -2.571 2.429 1.00 52.42 C ATOM 2180 O GLN B 237 -8.573 -3.462 1.848 1.00 2.43 O ATOM 2181 CB GLN B 237 -10.730 -1.827 0.585 1.00 13.01 C ATOM 2182 CG GLN B 237 -11.883 -2.680 1.092 1.00 50.22 C ATOM 2183 CD GLN B 237 -12.817 -3.155 -0.028 1.00 3.41 C ATOM 2184 OE1 GLN B 237 -13.397 -4.234 0.052 1.00 33.43 O ATOM 2185 NE2 GLN B 237 -12.986 -2.360 -1.056 1.00 5.05 N ATOM 0 H GLN B 237 -8.135 -1.251 0.320 1.00 53.13 H new ATOM 0 HA GLN B 237 -10.232 -0.685 2.344 1.00 32.14 H new ATOM 0 HB2 GLN B 237 -11.141 -0.944 0.095 1.00 13.01 H new ATOM 0 HB3 GLN B 237 -10.190 -2.391 -0.176 1.00 13.01 H new ATOM 0 HG2 GLN B 237 -11.482 -3.548 1.616 1.00 50.22 H new ATOM 0 HG3 GLN B 237 -12.459 -2.107 1.819 1.00 50.22 H new ATOM 0 HE21 GLN B 237 -12.492 -1.469 -1.098 1.00 5.05 H new ATOM 0 HE22 GLN B 237 -13.612 -2.633 -1.814 1.00 5.05 H new ATOM 2194 N GLN B 238 -9.395 -2.570 3.722 1.00 3.22 N ATOM 2195 CA GLN B 238 -8.919 -3.640 4.584 1.00 1.40 C ATOM 2196 C GLN B 238 -10.145 -4.329 5.149 1.00 14.41 C ATOM 2197 O GLN B 238 -10.904 -3.721 5.909 1.00 44.41 O ATOM 2198 CB GLN B 238 -8.056 -3.018 5.710 1.00 40.31 C ATOM 2199 CG GLN B 238 -7.202 -3.964 6.598 1.00 71.34 C ATOM 2200 CD GLN B 238 -7.982 -4.986 7.407 1.00 13.24 C ATOM 2201 OE1 GLN B 238 -8.421 -4.701 8.509 1.00 52.14 O ATOM 2202 NE2 GLN B 238 -8.086 -6.191 6.904 1.00 5.21 N ATOM 0 H GLN B 238 -9.897 -1.831 4.213 1.00 3.22 H new ATOM 0 HA GLN B 238 -8.305 -4.363 4.047 1.00 1.40 H new ATOM 0 HB2 GLN B 238 -7.381 -2.296 5.250 1.00 40.31 H new ATOM 0 HB3 GLN B 238 -8.722 -2.458 6.367 1.00 40.31 H new ATOM 0 HG2 GLN B 238 -6.497 -4.495 5.959 1.00 71.34 H new ATOM 0 HG3 GLN B 238 -6.614 -3.356 7.285 1.00 71.34 H new ATOM 0 HE21 GLN B 238 -7.707 -6.392 5.979 1.00 5.21 H new ATOM 0 HE22 GLN B 238 -8.546 -6.928 7.438 1.00 5.21 H new ATOM 2211 N LYS B 239 -10.354 -5.560 4.752 1.00 22.00 N ATOM 2212 CA LYS B 239 -11.502 -6.317 5.180 1.00 61.10 C ATOM 2213 C LYS B 239 -11.092 -7.506 6.023 1.00 24.31 C ATOM 2214 O LYS B 239 -10.001 -8.052 5.833 1.00 61.51 O ATOM 2215 CB LYS B 239 -12.330 -6.784 3.998 1.00 14.32 C ATOM 2216 CG LYS B 239 -11.582 -7.645 3.021 1.00 21.21 C ATOM 2217 CD LYS B 239 -12.493 -8.177 1.950 1.00 72.13 C ATOM 2218 CE LYS B 239 -13.267 -7.042 1.278 1.00 32.41 C ATOM 2219 NZ LYS B 239 -14.049 -7.472 0.099 1.00 23.11 N ATOM 0 H LYS B 239 -9.731 -6.065 4.122 1.00 22.00 H new ATOM 0 HA LYS B 239 -12.114 -5.652 5.789 1.00 61.10 H new ATOM 0 HB2 LYS B 239 -13.191 -7.340 4.369 1.00 14.32 H new ATOM 0 HB3 LYS B 239 -12.717 -5.911 3.473 1.00 14.32 H new ATOM 0 HG2 LYS B 239 -10.779 -7.066 2.564 1.00 21.21 H new ATOM 0 HG3 LYS B 239 -11.115 -8.476 3.549 1.00 21.21 H new ATOM 0 HD2 LYS B 239 -11.908 -8.715 1.204 1.00 72.13 H new ATOM 0 HD3 LYS B 239 -13.192 -8.892 2.384 1.00 72.13 H new ATOM 0 HE2 LYS B 239 -13.942 -6.593 2.007 1.00 32.41 H new ATOM 0 HE3 LYS B 239 -12.565 -6.266 0.974 1.00 32.41 H new ATOM 0 HZ1 LYS B 239 -14.975 -6.999 0.105 1.00 23.11 H new ATOM 0 HZ2 LYS B 239 -13.536 -7.218 -0.769 1.00 23.11 H new ATOM 0 HZ3 LYS B 239 -14.186 -8.502 0.131 1.00 23.11 H new ATOM 2276 N ALA B 243 -6.081 -8.860 3.142 1.00 11.52 N ATOM 2277 CA ALA B 243 -5.064 -7.846 3.161 1.00 52.13 C ATOM 2278 C ALA B 243 -5.617 -6.594 2.501 1.00 45.40 C ATOM 2279 O ALA B 243 -6.503 -6.690 1.639 1.00 25.44 O ATOM 2280 CB ALA B 243 -3.811 -8.342 2.446 1.00 33.30 C ATOM 0 HA ALA B 243 -4.783 -7.614 4.188 1.00 52.13 H new ATOM 0 HB1 ALA B 243 -3.048 -7.564 2.467 1.00 33.30 H new ATOM 0 HB2 ALA B 243 -3.435 -9.233 2.948 1.00 33.30 H new ATOM 0 HB3 ALA B 243 -4.054 -8.583 1.411 1.00 33.30 H new ATOM 2286 N PRO B 244 -5.160 -5.403 2.904 1.00 42.11 N ATOM 2287 CA PRO B 244 -5.651 -4.178 2.320 1.00 22.43 C ATOM 2288 C PRO B 244 -5.144 -3.973 0.893 1.00 13.14 C ATOM 2289 O PRO B 244 -3.942 -3.830 0.655 1.00 73.52 O ATOM 2290 CB PRO B 244 -5.107 -3.084 3.256 1.00 42.25 C ATOM 2291 CG PRO B 244 -3.894 -3.685 3.882 1.00 22.32 C ATOM 2292 CD PRO B 244 -4.143 -5.166 3.950 1.00 63.54 C ATOM 0 HA PRO B 244 -6.738 -4.174 2.236 1.00 22.43 H new ATOM 0 HB2 PRO B 244 -4.859 -2.178 2.703 1.00 42.25 H new ATOM 0 HB3 PRO B 244 -5.844 -2.806 4.009 1.00 42.25 H new ATOM 0 HG2 PRO B 244 -3.004 -3.467 3.292 1.00 22.32 H new ATOM 0 HG3 PRO B 244 -3.726 -3.273 4.877 1.00 22.32 H new ATOM 0 HD2 PRO B 244 -3.232 -5.734 3.758 1.00 63.54 H new ATOM 0 HD3 PRO B 244 -4.504 -5.466 4.934 1.00 63.54 H new ATOM 2300 N LYS B 245 -6.055 -3.964 -0.040 1.00 51.11 N ATOM 2301 CA LYS B 245 -5.724 -3.701 -1.413 1.00 75.34 C ATOM 2302 C LYS B 245 -6.154 -2.315 -1.725 1.00 53.22 C ATOM 2303 O LYS B 245 -7.225 -1.871 -1.271 1.00 62.11 O ATOM 2304 CB LYS B 245 -6.351 -4.691 -2.419 1.00 14.43 C ATOM 2305 CG LYS B 245 -5.905 -4.396 -3.867 1.00 1.54 C ATOM 2306 CD LYS B 245 -6.508 -5.329 -4.909 1.00 62.12 C ATOM 2307 CE LYS B 245 -6.048 -4.912 -6.318 1.00 12.52 C ATOM 2308 NZ LYS B 245 -6.612 -5.767 -7.391 1.00 11.32 N ATOM 0 H LYS B 245 -7.046 -4.138 0.129 1.00 51.11 H new ATOM 0 HA LYS B 245 -4.647 -3.829 -1.522 1.00 75.34 H new ATOM 0 HB2 LYS B 245 -6.068 -5.709 -2.152 1.00 14.43 H new ATOM 0 HB3 LYS B 245 -7.438 -4.635 -2.355 1.00 14.43 H new ATOM 0 HG2 LYS B 245 -6.174 -3.369 -4.116 1.00 1.54 H new ATOM 0 HG3 LYS B 245 -4.818 -4.463 -3.921 1.00 1.54 H new ATOM 0 HD2 LYS B 245 -6.205 -6.357 -4.708 1.00 62.12 H new ATOM 0 HD3 LYS B 245 -7.596 -5.300 -4.849 1.00 62.12 H new ATOM 0 HE2 LYS B 245 -6.338 -3.877 -6.497 1.00 12.52 H new ATOM 0 HE3 LYS B 245 -4.960 -4.951 -6.365 1.00 12.52 H new ATOM 0 HZ1 LYS B 245 -6.653 -5.228 -8.279 1.00 11.32 H new ATOM 0 HZ2 LYS B 245 -6.008 -6.604 -7.522 1.00 11.32 H new ATOM 0 HZ3 LYS B 245 -7.571 -6.070 -7.126 1.00 11.32 H new ATOM 2322 N LEU B 246 -5.330 -1.606 -2.418 1.00 1.10 N ATOM 2323 CA LEU B 246 -5.640 -0.273 -2.727 1.00 21.41 C ATOM 2324 C LEU B 246 -6.628 -0.202 -3.876 1.00 24.03 C ATOM 2325 O LEU B 246 -6.591 -1.016 -4.798 1.00 5.02 O ATOM 2326 CB LEU B 246 -4.360 0.549 -2.946 1.00 40.01 C ATOM 2327 CG LEU B 246 -3.558 0.303 -4.200 1.00 72.15 C ATOM 2328 CD1 LEU B 246 -4.125 1.109 -5.311 1.00 54.44 C ATOM 2329 CD2 LEU B 246 -2.110 0.619 -3.973 1.00 4.21 C ATOM 0 H LEU B 246 -4.435 -1.939 -2.778 1.00 1.10 H new ATOM 0 HA LEU B 246 -6.143 0.188 -1.877 1.00 21.41 H new ATOM 0 HB2 LEU B 246 -4.635 1.604 -2.929 1.00 40.01 H new ATOM 0 HB3 LEU B 246 -3.704 0.377 -2.093 1.00 40.01 H new ATOM 0 HG LEU B 246 -3.618 -0.751 -4.470 1.00 72.15 H new ATOM 0 HD11 LEU B 246 -3.548 0.934 -6.219 1.00 54.44 H new ATOM 0 HD12 LEU B 246 -5.162 0.819 -5.479 1.00 54.44 H new ATOM 0 HD13 LEU B 246 -4.082 2.167 -5.052 1.00 54.44 H new ATOM 0 HD21 LEU B 246 -1.549 0.435 -4.889 1.00 4.21 H new ATOM 0 HD22 LEU B 246 -2.006 1.666 -3.688 1.00 4.21 H new ATOM 0 HD23 LEU B 246 -1.720 -0.014 -3.176 1.00 4.21 H new ATOM 2341 N LEU B 247 -7.518 0.733 -3.777 1.00 15.24 N ATOM 2342 CA LEU B 247 -8.528 0.958 -4.770 1.00 2.40 C ATOM 2343 C LEU B 247 -8.019 1.996 -5.718 1.00 52.50 C ATOM 2344 O LEU B 247 -8.255 1.950 -6.919 1.00 31.04 O ATOM 2345 CB LEU B 247 -9.835 1.504 -4.130 1.00 53.11 C ATOM 2346 CG LEU B 247 -10.522 0.671 -3.041 1.00 5.23 C ATOM 2347 CD1 LEU B 247 -10.758 -0.763 -3.474 1.00 34.44 C ATOM 2348 CD2 LEU B 247 -9.779 0.754 -1.734 1.00 10.14 C ATOM 0 H LEU B 247 -7.567 1.377 -2.988 1.00 15.24 H new ATOM 0 HA LEU B 247 -8.745 0.014 -5.269 1.00 2.40 H new ATOM 0 HB2 LEU B 247 -9.612 2.483 -3.707 1.00 53.11 H new ATOM 0 HB3 LEU B 247 -10.556 1.660 -4.932 1.00 53.11 H new ATOM 0 HG LEU B 247 -11.508 1.107 -2.881 1.00 5.23 H new ATOM 0 HD11 LEU B 247 -11.247 -1.311 -2.668 1.00 34.44 H new ATOM 0 HD12 LEU B 