USER MOD reduce.3.24.130724 H: found=0, std=0, add=890, rem=0, adj=30 USER MOD reduce.3.24.130724 removed 891 hydrogens (11 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 NoAdj-H: A 101 PTR HN2 : A 101 PTR N : A 100 ACE C :(H bumps) USER MOD NoAdj-H: A 101 PTR H : A 101 PTR N : A 100 ACE C :(H bumps) USER MOD Set 1.1: B 242 THR OG1 : rot 180:sc= -1.38! USER MOD Set 1.2: B 243 THR OG1 : rot 180:sc= -0.249 USER MOD Set 2.1: B 177 SER OG : rot -146:sc= 0.449 USER MOD Set 2.2: B 179 THR OG1 : rot 180:sc= 0 USER MOD Set 2.3: B 180 THR OG1 : rot 180:sc= 0.296 USER MOD Set 3.1: B 142 SER OG : rot 150:sc= 0 USER MOD Set 3.2: B 144 GLN : amide:sc= -0.464 K(o=-0.46,f=-3.5!) USER MOD Single : B 140 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : B 149 TYR OH : rot -16:sc= 0.176 USER MOD Single : B 152 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 154 THR OG1 : rot 180:sc= 0.34 USER MOD Single : B 158 SER OG : rot 180:sc= 0 USER MOD Single : B 164 ASN : amide:sc= -0.271 X(o=-0.27,f=-0.035) USER MOD Single : B 167 ASN : amide:sc= -1.77 K(o=-1.8,f=-3.3!) USER MOD Single : B 171 THR OG1 : rot 70:sc= -0.933 USER MOD Single : B 181 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 184 TYR OH : rot 180:sc= 0 USER MOD Single : B 185 CYS SG : rot -42:sc= -1.14! USER MOD Single : B 187 SER OG : rot 180:sc= 0 USER MOD Single : B 189 SER OG : rot -64:sc= -0.865 USER MOD Single : B 193 ASN : amide:sc= -0.505 K(o=-0.51,f=-3.7!) USER MOD Single : B 195 LYS NZ :NH3+ 147:sc= -0.0749 (180deg=-0.725) USER MOD Single : B 198 ASN :FLIP amide:sc= -0.693 F(o=-1.7,f=-0.69) USER MOD Single : B 200 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 201 HIS : no HE2:sc= -0.991 X(o=-0.99,f=-0.98) USER MOD Single : B 202 TYR OH : rot 115:sc= 0.938 USER MOD Single : B 203 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 206 LYS NZ :NH3+ -166:sc= -1.62! (180deg=-1.66!) USER MOD Single : B 209 SER OG : rot 180:sc= -0.827 USER MOD Single : B 213 TYR OH : rot 180:sc= 0 USER MOD Single : B 215 THR OG1 : rot -146:sc= -3.87! USER MOD Single : B 216 SER OG : rot 180:sc= 0 USER MOD Single : B 218 THR OG1 : rot 180:sc= 0 USER MOD Single : B 219 GLN : amide:sc= -8.15! C(o=-8.2!,f=-16!) USER MOD Single : B 221 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : B 222 SER OG : rot 180:sc= -1.5! USER MOD Single : B 224 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : B 225 GLN : amide:sc= 0.108 K(o=0.11,f=-2.5!) USER MOD Single : B 229 TYR OH : rot 180:sc= 0 USER MOD Single : B 230 TYR OH : rot 99:sc= 0.0659 USER MOD Single : B 231 SER OG : rot 104:sc= -5.96! USER MOD Single : B 232 