247 -11.394 -0.776 -4.359 1.00 34.44 H new ATOM 0 HD13 LEU B 247 -9.803 -1.235 -3.706 1.00 34.44 H new ATOM 0 HD21 LEU B 247 -10.293 0.152 -0.984 1.00 10.14 H new ATOM 0 HD22 LEU B 247 -8.765 0.378 -1.868 1.00 10.14 H new ATOM 0 HD23 LEU B 247 -9.741 1.792 -1.402 1.00 10.14 H new ATOM 2360 N ILE B 248 -7.291 2.925 -5.157 1.00 42.20 N ATOM 2361 CA ILE B 248 -6.813 4.071 -5.861 1.00 42.12 C ATOM 2362 C ILE B 248 -5.362 4.274 -5.521 1.00 52.41 C ATOM 2363 O ILE B 248 -4.975 4.099 -4.372 1.00 74.25 O ATOM 2364 CB ILE B 248 -7.637 5.314 -5.447 1.00 41.13 C ATOM 2365 CG1 ILE B 248 -9.111 5.089 -5.800 1.00 43.14 C ATOM 2366 CG2 ILE B 248 -7.102 6.569 -6.105 1.00 43.54 C ATOM 2367 CD1 ILE B 248 -10.033 6.195 -5.420 1.00 42.52 C ATOM 0 H ILE B 248 -7.011 2.900 -4.176 1.00 42.20 H new ATOM 0 HA ILE B 248 -6.919 3.924 -6.936 1.00 42.12 H new ATOM 0 HB ILE B 248 -7.549 5.454 -4.370 1.00 41.13 H new ATOM 0 HG12 ILE B 248 -9.189 4.926 -6.875 1.00 43.14 H new ATOM 0 HG13 ILE B 248 -9.448 4.174 -5.314 1.00 43.14 H new ATOM 0 HG21 ILE B 248 -7.701 7.426 -5.795 1.00 43.54 H new ATOM 0 HG22 ILE B 248 -6.065 6.723 -5.805 1.00 43.54 H new ATOM 0 HG23 ILE B 248 -7.154 6.462 -7.189 1.00 43.54 H new ATOM 0 HD11 ILE B 248 -11.051 5.937 -5.713 1.00 42.52 H new ATOM 0 HD12 ILE B 248 -9.994 6.347 -4.341 1.00 42.52 H new ATOM 0 HD13 ILE B 248 -9.731 7.111 -5.927 1.00 42.52 H new ATOM 2379 N TYR B 249 -4.579 4.656 -6.504 1.00 34.10 N ATOM 2380 CA TYR B 249 -3.133 4.807 -6.327 1.00 2.32 C ATOM 2381 C TYR B 249 -2.642 6.201 -6.680 1.00 65.14 C ATOM 2382 O TYR B 249 -1.466 6.493 -6.554 1.00 12.14 O ATOM 2383 CB TYR B 249 -2.360 3.757 -7.147 1.00 31.43 C ATOM 2384 CG TYR B 249 -2.674 3.781 -8.627 1.00 0.53 C ATOM 2385 CD1 TYR B 249 -2.130 4.747 -9.463 1.00 54.04 C ATOM 2386 CD2 TYR B 249 -3.524 2.851 -9.179 1.00 24.41 C ATOM 2387 CE1 TYR B 249 -2.427 4.778 -10.801 1.00 53.12 C ATOM 2388 CE2 TYR B 249 -3.826 2.877 -10.521 1.00 21.41 C ATOM 2389 CZ TYR B 249 -3.279 3.840 -11.324 1.00 54.31 C ATOM 2390 OH TYR B 249 -3.588 3.864 -12.665 1.00 0.21 O ATOM 0 H TYR B 249 -4.912 4.872 -7.444 1.00 34.10 H new ATOM 0 HA TYR B 249 -2.939 4.648 -5.266 1.00 2.32 H new ATOM 0 HB2 TYR B 249 -1.291 3.919 -7.010 1.00 31.43 H new ATOM 0 HB3 TYR B 249 -2.585 2.766 -6.754 1.00 31.43 H new ATOM 0 HD1 TYR B 249 -1.460 5.488 -9.052 1.00 54.04 H new ATOM 0 HD2 TYR B 249 -3.961 2.089 -8.550 1.00 24.41 H new ATOM 0 HE1 TYR B 249 -1.993 5.535 -11.438 1.00 53.12 H new ATOM 0 HE2 TYR B 249 -4.494 2.139 -10.940 1.00 21.41 H new ATOM 0 HH TYR B 249 -4.204 3.130 -12.872 1.00 0.21 H new ATOM 2400 N ASP B 250 -3.519 7.039 -7.146 1.00 60.24 N ATOM 2401 CA ASP B 250 -3.133 8.395 -7.492 1.00 54.25 C ATOM 2402 C ASP B 250 -4.355 9.269 -7.388 1.00 14.12 C ATOM 2403 O ASP B 250 -4.991 9.555 -8.399 1.00 61.34 O ATOM 2404 CB ASP B 250 -2.575 8.449 -8.930 1.00 64.33 C ATOM 2405 CG ASP B 250 -1.870 9.747 -9.302 1.00 45.52 C ATOM 2406 OD1 ASP B 250 -2.511 10.814 -9.343 1.00 34.53 O ATOM 2407 OD2 ASP B 250 -0.648 9.694 -9.598 1.00 71.14 O ATOM 0 H ASP B 250 -4.503 6.820 -7.299 1.00 60.24 H new ATOM 0 HA ASP B 250 -2.354 8.742 -6.813 1.00 54.25 H new ATOM 0 HB2 ASP B 250 -1.876 7.623 -9.063 1.00 64.33 H new ATOM 0 HB3 ASP B 250 -3.396 8.287 -9.628 1.00 64.33 H new ATOM 2412 N ALA B 251 -4.754 9.548 -6.139 1.00 30.41 N ATOM 2413 CA ALA B 251 -5.921 10.405 -5.764 1.00 62.42 C ATOM 2414 C ALA B 251 -7.280 9.904 -6.301 1.00 51.41 C ATOM 2415 O ALA B 251 -8.176 9.583 -5.521 1.00 32.31 O ATOM 2416 CB ALA B 251 -5.699 11.868 -6.116 1.00 30.42 C ATOM 0 H ALA B 251 -4.266 9.177 -5.324 1.00 30.41 H new ATOM 0 HA ALA B 251 -5.982 10.321 -4.679 1.00 62.42 H new ATOM 0 HB1 ALA B 251 -6.574 12.449 -5.824 1.00 30.42 H new ATOM 0 HB2 ALA B 251 -4.822 12.241 -5.586 1.00 30.42 H new ATOM 0 HB3 ALA B 251 -5.541 11.964 -7.190 1.00 30.42 H new ATOM 2422 N SER B 252 -7.419 9.840 -7.604 1.00 30.53 N ATOM 2423 CA SER B 252 -8.647 9.425 -8.241 1.00 54.15 C ATOM 2424 C SER B 252 -8.452 8.164 -9.110 1.00 13.44 C ATOM 2425 O SER B 252 -9.412 7.465 -9.414 1.00 53.35 O ATOM 2426 CB SER B 252 -9.163 10.574 -9.098 1.00 12.11 C ATOM 2427 OG SER B 252 -8.170 10.979 -10.035 1.00 70.05 O ATOM 0 H SER B 252 -6.674 10.077 -8.259 1.00 30.53 H new ATOM 0 HA SER B 252 -9.370 9.170 -7.466 1.00 54.15 H new ATOM 0 HB2 SER B 252 -10.066 10.266 -9.625 1.00 12.11 H new ATOM 0 HB3 SER B 252 -9.437 11.416 -8.462 1.00 12.11 H new ATOM 0 HG SER B 252 -8.516 11.717 -10.580 1.00 70.05 H new ATOM 2433 N ASN B 253 -7.207 7.878 -9.478 1.00 32.11 N ATOM 2434 CA ASN B 253 -6.887 6.780 -10.412 1.00 2.55 C ATOM 2435 C ASN B 253 -7.057 5.394 -9.775 1.00 20.03 C ATOM 2436 O ASN B 253 -6.335 5.043 -8.829 1.00 12.55 O ATOM 2437 CB ASN B 253 -5.456 6.935 -10.965 1.00 13.24 C ATOM 2438 CG ASN B 253 -5.242 8.201 -11.800 1.00 22.53 C ATOM 2439 OD1 ASN B 253 -5.418 8.195 -13.014 1.00 30.32 O ATOM 2440 ND2 ASN B 253 -4.870 9.289 -11.167 1.00 11.22 N ATOM 0 H ASN B 253 -6.390 8.391 -9.146 1.00 32.11 H new ATOM 0 HA ASN B 253 -7.602 6.850 -11.232 1.00 2.55 H new ATOM 0 HB2 ASN B 253 -4.754 6.940 -10.131 1.00 13.24 H new ATOM 0 HB3 ASN B 253 -5.218 6.065 -11.577 1.00 13.24 H new ATOM 0 HD21 ASN B 253 -4.721 10.155 -11.685 1.00 11.22 H new ATOM 0 HD22 ASN B 253 -4.730 9.269 -10.157 1.00 11.22 H new ATOM 2447 N LEU B 254 -7.998 4.613 -10.317 1.00 11.25 N ATOM 2448 CA LEU B 254 -8.318 3.249 -9.832 1.00 12.22 C ATOM 2449 C LEU B 254 -7.264 2.236 -10.234 1.00 54.01 C ATOM 2450 O LEU B 254 -6.723 2.289 -11.348 1.00 54.41 O ATOM 2451 CB LEU B 254 -9.698 2.747 -10.351 1.00 62.12 C ATOM 2452 CG LEU B 254 -10.983 3.375 -9.781 1.00 53.32 C ATOM 2453 CD1 LEU B 254 -11.108 3.141 -8.300 1.00 52.04 C ATOM 2454 CD2 LEU B 254 -11.090 4.836 -10.101 1.00 30.24 C ATOM 0 H LEU B 254 -8.568 4.904 -11.111 1.00 11.25 H new ATOM 0 HA LEU B 254 -8.347 3.332 -8.746 1.00 12.22 H new ATOM 0 HB2 LEU B 254 -9.714 2.888 -11.432 1.00 62.12 H new ATOM 0 HB3 LEU B 254 -9.747 1.673 -10.169 1.00 62.12 H new ATOM 0 HG LEU B 254 -11.816 2.872 -10.272 1.00 53.32 H new ATOM 0 HD11 LEU B 254 -12.027 3.599 -7.936 1.00 52.04 H new ATOM 0 HD12 LEU B 254 -11.133 2.069 -8.102 1.00 52.04 H new ATOM 0 HD13 LEU B 254 -10.254 3.584 -7.788 1.00 52.04 H new ATOM 0 HD21 LEU B 254 -12.012 5.234 -9.678 1.00 30.24 H new ATOM 0 HD22 LEU B 254 -10.237 5.365 -9.675 1.00 30.24 H new ATOM 0 HD23 LEU B 254 -11.098 4.972 -11.182 1.00 30.24 H new ATOM 2466 N GLU B 255 -7.000 1.309 -9.335 1.00 74.14 N ATOM 2467 CA GLU B 255 -6.034 0.227 -9.559 1.00 34.24 C ATOM 2468 C GLU B 255 -6.729 -0.891 -10.369 1.00 53.33 C ATOM 2469 O GLU B 255 -7.969 -0.945 -10.439 1.00 60.41 O ATOM 2470 CB GLU B 255 -5.525 -0.306 -8.199 1.00 72.23 C ATOM 2471 CG GLU B 255 -4.068 -0.855 -8.164 1.00 74.51 C ATOM 2472 CD GLU B 255 -3.784 -2.028 -9.063 1.00 74.25 C ATOM 2473 OE1 GLU B 255 -3.965 -3.175 -8.632 1.00 73.51 O ATOM 2474 OE2 GLU B 255 -3.371 -1.809 -10.236 1.00 62.00 O ATOM 0 H GLU B 255 -7.447 1.276 -8.419 1.00 74.14 H new ATOM 0 HA GLU B 255 -5.174 0.592 -10.120 1.00 34.24 H new ATOM 0 HB2 GLU B 255 -5.603 0.498 -7.468 1.00 72.23 H new ATOM 0 HB3 GLU B 255 -6.196 -1.100 -7.872 1.00 72.23 H new ATOM 0 HG2 GLU B 255 -3.389 -0.045 -8.431 1.00 74.51 H new ATOM 0 HG3 GLU B 255 -3.834 -1.143 -7.139 1.00 74.51 H new ATOM 2481 N THR B 256 -5.951 -1.725 -10.988 1.00 22.43 N ATOM 2482 CA THR B 256 -6.418 -2.807 -11.814 1.00 4.14 C ATOM 2483 C THR B 256 -7.272 -3.812 -10.996 1.00 20.44 C ATOM 2484 O THR B 256 -6.821 -4.375 -9.981 1.00 74.02 O ATOM 2485 CB THR B 256 -5.206 -3.533 -12.411 1.00 73.00 C ATOM 2486 OG1 THR B 256 -4.318 -2.555 -12.991 1.00 53.11 O ATOM 2487 CG2 THR B 256 -5.637 -4.511 -13.490 1.00 62.45 C ATOM 0 H THR B 256 -4.934 -1.673 -10.933 1.00 22.43 H new ATOM 0 HA THR B 256 -7.045 -2.397 -12.605 1.00 4.14 H new ATOM 0 HB THR B 256 -4.704 -4.089 -11.619 1.00 73.00 H new ATOM 0 HG1 THR B 256 -3.712 -2.213 -12.301 1.00 53.11 H new ATOM 0 HG21 THR B 256 -4.760 -5.013 -13.898 1.00 62.45 H new ATOM 0 HG22 THR B 256 -6.312 -5.251 -13.061 1.00 62.45 H new ATOM 0 HG23 THR B 256 -6.149 -3.971 -14.287 1.00 62.45 H new ATOM 2495 N GLY B 257 -8.499 -4.004 -11.433 1.00 61.11 N ATOM 2496 CA GLY B 257 -9.383 -4.924 -10.773 1.00 2.31 C ATOM 2497 C GLY B 257 -10.319 -4.215 -9.837 1.00 44.54 C ATOM 2498 O GLY B 257 -11.238 -4.822 -9.279 1.00 70.21 O ATOM 0 H GLY B 257 -8.901 -3.532 -12.243 1.00 61.11 H new ATOM 0 HA2 GLY B 257 -9.959 -5.474 -11.517 1.00 2.31 H new ATOM 0 HA3 GLY B 257 -8.798 -5.657 -10.218 1.00 2.31 H new ATOM 2502 N VAL B 258 -10.091 -2.941 -9.652 1.00 0.31 N ATOM 2503 CA VAL B 258 -10.908 -2.151 -8.790 1.00 2.43 C ATOM 2504 C VAL B 258 -12.053 -1.534 -9.592 1.00 51.45 C ATOM 2505 O VAL B 258 -11.815 -0.834 -10.585 1.00 20.24 O ATOM 2506 CB VAL B 258 -10.088 -1.042 -8.106 1.00 15.02 C ATOM 2507 CG1 VAL B 258 -10.959 -0.251 -7.151 1.00 11.21 C ATOM 2508 CG2 VAL B 258 -8.894 -1.644 -7.376 1.00 1.41 C ATOM 0 H VAL B 258 -9.331 -2.428 -10.099 1.00 0.31 H new ATOM 0 HA VAL B 258 -11.312 -2.799 -8.012 1.00 2.43 H new ATOM 0 HB VAL B 258 -9.716 -0.360 -8.870 1.00 15.02 H new ATOM 0 HG11 VAL B 258 -10.363 0.529 -6.676 1.00 11.21 H new ATOM 0 HG12 VAL B 258 -11.781 0.205 -7.702 1.00 11.21 H new ATOM 0 HG13 VAL B 258 -11.360 -0.917 -6.387 1.00 11.21 H new ATOM 0 HG21 VAL B 258 -8.322 -0.849 -6.897 1.00 1.41 H new ATOM 0 HG22 VAL B 258 -9.246 -2.345 -6.619 1.00 1.41 H new ATOM 0 HG23 VAL B 258 -8.258 -2.169 -8.089 1.00 1.41 H new ATOM 2518 N PRO B 259 -13.302 -1.811 -9.186 1.00 41.23 N ATOM 2519 CA PRO B 259 -14.486 -1.316 -9.875 1.00 11.21 C ATOM 2520 C PRO B 259 -14.614 0.212 -9.874 1.00 65.23 C ATOM 2521 O PRO B 259 -14.148 0.903 -8.954 1.00 31.01 O ATOM 2522 CB PRO B 259 -15.658 -1.937 -9.121 1.00 24.14 C ATOM 2523 CG PRO B 259 -15.108 -2.408 -7.820 1.00 30.43 C ATOM 2524 CD PRO B 259 -13.648 -2.658 -8.029 1.00 34.43 C ATOM 0 HA PRO B 259 -14.444 -1.588 -10.930 1.00 11.21 H new ATOM 0 HB2 PRO B 259 -16.453 -1.207 -8.967 1.00 24.14 H new ATOM 0 HB3 PRO B 259 -16.090 -2.764 -9.684 1.00 24.14 H new ATOM 0 HG2 PRO B 259 -15.264 -1.661 -7.042 1.00 30.43 H new ATOM 0 HG3 PRO B 259 -15.613 -3.318 -7.494 1.00 30.43 H new ATOM 0 HD2 PRO B 259 -13.067 -2.387 -7.148 1.00 34.43 H new ATOM 0 HD3 PRO B 259 -13.448 -3.710 -8.231 1.00 34.43 H new ATOM 2532 N SER B 260 -15.281 0.715 -10.900 1.00 41.14 N ATOM 2533 CA SER B 260 -15.513 2.138 -11.120 1.00 1.32 C ATOM 2534 C SER B 260 -16.451 2.755 -10.063 1.00 51.45 C ATOM 2535 O SER B 260 -16.669 3.973 -10.041 1.00 11.13 O ATOM 2536 CB SER B 260 -16.073 2.326 -12.522 1.00 5.43 C ATOM 2537 OG SER B 260 -15.190 1.749 -13.478 1.00 24.52 O ATOM 0 H SER B 260 -15.690 0.128 -11.627 1.00 41.14 H new ATOM 0 HA SER B 260 -14.563 2.663 -11.021 1.00 1.32 H new ATOM 0 HB2 SER B 260 -17.056 1.861 -12.596 1.00 5.43 H new ATOM 0 HB3 SER B 260 -16.206 3.388 -12.731 1.00 5.43 H new ATOM 0 HG SER B 260 -15.557 1.872 -14.378 1.00 24.52 H new ATOM 2543 N ARG B 261 -16.998 1.908 -9.190 1.00 25.31 N ATOM 2544 CA ARG B 261 -17.867 2.371 -8.122 1.00 14.32 C ATOM 2545 C ARG B 261 -17.058 3.166 -7.092 1.00 33.54 C ATOM 2546 O ARG B 261 -17.620 3.899 -6.293 1.00 2.45 O ATOM 2547 CB ARG B 261 -18.584 1.187 -7.440 1.00 33.23 C ATOM 2548 CG ARG B 261 -17.660 0.239 -6.688 1.00 31.02 C ATOM 2549 CD ARG B 261 -18.390 -0.996 -6.175 1.00 61.12 C ATOM 2550 NE ARG B 261 -18.872 -1.853 -7.271 1.00 5.14 N ATOM 2551 CZ ARG B 261 -19.115 -3.175 -7.168 1.00 71.45 C ATOM 2552 NH1 ARG B 261 -18.838 -3.825 -6.036 1.00 63.41 N ATOM 2553 NH2 ARG B 261 -19.600 -3.840 -8.206 1.00 51.23 N ATOM 0 H ARG B 261 -16.851 0.899 -9.207 1.00 25.31 H new ATOM 0 HA ARG B 261 -18.626 3.022 -8.557 1.00 14.32 H new ATOM 0 HB2 ARG B 261 -19.326 1.580 -6.744 1.00 33.23 H new ATOM 0 HB3 ARG B 261 -19.126 0.621 -8.198 1.00 33.23 H new ATOM 0 HG2 ARG B 261 -16.847 -0.069 -7.345 1.00 31.02 H new ATOM 0 HG3 ARG B 261 -17.208 0.766 -5.848 1.00 31.02 H new ATOM 0 HD2 ARG B 261 -17.722 -1.571 -5.534 1.00 61.12 H new ATOM 0 HD3 ARG B 261 -19.235 -0.687 -5.559 1.00 61.12 H new ATOM 0 HE ARG B 261 -19.034 -1.413 -8.177 1.00 5.14 H new ATOM 0 HH11 ARG B 261 -18.440 -3.322 -5.243 1.00 63.41 H new ATOM 0 HH12 ARG B 261 -19.024 -4.825 -5.964 1.00 63.41 H new ATOM 0 HH21 ARG B 261 -19.789 -3.352 -9.081 1.00 51.23 H new ATOM 0 HH22 ARG B 261 -19.784 -4.840 -8.130 1.00 51.23 H new ATOM 2567 N PHE B 262 -15.741 3.002 -7.119 1.00 0.01 N ATOM 2568 CA PHE B 262 -14.865 3.754 -6.253 1.00 51.45 C ATOM 2569 C PHE B 262 -14.298 4.921 -7.035 1.00 50.25 C ATOM 2570 O PHE B 262 -14.045 4.799 -8.240 1.00 34.11 O ATOM 2571 CB PHE B 262 -13.714 2.882 -5.729 1.00 42.34 C ATOM 2572 CG PHE B 262 -14.143 1.701 -4.909 1.00 3.33 C ATOM 2573 CD1 PHE B 262 -14.557 1.865 -3.604 1.00 11.31 C ATOM 2574 CD2 PHE B 262 -14.124 0.426 -5.444 1.00 70.05 C ATOM 2575 CE1 PHE B 262 -14.947 0.783 -2.844 1.00 44.20 C ATOM 2576 CE2 PHE B 262 -14.512 -0.663 -4.686 1.00 32.53 C ATOM 2577 CZ PHE B 262 -14.923 -0.482 -3.385 1.00 11.14 C ATOM 0 H PHE B 262 -15.261 2.349 -7.738 1.00 0.01 H new ATOM 0 HA PHE B 262 -15.437 4.107 -5.395 1.00 51.45 H new ATOM 0 HB2 PHE B 262 -13.132 2.525 -6.578 1.00 42.34 H new ATOM 0 HB3 PHE B 262 -13.051 3.503 -5.127 1.00 42.34 H new ATOM 0 HD1 PHE B 262 -14.576 2.854 -3.171 1.00 11.31 H new ATOM 0 HD2 PHE B 262 -13.803 0.279 -6.465 1.00 70.05 H new ATOM 0 HE1 PHE B 262 -15.271 0.928 -1.824 1.00 44.20 H new ATOM 0 HE2 PHE B 262 -14.493 -1.654 -5.114 1.00 32.53 H new ATOM 0 HZ PHE B 262 -15.226 -1.331 -2.790 1.00 11.14 H new ATOM 2587 N SER B 263 -14.123 6.038 -6.383 1.00 65.52 N ATOM 2588 CA SER B 263 -13.565 7.199 -7.011 1.00 43.53 C ATOM 2589 C SER B 263 -13.014 8.134 -5.942 1.00 13.34 C ATOM 2590 O SER B 263 -13.551 8.215 -4.836 1.00 40.34 O ATOM 2591 CB SER B 263 -14.645 7.909 -7.853 1.00 24.43 C ATOM 2592 OG SER B 263 -14.116 9.016 -8.563 1.00 10.04 O ATOM 0 H SER B 263 -14.364 6.167 -5.400 1.00 65.52 H new ATOM 0 HA SER B 263 -12.752 6.904 -7.675 1.00 43.53 H new ATOM 0 HB2 SER B 263 -15.081 7.200 -8.557 1.00 24.43 H new ATOM 0 HB3 SER B 263 -15.450 8.247 -7.201 1.00 24.43 H new ATOM 0 HG SER B 263 -14.828 9.440 -9.086 1.00 10.04 H new ATOM 2598 N GLY B 264 -11.926 8.791 -6.241 1.00 31.51 N ATOM 2599 CA GLY B 264 -11.381 9.742 -5.334 1.00 54.11 C ATOM 2600 C GLY B 264 -11.406 11.117 -5.926 1.00 40.21 C ATOM 2601 O GLY B 264 -11.511 11.270 -7.137 1.00 11.12 O ATOM 0 H GLY B 264 -11.404 8.679 -7.110 1.00 31.51 H new ATOM 0 HA2 GLY B 264 -11.949 9.731 -4.404 1.00 54.11 H new ATOM 0 HA3 GLY B 264 -10.356 9.467 -5.084 1.00 54.11 H new ATOM 2605 N SER B 265 -11.362 12.098 -5.091 1.00 60.42 N ATOM 2606 CA SER B 265 -11.369 13.470 -5.494 1.00 45.25 C ATOM 2607 C SER B 265 -10.514 14.301 -4.560 1.00 72.05 C ATOM 2608 O SER B 265 -10.168 13.849 -3.449 1.00 63.44 O ATOM 2609 CB SER B 265 -12.805 13.986 -5.523 1.00 12.21 C ATOM 2610 OG SER B 265 -13.489 13.651 -4.323 1.00 12.14 O ATOM 0 H SER B 265 -11.319 11.968 -4.080 1.00 60.42 H new ATOM 0 HA SER B 265 -10.946 13.553 -6.495 1.00 45.25 H new ATOM 0 HB2 SER B 265 -12.804 15.068 -5.656 1.00 12.21 H new ATOM 0 HB3 SER B 265 -13.331 13.560 -6.377 1.00 12.21 H new ATOM 0 HG SER B 265 -12.930 13.053 -3.784 1.00 12.14 H new ATOM 2616 N GLY B 266 -10.176 