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 233 HIS : no HD1:sc= 0 X(o=0,f=-0.016) USER MOD Single : B 238 CYS SG : rot 87:sc= -1.86! USER MOD Single : B 239 HIS : no HD1:sc= -4.66! C(o=-4.7!,f=-4.6!) USER MOD Single : B 245 CYS SG : rot -53:sc= -8.27! USER MOD ----------------------------------------------------------------- HETATM 1 C ACE A 100 1.067 0.769 12.018 1.00 14.10 C HETATM 2 O ACE A 100 2.067 0.918 11.343 1.00 14.64 O HETATM 3 CH3 ACE A 100 1.154 0.294 13.471 1.00 14.17 C HETATM 0 H1 ACE A 100 0.721 1.049 14.127 1.00 14.17 H new HETATM 0 H2 ACE A 100 0.605 -0.641 13.582 1.00 14.17 H new HETATM 0 H3 ACE A 100 2.198 0.135 13.740 1.00 14.17 H new HETATM 7 N PTR A 101 -0.120 1.008 11.533 1.00 14.28 N HETATM 8 CA PTR A 101 -0.268 1.473 10.124 1.00 13.54 C HETATM 9 C PTR A 101 -0.469 2.990 10.106 1.00 14.12 C HETATM 10 O PTR A 101 -1.068 3.558 10.998 1.00 13.97 O HETATM 11 CB PTR A 101 -1.480 0.790 9.486 1.00 13.83 C HETATM 12 CG PTR A 101 -1.135 -0.639 9.143 1.00 12.91 C HETATM 13 CD1 PTR A 101 -0.507 -0.936 7.921 1.00 12.17 C HETATM 14 CD2 PTR A 101 -1.443 -1.672 10.043 1.00 12.70 C HETATM 15 CE1 PTR A 101 -0.187 -2.266 7.601 1.00 12.08 C HETATM 16 CE2 PTR A 101 -1.124 -3.002 9.722 1.00 11.44 C HETATM 17 CZ PTR A 101 -0.496 -3.300 8.501 1.00 13.78 C HETATM 18 OH PTR A 101 -0.171 -4.654 8.174 1.00 14.51 O HETATM 19 P PTR A 101 1.294 -5.246 8.478 1.00 17.94 P HETATM 20 O1P PTR A 101 1.018 -6.654 8.842 1.00 18.17 O HETATM 21 O2P PTR A 101 1.777 -4.396 9.589 1.00 15.88 O HETATM 22 O3P PTR A 101 2.005 -5.061 7.194 1.00 18.41 O HETATM 0 HE2 PTR A 101 -1.364 -3.803 10.421 1.00 11.44 H new HETATM 0 HE1 PTR A 101 0.301 -2.496 6.654 1.00 12.08 H new HETATM 0 HD2 PTR A 101 -1.930 -1.442 10.991 1.00 12.70 H new HETATM 0 HD1 PTR A 101 -0.268 -0.135 7.222 1.00 12.17 H new HETATM 0 HB3 PTR A 101 -2.327 0.815 10.172 1.00 13.83 H new HETATM 0 HB2 PTR A 101 -1.781 1.328 8.587 1.00 13.83 H new HETATM 0 HA PTR A 101 0.630 1.219 9.561 1.00 13.54 H new ATOM 31 N GLU A 102 0.029 3.651 9.096 1.00 15.01 N ATOM 32 CA GLU A 102 -0.132 5.130 9.020 1.00 18.67 C ATOM 33 C GLU A 102 -1.612 5.492 9.157 1.00 23.30 C ATOM 34 O GLU A 102 -2.454 4.638 9.363 1.00 23.42 O ATOM 35 CB GLU A 102 0.392 5.630 7.672 1.00 18.41 C ATOM 36 CG GLU A 102 1.915 5.487 7.631 1.00 20.30 C ATOM 37 CD GLU A 102 2.564 6.822 7.999 1.00 19.75 C ATOM 38 OE1 GLU A 102 2.516 7.727 7.182 1.00 19.69 O ATOM 39 OE2 GLU A 102 3.098 6.916 9.092 1.00 21.81 O ATOM 0 H GLU A 102 0.540 3.230 8.320 1.00 15.01 H new ATOM 0 HA GLU A 102 0.432 5.598 9.827 1.00 18.67 H new ATOM 0 HB2 GLU A 102 -0.059 5.060 6.860 1.00 18.41 H