15.485 -4.990 1.00 23.22 N ATOM 2617 CA GLY B 266 -9.421 16.372 -4.173 1.00 24.25 C ATOM 2618 C GLY B 266 -7.970 16.400 -4.540 1.00 13.11 C ATOM 2619 O GLY B 266 -7.445 15.451 -5.133 1.00 32.10 O ATOM 0 H GLY B 266 -10.417 15.853 -5.910 1.00 23.22 H new ATOM 0 HA2 GLY B 266 -9.833 17.378 -4.258 1.00 24.25 H new ATOM 0 HA3 GLY B 266 -9.522 16.074 -3.130 1.00 24.25 H new ATOM 2623 N SER B 267 -7.330 17.480 -4.213 1.00 53.22 N ATOM 2624 CA SER B 267 -5.936 17.646 -4.440 1.00 34.21 C ATOM 2625 C SER B 267 -5.389 18.634 -3.437 1.00 11.53 C ATOM 2626 O SER B 267 -6.057 19.624 -3.103 1.00 71.41 O ATOM 2627 CB SER B 267 -5.666 18.101 -5.892 1.00 3.05 C ATOM 2628 OG SER B 267 -6.360 19.311 -6.207 1.00 2.41 O ATOM 0 H SER B 267 -7.775 18.285 -3.772 1.00 53.22 H new ATOM 0 HA SER B 267 -5.427 16.691 -4.307 1.00 34.21 H new ATOM 0 HB2 SER B 267 -4.595 18.249 -6.034 1.00 3.05 H new ATOM 0 HB3 SER B 267 -5.973 17.315 -6.582 1.00 3.05 H new ATOM 0 HG SER B 267 -6.164 19.569 -7.132 1.00 2.41 H new ATOM 2634 N GLY B 268 -4.226 18.352 -2.924 1.00 22.42 N ATOM 2635 CA GLY B 268 -3.593 19.233 -1.996 1.00 13.11 C ATOM 2636 C GLY B 268 -3.392 18.610 -0.650 1.00 0.01 C ATOM 2637 O GLY B 268 -2.437 17.845 -0.445 1.00 31.33 O ATOM 0 H GLY B 268 -3.695 17.508 -3.138 1.00 22.42 H new ATOM 0 HA2 GLY B 268 -2.627 19.542 -2.396 1.00 13.11 H new ATOM 0 HA3 GLY B 268 -4.197 20.134 -1.888 1.00 13.11 H new ATOM 2641 N THR B 269 -4.276 18.916 0.265 1.00 75.20 N ATOM 2642 CA THR B 269 -4.162 18.429 1.617 1.00 11.20 C ATOM 2643 C THR B 269 -5.472 17.733 2.034 1.00 14.02 C ATOM 2644 O THR B 269 -5.460 16.742 2.780 1.00 44.20 O ATOM 2645 CB THR B 269 -3.866 19.604 2.570 1.00 71.33 C ATOM 2646 OG1 THR B 269 -2.825 20.414 1.996 1.00 1.55 O ATOM 2647 CG2 THR B 269 -3.361 19.091 3.894 1.00 15.54 C ATOM 0 H THR B 269 -5.091 19.506 0.096 1.00 75.20 H new ATOM 0 HA THR B 269 -3.345 17.710 1.671 1.00 11.20 H new ATOM 0 HB THR B 269 -4.783 20.175 2.717 1.00 71.33 H new ATOM 0 HG1 THR B 269 -2.629 21.166 2.593 1.00 1.55 H new ATOM 0 HG21 THR B 269 -3.156 19.932 4.556 1.00 15.54 H new ATOM 0 HG22 THR B 269 -4.116 18.448 4.347 1.00 15.54 H new ATOM 0 HG23 THR B 269 -2.445 18.521 3.738 1.00 15.54 H new ATOM 2655 N ASP B 270 -6.590 18.254 1.541 1.00 73.20 N ATOM 2656 CA ASP B 270 -7.902 17.666 1.783 1.00 0.32 C ATOM 2657 C ASP B 270 -8.272 16.816 0.598 1.00 13.52 C ATOM 2658 O ASP B 270 -8.109 17.240 -0.547 1.00 22.30 O ATOM 2659 CB ASP B 270 -8.984 18.755 1.976 1.00 53.25 C ATOM 2660 CG ASP B 270 -8.866 19.549 3.263 1.00 13.12 C ATOM 2661 OD1 ASP B 270 -7.983 20.431 3.369 1.00 21.12 O ATOM 2662 OD2 ASP B 270 -9.685 19.333 4.185 1.00 61.33 O ATOM 0 H ASP B 270 -6.612 19.094 0.963 1.00 73.20 H new ATOM 0 HA ASP B 270 -7.852 17.070 2.694 1.00 0.32 H new ATOM 0 HB2 ASP B 270 -8.938 19.446 1.134 1.00 53.25 H new ATOM 0 HB3 ASP B 270 -9.965 18.281 1.947 1.00 53.25 H new ATOM 2667 N PHE B 271 -8.758 15.635 0.853 1.00 61.24 N ATOM 2668 CA PHE B 271 -9.138 14.693 -0.192 1.00 1.22 C ATOM 2669 C PHE B 271 -10.458 14.059 0.131 1.00 3.24 C ATOM 2670 O PHE B 271 -10.828 13.941 1.297 1.00 53.50 O ATOM 2671 CB PHE B 271 -8.082 13.609 -0.348 1.00 65.33 C ATOM 2672 CG PHE B 271 -6.740 14.123 -0.762 1.00 11.25 C ATOM 2673 CD1 PHE B 271 -6.423 14.251 -2.098 1.00 35.43 C ATOM 2674 CD2 PHE B 271 -5.797 14.473 0.184 1.00 21.04 C ATOM 2675 CE1 PHE B 271 -5.196 14.720 -2.484 1.00 53.44 C ATOM 2676 CE2 PHE B 271 -4.569 14.945 -0.197 1.00 51.41 C ATOM 2677 CZ PHE B 271 -4.267 15.069 -1.533 1.00 54.54 C ATOM 0 H PHE B 271 -8.908 15.283 1.799 1.00 61.24 H new ATOM 0 HA PHE B 271 -9.222 15.245 -1.128 1.00 1.22 H new ATOM 0 HB2 PHE B 271 -7.980 13.077 0.598 1.00 65.33 H new ATOM 0 HB3 PHE B 271 -8.426 12.885 -1.086 1.00 65.33 H new ATOM 0 HD1 PHE B 271 -7.151 13.978 -2.848 1.00 35.43 H new ATOM 0 HD2 PHE B 271 -6.030 14.374 1.234 1.00 21.04 H new ATOM 0 HE1 PHE B 271 -4.959 14.816 -3.533 1.00 53.44 H new ATOM 0 HE2 PHE B 271 -3.839 15.219 0.550 1.00 51.41 H new ATOM 0 HZ PHE B 271 -3.299 15.441 -1.835 1.00 54.54 H new ATOM 2687 N THR B 272 -11.165 13.650 -0.879 1.00 61.50 N ATOM 2688 CA THR B 272 -12.451 13.045 -0.693 1.00 22.22 C ATOM 2689 C THR B 272 -12.555 11.747 -1.491 1.00 22.01 C ATOM 2690 O THR B 272 -12.398 11.734 -2.694 1.00 20.11 O ATOM 2691 CB THR B 272 -13.564 14.010 -1.140 1.00 33.31 C ATOM 2692 OG1 THR B 272 -13.409 15.267 -0.456 1.00 2.04 O ATOM 2693 CG2 THR B 272 -14.942 13.438 -0.832 1.00 50.44 C ATOM 0 H THR B 272 -10.869 13.725 -1.852 1.00 61.50 H new ATOM 0 HA THR B 272 -12.570 12.821 0.367 1.00 22.22 H new ATOM 0 HB THR B 272 -13.482 14.154 -2.217 1.00 33.31 H new ATOM 0 HG1 THR B 272 -14.116 15.883 -0.740 1.00 2.04 H new ATOM 0 HG21 THR B 272 -15.709 14.141 -1.158 1.00 50.44 H new ATOM 0 HG22 THR B 272 -15.069 12.492 -1.358 1.00 50.44 H new ATOM 0 HG23 THR B 272 -15.035 13.272 0.241 1.00 50.44 H new ATOM 2701 N PHE B 273 -12.790 10.689 -0.806 1.00 42.10 N ATOM 2702 CA PHE B 273 -13.017 9.403 -1.400 1.00 44.11 C ATOM 2703 C PHE B 273 -14.496 9.184 -1.449 1.00 3.23 C ATOM 2704 O PHE B 273 -15.202 9.433 -0.463 1.00 32.14 O ATOM 2705 CB PHE B 273 -12.340 8.332 -0.565 1.00 74.53 C ATOM 2706 CG PHE B 273 -12.654 6.912 -0.928 1.00 23.33 C ATOM 2707 CD1 PHE B 273 -11.978 6.245 -1.942 1.00 54.14 C ATOM 2708 CD2 PHE B 273 -13.622 6.244 -0.227 1.00 62.44 C ATOM 2709 CE1 PHE B 273 -12.285 4.931 -2.231 1.00 64.45 C ATOM 2710 CE2 PHE B 273 -13.928 4.948 -0.504 1.00 13.44 C ATOM 2711 CZ PHE B 273 -13.267 4.284 -1.502 1.00 52.11 C ATOM 0 H PHE B 273 -12.833 10.683 0.213 1.00 42.10 H new ATOM 0 HA PHE B 273 -12.602 9.355 -2.407 1.00 44.11 H new ATOM 0 HB2 PHE B 273 -11.262 8.473 -0.636 1.00 74.53 H new ATOM 0 HB3 PHE B 273 -12.614 8.487 0.479 1.00 74.53 H new ATOM 0 HD1 PHE B 273 -11.211 6.756 -2.505 1.00 54.14 H new ATOM 0 HD2 PHE B 273 -14.153 6.756 0.562 1.00 62.44 H new ATOM 0 HE1 PHE B 273 -11.762 4.411 -3.021 1.00 64.45 H new ATOM 0 HE2 PHE B 273 -14.694 4.442 0.065 1.00 13.44 H new ATOM 0 HZ PHE B 273 -13.512 3.255 -1.720 1.00 52.11 H new ATOM 2721 N THR B 274 -14.975 8.769 -2.558 1.00 33.52 N ATOM 2722 CA THR B 274 -16.350 8.578 -2.704 1.00 35.02 C ATOM 2723 C THR B 274 -16.654 7.218 -3.335 1.00 30.04 C ATOM 2724 O THR B 274 -15.994 6.792 -4.292 1.00 21.43 O ATOM 2725 CB THR B 274 -16.983 9.753 -3.513 1.00 22.41 C ATOM 2726 OG1 THR B 274 -18.389 9.601 -3.577 1.00 44.11 O ATOM 2727 CG2 THR B 274 -16.411 9.842 -4.931 1.00 31.14 C ATOM 0 H THR B 274 -14.419 8.554 -3.386 1.00 33.52 H new ATOM 0 HA THR B 274 -16.806 8.577 -1.714 1.00 35.02 H new ATOM 0 HB THR B 274 -16.736 10.678 -2.991 1.00 22.41 H new ATOM 0 HG1 THR B 274 -18.728 9.319 -2.702 1.00 44.11 H new ATOM 0 HG21 THR B 274 -16.878 10.673 -5.460 1.00 31.14 H new ATOM 0 HG22 THR B 274 -15.334 10.004 -4.880 1.00 31.14 H new ATOM 0 HG23 THR B 274 -16.613 8.913 -5.464 1.00 31.14 H new ATOM 2735 N ILE B 275 -17.594 6.520 -2.767 1.00 71.34 N ATOM 2736 CA ILE B 275 -18.072 5.307 -3.358 1.00 30.42 C ATOM 2737 C ILE B 275 -19.393 5.656 -3.983 1.00 73.44 C ATOM 2738 O ILE B 275 -20.329 5.974 -3.282 1.00 22.24 O ATOM 2739 CB ILE B 275 -18.267 4.171 -2.303 1.00 14.23 C ATOM 2740 CG1 ILE B 275 -16.933 3.827 -1.643 1.00 14.05 C ATOM 2741 CG2 ILE B 275 -18.860 2.928 -2.953 1.00 23.21 C ATOM 2742 CD1 ILE B 275 -17.029 2.771 -0.554 1.00 31.41 C ATOM 0 H ILE B 275 -18.047 6.774 -1.889 1.00 71.34 H new ATOM 0 HA ILE B 275 -17.351 4.927 -4.082 1.00 30.42 H new ATOM 0 HB ILE B 275 -18.959 4.529 -1.541 1.00 14.23 H new ATOM 0 HG12 ILE B 275 -16.240 3.480 -2.410 1.00 14.05 H new ATOM 0 HG13 ILE B 275 -16.507 4.735 -1.216 1.00 14.05 H new ATOM 0 HG21 ILE B 275 -18.987 2.150 -2.201 1.00 23.21 H new ATOM 0 HG22 ILE B 275 -19.828 3.173 -3.390 1.00 23.21 H new ATOM 0 HG23 ILE B 275 -18.189 2.571 -3.735 1.00 23.21 H new ATOM 0 HD11 ILE B 275 -16.039 2.586 -0.138 1.00 31.41 H new ATOM 0 HD12 ILE B 275 -17.694 3.122 0.235 1.00 31.41 H new ATOM 0 HD13 ILE B 275 -17.423 1.847 -0.977 1.00 31.41 H new ATOM 2754 N SER B 276 -19.447 5.624 -5.286 1.00 44.44 N ATOM 2755 CA SER B 276 -20.620 6.020 -6.020 1.00 34.05 C ATOM 2756 C SER B 276 -21.707 4.961 -5.917 1.00 54.43 C ATOM 2757 O SER B 276 -22.883 5.274 -5.728 1.00 22.41 O ATOM 2758 CB SER B 276 -20.223 6.210 -7.479 1.00 22.04 C ATOM 2759 OG SER B 276 -19.105 7.086 -7.579 1.00 5.33 O ATOM 0 H SER B 276 -18.672 5.320 -5.875 1.00 44.44 H new ATOM 0 HA SER B 276 -21.015 6.947 -5.604 1.00 34.05 H new ATOM 0 HB2 SER B 276 -19.979 5.246 -7.925 1.00 22.04 H new ATOM 0 HB3 SER B 276 -21.063 6.617 -8.041 1.00 22.04 H new ATOM 0 HG SER B 276 -18.860 7.197 -8.521 1.00 5.33 H new ATOM 2765 N SER B 277 -21.308 3.724 -6.045 1.00 51.04 N ATOM 2766 CA SER B 277 -22.213 2.625 -5.936 1.00 64.32 C ATOM 2767 C SER B 277 -21.801 1.748 -4.758 1.00 12.20 C ATOM 2768 O SER B 277 -20.884 0.933 -4.883 1.00 55.21 O ATOM 2769 CB SER B 277 -22.229 1.848 -7.246 1.00 11.32 C ATOM 2770 OG SER B 277 -22.501 2.729 -8.336 1.00 1.20 O ATOM 0 H SER B 277 -20.341 3.455 -6.228 1.00 51.04 H new ATOM 0 HA SER B 277 -23.226 2.983 -5.750 1.00 64.32 H new ATOM 0 HB2 SER B 277 -21.268 1.356 -7.397 1.00 11.32 H new ATOM 0 HB3 SER B 277 -22.986 1.065 -7.204 1.00 11.32 H new ATOM 0 HG SER B 277 -22.507 2.221 -9.174 1.00 1.20 H new ATOM 2776 N LEU B 278 -22.417 1.957 -3.614 1.00 31.23 N ATOM 2777 CA LEU B 278 -22.067 1.199 -2.424 1.00 52.34 C ATOM 2778 C LEU B 278 -22.625 -0.227 -2.511 1.00 0.32 C ATOM 2779 O LEU B 278 -23.838 -0.418 -2.686 1.00 1.03 O ATOM 2780 CB LEU B 278 -22.593 1.922 -1.183 1.00 35.33 C ATOM 2781 CG LEU B 278 -22.198 1.340 0.160 1.00 3.41 C ATOM 2782 CD1 LEU B 278 -20.691 1.334 0.301 1.00 53.43 C ATOM 2783 CD2 LEU B 278 -22.823 2.143 1.278 1.00 44.20 C ATOM 0 H LEU B 278 -23.161 2.642 -3.479 1.00 31.23 H new ATOM 0 HA LEU B 278 -20.982 1.125 -2.351 1.00 52.34 H new ATOM 0 HB2 LEU B 278 -22.250 2.956 -1.220 1.00 35.33 H new ATOM 0 HB3 LEU B 278 -23.681 1.945 -1.238 1.00 35.33 H new ATOM 0 HG LEU B 278 -22.560 0.314 0.220 1.00 3.41 H new ATOM 0 HD11 LEU B 278 -20.418 0.914 1.269 1.00 53.43 H new ATOM 0 HD12 LEU B 278 -20.254 0.729 -0.493 1.00 53.43 H new ATOM 0 HD13 LEU B 278 -20.315 2.354 0.229 1.00 53.43 H new ATOM 0 HD21 LEU B 278 -22.533 1.717 2.238 1.00 44.20 H new ATOM 0 HD22 LEU B 278 -22.479 3.176 1.221 1.00 44.20 H new ATOM 0 HD23 LEU B 278 -23.908 2.116 1.182 1.00 44.20 H new ATOM 2795 N GLN B 279 -21.741 -1.213 -2.386 1.00 53.45 N ATOM 2796 CA GLN B 279 -22.111 -2.617 -2.522 1.00 35.50 C ATOM 2797 C GLN B 279 -21.720 -3.417 -1.286 1.00 64.44 C ATOM 2798 O GLN B 279 -20.666 -3.211 -0.748 1.00 71.41 O ATOM 2799 CB GLN B 279 -21.453 -3.244 -3.755 1.00 22.23 C ATOM 2800 CG GLN B 279 -21.880 -2.633 -5.076 1.00 44.31 C ATOM 2801 CD GLN B 279 -23.365 -2.755 -5.340 1.00 74.42 C ATOM 2802 OE1 GLN B 279 -24.026 -3.697 -4.898 1.00 42.50 O ATOM 2803 NE2 GLN B 279 -23.889 -1.831 -6.075 1.00 73.31 N ATOM 0 H GLN B 279 -20.752 -1.061 -2.188 1.00 53.45 H new ATOM 0 HA GLN B 279 -23.194 -2.650 -2.637 1.00 35.50 H new ATOM 0 HB2 GLN B 279 -20.371 -3.152 -3.660 1.00 22.23 H new ATOM 0 HB3 GLN B 279 -21.682 -4.309 -3.771 1.00 22.23 H new ATOM 0 HG2 GLN B 279 -21.601 -1.579 -5.088 1.00 44.31 H new ATOM 0 HG3 GLN B 279 -21.333 -3.116 -5.886 1.00 44.31 H new ATOM 0 HE21 GLN B 279 -23.310 -1.066 -6.423 1.00 73.31 H new ATOM 0 HE22 GLN B 279 -24.882 -1.866 -6.308 1.00 73.31 H new ATOM 2812 N PRO B 280 -22.572 -4.375 -0.870 1.00 11.14 N ATOM 2813 CA PRO B 280 -22.365 -5.251 0.331 1.00 62.52 C ATOM 2814 C PRO B 280 -20.940 -5.837 0.507 1.00 53.20 C ATOM 2815 O PRO B 280 -20.503 -6.115 1.628 1.00 53.22 O ATOM 2816 CB PRO B 280 -23.390 -6.358 0.109 1.00 32.54 C ATOM 2817 CG PRO B 280 -24.509 -5.648 -0.568 1.00 60.20 C ATOM 2818 CD PRO B 280 -23.853 -4.709 -1.541 1.00 52.15 C ATOM 0 HA PRO B 280 -22.485 -4.677 1.250 1.00 62.52 H new ATOM 0 HB2 PRO B 280 -22.989 -7.161 -0.509 1.00 32.54 H new ATOM 0 HB3 PRO B 280 -23.708 -6.808 1.049 1.00 32.54 H new ATOM 0 HG2 PRO B 280 -25.167 -6.350 -1.081 1.00 60.20 H new ATOM 0 HG3 PRO B 280 -25.122 -5.104 0.151 1.00 60.20 H new ATOM 0 HD2 PRO B 280 -23.690 -5.181 -2.510 1.00 52.15 H new ATOM 0 HD3 PRO B 280 -24.460 -3.821 -1.717 1.00 52.15 H new ATOM 2826 N GLU B 281 -20.239 -6.029 -0.591 1.00 13.42 N ATOM 2827 CA GLU B 281 -18.942 -6.695 -0.585 1.00 43.11 C ATOM 2828 C GLU B 281 -17.821 -5.741 -0.154 1.00 24.35 C ATOM 2829 O GLU B 281 -16.670 -6.167 0.049 1.00 12.15 O ATOM 2830 CB GLU B 281 -18.625 -7.193 -1.995 1.00 32.12 C ATOM 2831 CG GLU B 281 -18.495 -6.058 -3.008 1.00 2.04 C ATOM 2832 CD GLU B 281 -18.091 -6.510 -4.379 1.00 13.54 C ATOM 2833 OE1 GLU B 281 -16.894 -6.823 -4.584 1.00 4.42 O ATOM 2834 OE2 GLU B 281 -18.941 -6.504 -5.287 1.00 53.32 O ATOM 0 H GLU B 281 -20.548 -5.730 -1.516 1.00 13.42 H new ATOM 0 HA GLU B 281 -18.995 -7.522 0.124 1.00 43.11 H new ATOM 0 HB2 GLU B 281 -17.696 -7.763 -1.974 1.00 32.12 H new ATOM 0 HB3 GLU B 281 -19.411 -7.875 -2.320 1.00 32.12 H new ATOM 0 HG2 GLU B 281 -19.448 -5.533 -3.075 1.00 2.04 H new ATOM 0 HG3 GLU B 281 -17.761 -5.340 -2.642 1.00 2.04 H new ATOM 2841 N ASP B 282 -18.145 -4.470 -0.019 1.00 0.20 N ATOM 2842 CA ASP B 282 -17.127 -3.467 0.224 1.00 75.02 C ATOM 2843 C ASP B 282 -16.879 -3.290 1.709 1.00 11.13 C ATOM 2844 O ASP B 282 -15.838 -2.778 2.093 1.00 21.22 O ATOM 2845 CB ASP B 282 -17.557 -2.123 -0.373 1.00 5.43 C ATOM 2846 CG ASP B 282 -18.247 -1.200 0.623 1.00 64.13 C ATOM 2847 OD1 ASP B 282 -19.376 -1.508 1.042 1.00 53.54 O ATOM 2848 OD2 ASP B 282 -17.630 -0.177 0.994 1.00 54.42 O ATOM 0 H ASP B 282 -19.098 -4.109 -0.073 1.00 0.20 H new ATOM 0 HA ASP B 282 -16.206 -3.806 -0.251 1.00 75.02 H new ATOM 0 HB2 ASP B 282 -16.679 -1.617 -0.775 1.00 5.43 H new ATOM 0 HB3 ASP B 282 -18.230 -2.307 -1.210 1.00 5.43 H new ATOM 2853 N ILE B 283 -17.847 -3.752 2.529 1.00 32.15 N ATOM 2854 CA ILE B 283 -17.829 -3.581 3.992 1.00 21.51 C ATOM 2855 C ILE B 283 -16.468 -3.912 4.581 1.00 60.35 C ATOM 2856 O ILE B 283 -16.091 -5.091 4.738 1.00 23.53 O ATOM 2857 CB ILE B 283 -18.939 -4.414 4.702 1.00 64.00 C ATOM 2858 CG1 ILE B 283 -20.321 -4.054 4.145 1.00 62.31 C ATOM 2859 CG2 ILE B 283 -18.910 -4.177 6.211 1.00 13.41 C ATOM 2860 CD1 ILE B 283 -20.658 -2.601 4.281 1.00 12.33 C ATOM 0 H ILE B 283 -18.666 -4.256 2.190 1.00 32.15 H new ATOM 0 HA ILE B 283 -18.037 -2.527 4.174 1.00 21.51 H new ATOM 0 HB ILE B 283 -18.744 -5.469 4.509 1.00 64.00 H new ATOM 0 HG12 ILE B 283 -20.364 -4.332 3.092 1.00 62.31 H new ATOM 0 HG13 ILE B 283 -21.078 -4.645 4.661 1.00 62.31 H new ATOM 0 HG21 ILE B 283 -19.693 -4.768 6.687 1.00 13.41 H new ATOM 0 HG22 ILE B 283 -17.939 -4.474 6.607 1.00 13.41 H new ATOM 0 HG23 ILE B 283 -19.078 -3.120 6.417 1.00 13.41 H new ATOM 0 HD11 ILE B 283 -21.649 -2.417 3.867 1.00 12.33 H new ATOM 0 HD12 ILE B 283 -20.648 -2.322 5.335 1.00 12.33 H new ATOM 0 HD13 ILE B 283 -19.923 -2.005 3.741 1.00 12.33 H new ATOM 2872 N ALA B 284 -15.733 -2.874 4.881 1.00 44.34 N ATOM 2873 CA ALA B 284 -14.395 -2.977 5.352 1.00 25.02 C ATOM 2874 C ALA B 284 -13.977 -1.660 5.953 1.00 61.30 C ATOM 2875 O ALA B 284 -14.809 -0.772 6.180 1.00 14.25 O ATOM 2876 CB ALA B 284 -13.485 -3.320 4.187 1.00 25.13 C ATOM 0 H ALA B 284 -16.065 -1.913 4.799 1.00 44.34 H new ATOM 0 HA ALA B 284 -14.326 -3.757 6.110 1.00 25.02 H new ATOM 0 HB1 ALA B 284 -12.457 -3.401 4.540 1.00 25.13 H new ATOM 0 HB2 ALA B 284 -13.795 -4.270 3.751 1.00 25.13 H new ATOM 0 HB3 ALA B 284 -13.549 -2.536 3.432 1.00 25.13 H new ATOM 2882 N THR B 285 -12.715 -1.536 6.233 1.00 12.41 N ATOM 2883 CA THR B 285 -12.181 -0.327 6.743 1.00 15.31 C ATOM 2884 C THR B 285 -11.325 0.359 5.663 1.00 32.41 C ATOM 2885 O THR B 285 -10.369 -0.238 5.125 1.00 63.44 O ATOM 2886 CB THR B 285 -11.364 -0.612 8.007 1.00 21.55 C ATOM 2887 OG1 THR B 285 -12.211 -1.302 8.941 1.00 20.23 O ATOM 2888 CG2 THR B 285 -10.866 0.676 8.643 1.00 11.24 C ATOM 0 H THR B 285 -12.029 -2.281 6.110 1.00 12.41 H new ATOM 0 HA THR B 285 -12.992 0.349 7.012 1.00 15.31 H new ATOM 0 HB THR B 285 -10.496 -1.216 7.742 1.00 21.55 H new ATOM 0 HG1 THR B 285 -11.707 -1.496 9.758 1.00 20.23 H new ATOM 0 HG21 THR B 285 -10.290 0.441 9.538 1.00 11.24 H new ATOM 0 HG22 THR B 285 -10.234 1.211 7.934 1.00 11.24 H new ATOM 0 HG23 THR B 285 -11.717 1.301 8.913 1.00 11.24 H new ATOM 2896 N TYR B 286 -11.665 1.592 5.364 1.00 52.32 N ATOM 2897 CA TYR B 286 -11.005 2.370 4.337 1.00 22.04 C ATOM 2898 C TYR B 286 -10.057 3.355 4.943 1.00 33.34 C ATOM 2899 O TYR B 286 -10.308 3.912 6.003 1.00 23.10 O ATOM 2900 CB TYR B 286 -12.029 3.087 3.456 1.00 42.15 C ATOM 2901 CG TYR B 286 -12.855 2.148 2.604 1.00 11.31 C ATOM 2902 CD1 TYR B 286 -13.952 1.468 3.124 1.00 22.04 C ATOM 2903 CD2 TYR B 286 -12.527 1.937 1.275 1.00 5.13 C ATOM 2904 CE1 TYR B 286 -14.691 0.610 2.337 1.00 52.14 C ATOM 2905 CE2 TYR B 286 -13.263 1.084 0.489 1.00 30.05 C ATOM 2906 CZ TYR B 286 -14.340 0.427 1.022 1.00 31.02 C ATOM 2907 OH TYR B 286 -15.060 -0.412 0.245 1.00 31.04 O ATOM 0 H TYR B 286 -12.420 2.092 5.834 1.00 52.32 H new ATOM 0 HA TYR B 286 -10.434 1.684 3.711 1.00 22.04 H new ATOM 0 HB2 TYR B 286 -12.696 3.671 4.090 1.00 42.15 H new ATOM 0 HB3 TYR B 286 -11.508 3.791 2.807 1.00 42.15 H new ATOM 0 HD1 TYR B 286 -14.228 1.614 4.158 1.00 22.04 H new ATOM 0 HD2 TYR B 286 -11.678 2.452 0.849 1.00 5.13 H new ATOM 0 HE1 TYR B 286 -15.539 0.086 2.752 1.00 52.14 H new ATOM 0 HE2 TYR B 286 -12.993 0.932 -0.546 1.00 30.05 H new ATOM 0 HH TYR B 286 -16.006 -0.158 0.278 1.00 31.04 H new ATOM 2917 N HIS B 287 -8.935 3.505 4.310 1.00 5.11 N ATOM 2918 CA HIS B 287 -7.897 4.394 4.773 1.00 14.23 C ATOM 2919 C HIS B 287 -7.023 4.915 3.687 1.00 62.43 C ATOM 2920 O HIS B 287 -6.605 4.172 2.790 1.00 43.45 O ATOM 2921 CB HIS B 287 -7.089 3.848 5.991 1.00 75.22 C ATOM 2922 CG HIS B 287 -6.995 2.362 6.080 1.00 34.02 C ATOM 2923 ND1 HIS B 287 -7.427 1.670 7.187 1.00 72.23 N ATOM 2924 CD2 HIS B 287 -6.559 1.434 5.206 1.00 23.31 C ATOM 2925 CE1 HIS B 287 -7.270 0.390 6.994 1.00 52.31 C ATOM 2926 NE2 HIS B 287 -6.743 0.210 5.795 1.00 51.01 N ATOM 0 H HIS B 287 -8.705 3.012 3.447 1.00 5.11 H new ATOM 0 HA HIS B 287 -8.439 5.260 5.153 1.00 14.23 H new ATOM 0 HB2 HIS B 287 -6.080 4.257 5.949 1.00 75.22 H new ATOM 0 HB3 HIS B 287 -7.547 4.222 6.907 1.00 75.22 H new ATOM 0 HD1 HIS B 287 -7.812 2.094 8.031 1.00 72.23 H new ATOM 0 HD2 HIS B 287 -6.143 1.619 4.227 1.00 23.31 H new ATOM 0 HE1 HIS B 287 -7.527 -0.391 7.695 1.00 52.31 H new ATOM 2935 N CYS B 288 -6.780 6.186 3.770 1.00 61.41 N ATOM 2936 CA CYS B 288 -5.941 6.917 2.865 1.00 40.43 C ATOM 2937 C CYS B 288 -4.490 6.812 3.298 1.00 35.24 C ATOM 2938 O CYS B 288 -4.209 6.634 4.489 1.00 2.44 O ATOM 2939 CB CYS B 288 -6.377 8.374 2.907 1.00 41.33 C ATOM 2940 SG CYS B 288 -6.474 9.046 4.602 1.00 44.05 S ATOM 0 H CYS B 288 -7.179 6.772 4.504 1.00 61.41 H new ATOM 0 HA CYS B 288 -6.031 6.512 1.857 1.00 40.43 H new ATOM 0 HB2 CYS B 288 -5.677 8.973 2.325 1.00 41.33 H new ATOM 0 HB3 CYS B 288 -7.352 8.469 2.429 1.00 41.33 H new ATOM 2945 N GLN B 289 -3.591 6.870 2.349 1.00 54.21 N ATOM 2946 CA GLN B 289 -2.176 6.874 2.625 1.00 53.21 C ATOM 2947 C GLN B 289 -1.497 7.827 1.674 1.00 73.11 C ATOM 2948 O GLN B 289 -1.954 7.988 0.537 1.00 74.33 O ATOM 2949 CB GLN B 289 -1.568 5.446 2.576 1.00 44.43 C ATOM 2950 CG GLN B 289 -1.445 4.763 1.216 1.00 51.41 C ATOM 2951 CD GLN B 289 -0.221 5.181 0.384 1.00 0.14 C ATOM 2952 OE1 GLN B 289 -0.263 6.101 -0.413 1.00 11.34 O ATOM 2953 NE2 GLN B 289 0.870 4.490 0.573 1.00 50.00 N ATOM 0 H GLN B 289 -3.821 6.916 1.356 1.00 54.21 H new ATOM 0 HA GLN B 289 -2.009 7.221 3.645 1.00 53.21 H new ATOM 0 HB2 GLN B 289 -0.572 5.492 3.017 1.00 44.43 H new ATOM 0 HB3 GLN B 289 -2.172 4.804 3.218 1.00 44.43 H new ATOM 0 HG2 GLN B 289 -1.409 3.685 1.370 1.00 51.41 H new ATOM 0 HG3 GLN B 289 -2.346 4.972 0.639 1.00 51.41 H new ATOM 0 HE21 GLN B 289 0.878 3.724 1.247 1.00 50.00 H new ATOM 0 HE22 GLN B 289 1.714 4.716 0.047 1.00 50.00 H new ATOM 2962 N GLN B 290 -0.507 8.516 2.135 1.00 23.10 N ATOM 2963 CA GLN B 290 0.262 9.384 1.271 1.00 63.20 C ATOM 2964 C GLN B 290 1.495 8.684 0.723 1.00 0.24 C ATOM 2965 O GLN B 290 1.997 7.742 1.327 1.00 51.32 O ATOM 2966 CB GLN B 290 0.618 10.725 1.945 1.00 13.51 C ATOM 2967 CG GLN B 290 1.019 10.680 3.430 1.00 42.43 C ATOM 2968 CD GLN B 290 2.114 9.700 3.793 1.00 52.43 C ATOM 2969 OE1 GLN B 290 1.838 8.574 4.132 1.00 62.30 O ATOM 2970 NE2 GLN B 290 3.341 10.123 3.743 1.00 72.23 N ATOM 0 H GLN B 290 -0.201 8.503 3.108 1.00 23.10 H new ATOM 0 HA GLN B 290 -0.380 9.625 0.423 1.00 63.20 H new ATOM 0 HB2 GLN B 290 1.438 11.177 1.387 1.00 13.51 H new ATOM 0 HB3 GLN B 290 -0.239 11.391 1.846 1.00 13.51 H new ATOM 0 HG2 GLN B 290 1.338 11.678 3.730 1.00 42.43 H new ATOM 0 HG3 GLN B 290 0.133 10.439 4.018 1.00 42.43 H new ATOM 0 HE21 GLN B 290 3.539 11.080 3.452 1.00 72.23 H new ATOM 0 HE22 GLN B 290 4.107 9.498 3.994 1.00 72.23 H new ATOM 2979 N TYR B 291 1.966 9.118 -0.429 1.00 24.43 N ATOM 2980 CA TYR B 291 3.173 8.538 -0.985 1.00 72.32 C ATOM 2981 C TYR B 291 4.072 9.605 -1.583 1.00 41.12 C ATOM 2982 O TYR B 291 4.923 9.327 -2.429 1.00 75.21 O ATOM 2983 CB TYR B 291 2.887 7.400 -1.995 1.00 32.43 C ATOM 2984 CG TYR B 291 2.223 7.803 -3.288 1.00 11.15 C ATOM 2985 CD1 TYR B 291 0.871 7.945 -3.367 1.00 53.25 C ATOM 2986 CD2 TYR B 291 2.974 8.020 -4.440 1.00 35.23 C ATOM 2987 CE1 TYR B 291 0.265 8.299 -4.546 1.00 33.30 C ATOM 2988 CE2 TYR B 291 2.374 8.374 -5.620 1.00 25.20 C ATOM 2989 CZ TYR B 291 1.014 8.513 -5.663 1.00 1.33 C ATOM 2990 OH TYR B 291 0.399 8.878 -6.821 1.00 33.21 O ATOM 0 H TYR B 291 1.541 9.856 -0.990 1.00 24.43 H new ATOM 0 HA TYR B 291 3.706 8.077 -0.154 1.00 72.32 H new ATOM 0 HB2 TYR B 291 3.831 6.910 -2.234 1.00 32.43 H new ATOM 0 HB3 TYR B 291 2.257 6.658 -1.504 1.00 32.43 H new ATOM 0 HD1 TYR B 291 0.266 7.776 -2.488 1.00 53.25 H new ATOM 0 HD2 TYR B 291 4.047 7.907 -4.403 1.00 35.23 H new ATOM 0 HE1 TYR B 291 -0.809 8.408 -4.588 1.00 33.30 H new ATOM 0 HE2 TYR B 291 2.968 8.541 -6.506 1.00 25.20 H new ATOM 0 HH TYR B 291 -0.286 8.216 -7.050 1.00 33.21 H new ATOM 3000 N ASP B 292 3.937 10.804 -1.093 1.00 72.23 N ATOM 3001 CA ASP B 292 4.745 11.906 -1.571 1.00 20.22 C ATOM 3002 C ASP B 292 6.104 11.891 -0.844 1.00 15.32 C ATOM 3003 O ASP B 292 7.146 12.157 -1.443 1.00 3.14 O ATOM 3004 CB ASP B 292 4.028 13.245 -1.308 1.00 34.30 C ATOM 3005 CG ASP B 292 4.022 13.595 0.146 1.00 12.00 C ATOM 3006 OD1 ASP B 292 3.485 12.793 0.931 1.00 11.33 O ATOM 3007 OD2 ASP B 292 4.576 14.668 0.514 1.00 61.11 O ATOM 0 H ASP B 292 3.273 11.051 -0.359 1.00 72.23 H new ATOM 0 HA ASP B 292 4.901 11.798 -2.644 1.00 20.22 H new ATOM 0 HB2 ASP B 292 4.521 14.038 -1.871 1.00 34.30 H new ATOM 0 HB3 ASP B 292 3.002 13.186 -1.672 1.00 34.30 H new ATOM 3012 N ASN B 293 6.085 11.534 0.437 1.00 31.42 N ATOM 3013 CA ASN B 293 7.280 11.521 1.276 1.00 14.02 C ATOM 3014 C ASN B 293 7.245 10.366 2.269 1.00 34.31 C ATOM 3015 O ASN B 293 6.200 10.064 2.844 1.00 4.35 O ATOM 3016 CB ASN B 293 7.400 12.873 2.018 1.00 65.44 C ATOM 3017 CG ASN B 293 8.476 12.904 3.092 1.00 24.22 C ATOM 3018 OD1 ASN B 293 9.643 13.184 2.820 1.00 3.11 O ATOM 3019 ND2 ASN B 293 8.082 12.666 4.323 1.00 22.04 N ATOM 0 H ASN B 293 5.237 11.244 0.924 1.00 31.42 H new ATOM 0 HA ASN B 293 8.153 11.378 0.639 1.00 14.02 H new ATOM 0 HB2 ASN B 293 7.608 13.657 1.289 1.00 65.44 H new ATOM 0 HB3 ASN B 293 6.439 13.109 2.476 1.00 65.44 H new ATOM 0 HD21 ASN B 293 8.752 12.710 5.091 1.00 22.04 H new ATOM 0 HD22 ASN B 293 7.106 12.437 4.511 1.00 22.04 H new ATOM 3026 N LEU B 294 8.393 9.745 2.473 1.00 34.24 N ATOM 3027 CA LEU B 294 8.532 8.619 3.383 1.00 65.01 C ATOM 3028 C LEU B 294 8.851 9.052 4.812 1.00 72.42 C ATOM 3029 O LEU B 294 9.470 10.097 5.030 1.00 60.04 O ATOM 3030 CB LEU B 294 9.579 7.614 2.856 1.00 64.22 C ATOM 3031 CG LEU B 294 9.092 6.646 1.779 1.00 65.40 C ATOM 3032 CD1 LEU B 294 10.241 5.968 1.100 1.00 3.30 C ATOM 3033 CD2 LEU B 294 8.233 5.578 2.417 1.00 40.30 C ATOM 0 H LEU B 294 9.262 10.009 2.009 1.00 34.24 H new ATOM 0 HA LEU B 294 7.563 8.121 3.421 1.00 65.01 H new ATOM 0 HB2 LEU B 294 10.424 8.175 2.457 1.00 64.22 H new ATOM 0 HB3 LEU B 294 9.952 7.032 3.699 1.00 64.22 H new ATOM 0 HG LEU B 294 8.527 7.220 1.044 1.00 65.40 H new ATOM 0 HD11 LEU B 294 9.863 5.286 0.339 1.00 3.30 H new ATOM 0 HD12 LEU B 294 10.880 6.717 0.631 1.00 3.30 H new ATOM 0 HD13 LEU B 294 10.819 5.408 1.835 1.00 3.30 H new ATOM 0 HD21 LEU B 294 7.884 4.886 1.651 1.00 40.30 H new ATOM 0 HD22 LEU B 294 8.819 5.034 3.158 1.00 40.30 H new ATOM 0 HD23 LEU B 294 7.376 6.043 2.903 1.00 40.30 H new ATOM 3045 N PRO B 295 8.434 8.247 5.813 1.00 1.43 N ATOM 3046 CA PRO B 295 7.700 6.994 5.588 1.00 0.12 C ATOM 3047 C PRO B 295 6.234 7.223 5.205 1.00 60.54 C ATOM 3048 O PRO B 295 5.638 8.261 5.534 1.00 30.53 O ATOM 3049 CB PRO B 295 7.792 6.278 6.934 1.00 72.33 C ATOM 3050 CG PRO B 295 7.927 7.369 7.935 1.00 21.01 C ATOM 3051 CD PRO B 295 8.659 8.498 7.249 1.00 11.45 C ATOM 0 HA PRO B 295 8.121 6.429 4.756 1.00 0.12 H new ATOM 0 HB2 PRO B 295 6.904 5.675 7.123 1.00 72.33 H new ATOM 0 HB3 PRO B 295 8.648 5.604 6.966 1.00 72.33 H new ATOM 0 HG2 PRO B 295 6.948 7.698 8.284 1.00 21.01 H new ATOM 0 HG3 PRO B 295 8.478 7.025 8.810 1.00 21.01 H new ATOM 0 HD2 PRO B 295 8.267 9.469 7.551 1.00 11.45 H new ATOM 0 HD3 PRO B 295 9.721 8.492 7.494 1.00 11.45 H new ATOM 3059 N TYR B 296 5.668 6.272 4.494 1.00 4.53 N ATOM 3060 CA TYR B 296 4.292 6.357 4.105 1.00 51.04 C ATOM 3061 C TYR B 296 3.472 5.760 5.203 1.00 5.22 C ATOM 3062 O TYR B 296 3.847 4.730 5.777 1.00 1.25 O ATOM 3063 CB TYR B 296 4.021 5.614 2.790 1.00 60.13 C ATOM 3064 CG TYR B 296 4.858 6.067 1.614 1.00 63.54 C ATOM 3065 CD1 TYR B 296 5.181 7.408 1.432 1.00 61.23 C ATOM 3066 CD2 TYR B 296 5.334 5.147 0.683 1.00 52.23 C ATOM 3067 CE1 TYR B 296 5.949 7.815 0.356 1.00 34.23 C ATOM 3068 CE2 TYR B 296 6.101 5.547 -0.390 1.00 50.34 C ATOM 3069 CZ TYR B 296 6.404 6.879 -0.551 1.00 74.41 C ATOM 3070 OH TYR B 296 7.158 7.273 -1.623 1.00 60.42 O ATOM 0 H TYR B 296 6.149 5.430 4.176 1.00 4.53 H new ATOM 0 HA TYR B 296 4.031 7.402 3.940 1.00 51.04 H new ATOM 0 HB2 TYR B 296 4.193 4.550 2.950 1.00 60.13 H new ATOM 0 HB3 TYR B 296 2.968 5.732 2.534 1.00 60.13 H new ATOM 0 HD1 TYR B 296 4.827 8.142 2.141 1.00 61.23 H new ATOM 0 HD2 TYR B 296 5.098 4.100 0.804 1.00 52.23 H new ATOM 0 HE1 TYR B 296 6.191 8.859 0.226 1.00 34.23 H new ATOM 0 HE2 TYR B 296 6.462 4.818 -1.101 1.00 50.34 H new ATOM 0 HH TYR B 296 6.689 7.983 -2.110 1.00 60.42 H new ATOM 3080 N THR B 297 2.403 6.393 5.524 1.00 21.35 N ATOM 3081 CA THR B 297 1.567 5.949 6.581 1.00 42.31 C ATOM 3082 C THR B 297 0.133 5.948 6.106 1.00 33.51 C ATOM 3083 O THR B 297 -0.194 6.567 5.095 1.00 12.31 O ATOM 3084 CB THR B 297 1.675 6.887 7.816 1.00 64.54 C ATOM 3085 OG1 THR B 297 1.128 8.158 7.490 1.00 2.45 O ATOM 3086 CG2 THR B 297 3.127 7.095 8.224 1.00 73.00 C ATOM 0 H THR B 297 2.080 7.241 5.058 1.00 21.35 H new ATOM 0 HA THR B 297 1.885 4.947 6.871 1.00 42.31 H new ATOM 0 HB THR B 297 1.131 6.422 8.638 1.00 64.54 H new ATOM 0 HG1 THR B 297 1.624 8.859 7.963 1.00 2.45 H new ATOM 0 HG21 THR B 297 3.171 7.755 9.090 1.00 73.00 H new ATOM 0 HG22 THR B 297 3.575 6.134 8.477 1.00 73.00 H new ATOM 0 HG23 THR B 297 3.676 7.545 7.397 1.00 73.00 H new ATOM 3094 N PHE B 298 -0.699 5.284 6.829 1.00 12.10 N ATOM 3095 CA PHE B 298 -2.102 5.233 6.550 1.00 11.41 C ATOM 3096 C PHE B 298 -2.820 6.020 7.585 1.00 62.10 C ATOM 3097 O PHE B 298 -2.308 6.212 8.690 1.00 22.44 O ATOM 3098 CB PHE B 298 -2.622 3.803 6.657 1.00 10.34 C ATOM 3099 CG PHE B 298 -2.293 2.853 5.547 1.00 41.00 C ATOM 3100 CD1 PHE B 298 -1.040 2.795 4.961 1.00 24.21 C ATOM 3101 CD2 PHE B 298 -3.269 2.002 5.099 1.00 61.11 C ATOM 3102 CE1 PHE B 298 -0.786 1.893 3.947 1.00 33.32 C ATOM 3103 CE2 PHE B 298 -3.032 1.106 4.102 1.00 33.25 C ATOM 3104 CZ PHE B 298 -1.785 1.045 3.515 1.00 64.22 C ATOM 0 H PHE B 298 -0.423 4.747 7.651 1.00 12.10 H new ATOM 0 HA PHE B 298 -2.265 5.622 5.545 1.00 11.41 H new ATOM 0 HB2 PHE B 298 -2.241 3.377 7.585 1.00 10.34 H new ATOM 0 HB3 PHE B 298 -3.707 3.848 6.748 1.00 10.34 H new ATOM 0 HD1 PHE B 298 -0.258 3.458 5.299 1.00 24.21 H new ATOM 0 HD2 PHE B 298 -4.250 2.043 5.548 1.00 61.11 H new ATOM 0 HE1 PHE B 298 0.193 1.851 3.493 1.00 33.32 H new ATOM 0 HE2 PHE B 298 -3.819 0.444 3.771 1.00 33.25 H new ATOM 0 HZ PHE B 298 -1.592 0.338 2.722 1.00 64.22 H new ATOM 3114 N GLY B 299 -3.984 6.486 7.241 1.00 31.54 N ATOM 3115 CA GLY B 299 -4.799 7.129 8.193 1.00 1.51 C ATOM 3116 C GLY B 299 -5.441 6.112 9.089 1.00 64.05 C ATOM 3117 O GLY B 299 -5.431 4.907 8.760 1.00 51.53 O ATOM 0 H GLY B 299 -4.379 6.426 6.303 1.00 31.54 H new ATOM 0 HA2 GLY B 299 -4.202 7.823 8.785 1.00 1.51 H new ATOM 0 HA3 GLY B 299 -5.566 7.718 7.689 1.00 1.51 H new ATOM 3121 N GLN B 300 -5.999 6.587 10.191 1.00 62.20 N ATOM 3122 CA GLN B 300 -6.678 5.774 11.211 1.00 40.31 C ATOM 3123 C GLN B 300 -7.521 4.658 10.574 1.00 11.44 C ATOM 3124 O GLN B 300 -7.246 3.468 10.746 1.00 64.53 O ATOM 3125 CB GLN B 300 -7.578 6.710 12.009 1.00 55.24 C ATOM 3126 CG GLN B 300 -8.404 6.072 13.095 1.00 5.14 C ATOM 3127 CD GLN B 300 -9.313 7.085 13.744 1.00 22.25 C ATOM 3128 OE1 GLN B 300 -8.945 7.744 14.721 1.00 41.42 O ATOM 3129 NE2 GLN B 300 -10.488 7.235 13.197 1.00 71.24 N ATOM 0 H GLN B 300 -5.996 7.582 10.416 1.00 62.20 H new ATOM 0 HA GLN B 300 -5.938 5.292 11.850 1.00 40.31 H new ATOM 0 HB2 GLN B 300 -6.955 7.482 12.461 1.00 55.24 H new ATOM 0 HB3 GLN B 300 -8.253 7.211 11.315 1.00 55.24 H new ATOM 0 HG2 GLN B 300 -8.998 5.260 12.676 1.00 5.14 H new ATOM 0 HG3 GLN B 300 -7.748 5.632 13.846 1.00 5.14 H new ATOM 0 HE21 GLN B 300 -10.751 6.669 12.390 1.00 71.24 H new ATOM 0 HE22 GLN B 300 -11.144 7.918 13.576 1.00 71.24 H new ATOM 3138 N GLY B 301 -8.505 5.051 9.817 1.00 31.41 N ATOM 3139 CA GLY B 301 -9.354 4.105 9.181 1.00 43.21 C ATOM 3140 C GLY B 301 -10.795 4.412 9.423 1.00 35.41 C ATOM 3141 O GLY B 301 -11.202 4.665 10.563 1.00 62.00 O ATOM 0 H GLY B 301 -8.734 6.027 9.629 1.00 31.41 H new ATOM 0 HA2 GLY B 301 -9.157 4.101 8.109 1.00 43.21 H new ATOM 0 HA3 GLY B 301 -9.127 3.105 9.551 1.00 43.21 H new ATOM 3145 N THR B 302 -11.546 4.425 8.374 1.00 75.13 N ATOM 3146 CA THR B 302 -12.943 4.630 8.452 1.00 24.21 C ATOM 3147 C THR B 302 -13.622 3.289 8.295 1.00 41.01 C ATOM 3148 O THR B 302 -13.399 2.574 7.306 1.00 70.35 O ATOM 3149 CB THR B 302 -13.407 5.583 7.331 1.00 12.30 C ATOM 3150 OG1 THR B 302 -12.765 6.860 7.484 1.00 20.05 O ATOM 3151 CG2 THR B 302 -14.928 5.758 7.320 1.00 25.35 C ATOM 0 H THR B 302 -11.196 4.291 7.425 1.00 75.13 H new ATOM 0 HA THR B 302 -13.201 5.079 9.411 1.00 24.21 H new ATOM 0 HB THR B 302 -13.123 5.138 6.377 1.00 12.30 H new ATOM 0 HG1 THR B 302 -13.382 7.486 7.918 1.00 20.05 H new ATOM 0 HG21 THR B 302 -15.210 6.437 6.515 1.00 25.35 H new ATOM 0 HG22 THR B 302 -15.404 4.790 7.163 1.00 25.35 H new ATOM 0 HG23 THR B 302 -15.254 6.172 8.274 1.00 25.35 H new ATOM 3159 N LYS B 303 -14.413 2.946 9.261 1.00 14.25 N ATOM 3160 CA LYS B 303 -15.126 1.709 9.251 1.00 30.02 C ATOM 3161 C LYS B 303 -16.445 1.944 8.514 1.00 65.13 C ATOM 3162 O LYS B 303 -17.262 2.781 8.920 1.00 54.03 O ATOM 3163 CB LYS B 303 -15.282 1.219 10.722 1.00 52.11 C ATOM 3164 CG LYS B 303 -15.879 -0.171 10.951 1.00 23.40 C ATOM 3165 CD LYS B 303 -17.361 -0.234 10.692 1.00 44.31 C ATOM 3166 CE LYS B 303 -18.144 0.697 11.621 1.00 51.44 C ATOM 3167 NZ LYS B 303 -17.917 0.395 13.056 1.00 20.22 N ATOM 0 H LYS B 303 -14.584 3.521 10.086 1.00 14.25 H new ATOM 0 HA LYS B 303 -14.603 0.913 8.722 1.00 30.02 H new ATOM 0 HB2 LYS B 303 -14.297 1.242 11.189 1.00 52.11 H new ATOM 0 HB3 LYS B 303 -15.903 1.942 11.252 1.00 52.11 H new ATOM 0 HG2 LYS B 303 -15.373 -0.887 10.303 1.00 23.40 H new ATOM 0 HG3 LYS B 303 -15.684 -0.478 11.979 1.00 23.40 H new ATOM 0 HD2 LYS B 303 -17.560 0.037 9.655 1.00 44.31 H new ATOM 0 HD3 LYS B 303 -17.710 -1.258 10.826 1.00 44.31 H new ATOM 0 HE2 LYS B 303 -17.857 1.729 11.421 1.00 51.44 H new ATOM 0 HE3 LYS B 303 -19.208 0.614 11.400 1.00 51.44 H new ATOM 0 HZ1 LYS B 303 -18.581 0.947 13.636 1.00 20.22 H new ATOM 0 HZ2 LYS B 303 -18.070 -0.620 13.226 1.00 20.22 H new ATOM 0 HZ3 LYS B 303 -16.941 0.646 13.313 1.00 20.22 H new ATOM 3181 N LEU B 304 -16.629 1.240 7.428 1.00 13.51 N ATOM 3182 CA LEU B 304 -17.765 1.455 6.552 1.00 34.41 C ATOM 3183 C LEU B 304 -18.821 0.395 6.831 1.00 22.02 C ATOM 3184 O LEU B 304 -18.493 -0.788 6.985 1.00 32.54 O ATOM 3185 CB LEU B 304 -17.257 1.372 5.080 1.00 51.20 C ATOM 3186 CG LEU B 304 -18.169 1.884 3.926 1.00 20.54 C ATOM 3187 CD1 LEU B 304 -19.437 1.069 3.759 1.00 52.40 C ATOM 3188 CD2 LEU B 304 -18.493 3.358 4.107 1.00 74.03 C ATOM 0 H LEU B 304 -15.999 0.499 7.120 1.00 13.51 H new ATOM 0 HA LEU B 304 -18.217 2.432 6.723 1.00 34.41 H new ATOM 0 HB2 LEU B 304 -16.319 1.925 5.026 1.00 51.20 H new ATOM 0 HB3 LEU B 304 -17.023 0.328 4.873 1.00 51.20 H new ATOM 0 HG LEU B 304 -17.600 1.757 3.005 1.00 20.54 H new ATOM 0 HD11 LEU B 304 -20.027 1.478 2.939 1.00 52.40 H new ATOM 0 HD12 LEU B 304 -19.178 0.034 3.538 1.00 52.40 H new ATOM 0 HD13 LEU B 304 -20.019 1.109 4.680 1.00 52.40 H new ATOM 0 HD21 LEU B 304 -19.131 3.693 3.289 1.00 74.03 H new ATOM 0 HD22 LEU B 304 -19.012 3.503 5.055 1.00 74.03 H new ATOM 0 HD23 LEU B 304 -17.569 3.936 4.107 1.00 74.03 H new ATOM 3200 N GLU B 305 -20.073 0.821 6.935 1.00 3.01 N ATOM 3201 CA GLU B 305 -21.175 -0.092 7.139 1.00 42.34 C ATOM 3202 C GLU B 305 -22.301 0.232 6.205 1.00 22.33 C ATOM 3203 O GLU B 305 -22.565 1.399 5.916 1.00 53.02 O ATOM 3204 CB GLU B 305 -21.732 -0.003 8.546 1.00 63.34 C ATOM 3205 CG GLU B 305 -20.727 -0.221 9.604 1.00 11.22 C ATOM 3206 CD GLU B 305 -21.338 -0.329 10.965 1.00 72.23 C ATOM 3207 OE1 GLU B 305 -21.547 0.694 11.623 1.00 3.12 O ATOM 3208 OE2 GLU B 305 -21.613 -1.456 11.406 1.00 74.43 O ATOM 0 H GLU B 305 -20.345 1.802 6.880 1.00 3.01 H new ATOM 0 HA GLU B 305 -20.782 -1.092 6.958 1.00 42.34 H new ATOM 0 HB2 GLU B 305 -22.184 0.979 8.685 1.00 63.34 H new ATOM 0 HB3 GLU B 305 -22.528 -0.739 8.658 1.00 63.34 H new ATOM 0 HG2 GLU B 305 -20.169 -1.132 9.387 1.00 11.22 H new ATOM 0 HG3 GLU B 305 -20.012 0.601 9.595 1.00 11.22 H new ATOM 3215 N ILE B 306 -22.960 -0.769 5.729 1.00 10.21 N ATOM 3216 CA ILE B 306 -24.148 -0.554 4.974 1.00 70.20 C ATOM 3217 C ILE B 306 -25.339 -0.673 5.886 1.00 23.00 C ATOM 3218 O ILE B 306 -25.588 -1.731 6.483 1.00 73.40 O ATOM 3219 CB ILE B 306 -24.263 -1.494 3.752 1.00 64.34 C ATOM 3220 CG1 ILE B 306 -23.277 -1.051 2.671 1.00 30.53 C ATOM 3221 CG2 ILE B 306 -25.687 -1.508 3.196 1.00 52.44 C ATOM 3222 CD1 ILE B 306 -23.232 -1.960 1.479 1.00 12.11 C ATOM 0 H ILE B 306 -22.696 -1.747 5.849 1.00 10.21 H new ATOM 0 HA ILE B 306 -24.110 0.453 4.558 1.00 70.20 H new ATOM 0 HB ILE B 306 -24.021 -2.508 4.072 1.00 64.34 H new ATOM 0 HG12 ILE B 306 -23.543 -0.047 2.340 1.00 30.53 H new ATOM 0 HG13 ILE B 306 -22.280 -0.989 3.106 1.00 30.53 H new ATOM 0 HG21 ILE B 306 -25.736 -2.178 2.338 1.00 52.44 H new ATOM 0 HG22 ILE B 306 -26.375 -1.855 3.967 1.00 52.44 H new ATOM 0 HG23 ILE B 306 -25.967 -0.501 2.887 1.00 52.44 H new ATOM 0 HD11 ILE B 306 -22.510 -1.578 0.757 1.00 12.11 H new ATOM 0 HD12 ILE B 306 -22.935 -2.960 1.795 1.00 12.11 H new ATOM 0 HD13 ILE B 306 -24.218 -2.003 1.017 1.00 12.11 H new ATOM 3234 N LYS B 307 -26.061 0.399 5.998 1.00 44.44 N ATOM 3235 CA LYS B 307 -27.196 0.470 6.855 1.00 34.43 C ATOM 3236 C LYS B 307 -28.430 0.175 6.053 1.00 15.54 C ATOM 3237 O LYS B 307 -28.426 0.293 4.818 1.00 40.12 O ATOM 3238 CB LYS B 307 -27.352 1.856 7.467 1.00 73.31 C ATOM 3239 CG LYS B 307 -27.808 2.869 6.507 1.00 43.44 C ATOM 3240 CD LYS B 307 -28.150 4.133 7.193 1.00 61.33 C ATOM 3241 CE LYS B 307 -28.871 4.993 6.244 1.00 34.32 C ATOM 3242 NZ LYS B 307 -30.222 4.442 5.887 1.00 73.04 N ATOM 0 H LYS B 307 -25.872 1.261 5.487 1.00 44.44 H new ATOM 0 HA LYS B 307 -27.057 -0.255 7.657 1.00 34.43 H new ATOM 0 HB2 LYS B 307 -28.062 1.803 8.293 1.00 73.31 H new ATOM 0 HB3 LYS B 307 -26.396 2.169 7.888 1.00 73.31 H new ATOM 0 HG2 LYS B 307 -27.028 3.052 5.768 1.00 43.44 H new ATOM 0 HG3 LYS B 307 -28.679 2.497 5.967 1.00 43.44 H new ATOM 0 HD2 LYS B 307 -28.767 3.934 8.070 1.00 61.33 H new ATOM 0 HD3 LYS B 307 -27.246 4.630 7.545 1.00 61.33 H new ATOM 0 HE2 LYS B 307 -28.989 5.987 6.675 1.00 34.32 H new ATOM 0 HE3 LYS B 307 -28.277 5.108 5.337 1.00 34.32 H new ATOM 0 HZ1 LYS B 307 -30.860 5.224 5.636 1.00 73.04 H new ATOM 0 HZ2 LYS B 307 -30.131 3.796 5.077 1.00 73.04 H new ATOM 0 HZ3 LYS B 307 -30.612 3.924 6.700 1.00 73.04 H new ATOM 3256 N ARG B 308 -29.451 -0.238 6.714 1.00 30.21 N ATOM 3257 CA ARG B 308 -30.698 -0.402 6.065 1.00 11.15 C ATOM 3258 C ARG B 308 -31.470 0.899 6.178 1.00 43.12 C ATOM 3259 O ARG B 308 -31.369 1.738 5.260 1.00 37.39 O ATOM 3260 CB ARG B 308 -31.500 -1.579 6.631 1.00 42.12 C ATOM 3261 CG ARG B 308 -30.823 -2.940 6.467 1.00 54.11 C ATOM 3262 CD ARG B 308 -30.445 -3.204 5.010 1.00 21.33 C ATOM 3263 NE ARG B 308 -31.590 -3.051 4.101 1.00 32.03 N ATOM 3264 CZ ARG B 308 -31.504 -2.937 2.773 1.00 41.25 C ATOM 3265 NH1 ARG B 308 -30.323 -3.031 2.162 1.00 55.32 N ATOM 3266 NH2 ARG B 308 -32.601 -2.736 2.061 1.00 31.23 N ATOM 3267 OXT ARG B 308 -32.127 1.110 7.201 1.00 37.39 O ATOM 0 H ARG B 308 -29.446 -0.469 7.708 1.00 30.21 H new ATOM 0 HA ARG B 308 -30.522 -0.641 5.016 1.00 11.15 H new ATOM 0 HB2 ARG B 308 -31.682 -1.403 7.691 1.00 42.12 H new ATOM 0 HB3 ARG B 308 -32.473 -1.609 6.141 1.00 42.12 H new ATOM 0 HG2 ARG B 308 -29.929 -2.980 7.089 1.00 54.11 H new ATOM 0 HG3 ARG B 308 -31.492 -3.725 6.819 1.00 54.11 H new ATOM 0 HD2 ARG B 308 -29.653 -2.517 4.712 1.00 21.33 H new ATOM 0 HD3 ARG B 308 -30.043 -4.213 4.918 1.00 21.33 H new ATOM 0 HE ARG B 308 -32.521 -3.030 4.516 1.00 32.03 H new ATOM 0 HH11 ARG B 308 -29.477 -3.191 2.709 1.00 55.32 H new ATOM 0 HH12 ARG B 308 -30.265 -2.943 1.147 1.00 55.32 H new ATOM 0 HH21 ARG B 308 -33.506 -2.669 2.527 1.00 31.23 H new ATOM 0 HH22 ARG B 308 -32.542 -2.648 1.047 1.00 31.23 H new