new ATOM 0 HB3 GLU A 102 0.110 6.672 7.524 1.00 18.41 H new ATOM 0 HG2 GLU A 102 2.237 4.711 8.325 1.00 20.30 H new ATOM 0 HG3 GLU A 102 2.235 5.177 6.636 1.00 20.30 H new ATOM 46 N GLU A 103 -1.938 6.751 9.048 1.00 29.30 N ATOM 47 CA GLU A 103 -3.363 7.168 9.173 1.00 35.63 C ATOM 48 C GLU A 103 -3.635 8.347 8.238 1.00 37.94 C ATOM 49 O GLU A 103 -2.877 9.296 8.185 1.00 40.44 O ATOM 50 CB GLU A 103 -3.644 7.588 10.617 1.00 38.84 C ATOM 51 CG GLU A 103 -3.970 6.350 11.456 1.00 44.99 C ATOM 52 CD GLU A 103 -5.210 6.624 12.310 1.00 50.48 C ATOM 53 OE1 GLU A 103 -5.203 7.609 13.030 1.00 53.57 O ATOM 54 OE2 GLU A 103 -6.145 5.844 12.229 1.00 53.04 O ATOM 0 H GLU A 103 -1.278 7.510 8.878 1.00 29.30 H new ATOM 0 HA GLU A 103 -4.011 6.334 8.902 1.00 35.63 H new ATOM 0 HB2 GLU A 103 -2.778 8.103 11.032 1.00 38.84 H new ATOM 0 HB3 GLU A 103 -4.477 8.290 10.647 1.00 38.84 H new ATOM 0 HG2 GLU A 103 -4.145 5.493 10.806 1.00 44.99 H new ATOM 0 HG3 GLU A 103 -3.124 6.098 12.095 1.00 44.99 H new ATOM 61 N ILE A 104 -4.710 8.298 7.499 1.00 39.26 N ATOM 62 CA ILE A 104 -5.028 9.418 6.569 1.00 40.91 C ATOM 63 C ILE A 104 -5.799 10.502 7.324 1.00 42.72 C ATOM 64 O ILE A 104 -7.006 10.438 7.460 1.00 43.33 O ATOM 65 CB ILE A 104 -5.883 8.897 5.413 1.00 40.30 C ATOM 66 CG1 ILE A 104 -5.055 7.934 4.559 1.00 39.28 C ATOM 67 CG2 ILE A 104 -6.344 10.073 4.549 1.00 41.44 C ATOM 68 CD1 ILE A 104 -3.935 8.706 3.859 1.00 37.66 C ATOM 0 H ILE A 104 -5.382 7.530 7.499 1.00 39.26 H new ATOM 0 HA ILE A 104 -4.102 9.836 6.175 1.00 40.91 H new ATOM 0 HB ILE A 104 -6.752 8.375 5.812 1.00 40.30 H new ATOM 0 HG12 ILE A 104 -4.633 7.148 5.185 1.00 39.28 H new ATOM 0 HG13 ILE A 104 -5.692 7.447 3.821 1.00 39.28 H new ATOM 0 HG21 ILE A 104 -6.953 9.702 3.725 1.00 41.44 H new ATOM 0 HG22 ILE A 104 -6.933 10.761 5.155 1.00 41.44 H new ATOM 0 HG23 ILE A 104 -5.474 10.595 4.151 1.00 41.44 H new ATOM 0 HD11 ILE A 104 -3.345 8.020 3.251 1.00 37.66 H new ATOM 0 HD12 ILE A 104 -4.368 9.476 3.221 1.00 37.66 H new ATOM 0 HD13 ILE A 104 -3.293 9.172 4.606 1.00 37.66 H new ATOM 80 N GLU A 105 -5.115 11.497 7.817 1.00 0.00 N ATOM 81 CA GLU A 105 -5.811 12.582 8.563 1.00 0.00 C ATOM 82 C GLU A 105 -5.166 13.928 8.224 1.00 0.00 C ATOM 83 O GLU A 105 -5.053 14.229 7.047 1.00 0.00 O ATOM 84 CB GLU A 105 -5.692 12.324 10.066 1.00 0.00 C ATOM 85 CG GLU A 105 -6.640 11.191 10.466 1.00 0.00 C ATOM 86 CD GLU A 105 -8.078 11.714 10.489 1.00 0.00 C ATOM 87 OE1 GLU A 105 -8.388 12.500 11.369 1.00 0.00 O ATOM 88 OE2 GLU A 105 -8.846 11.318 9.627 1.00 0.00 O ATOM 89 OXT GLU A 105 -4.798 14.636 9.147 1.00 0.00 O ATOM 0 H GLU A 105 -4.104 11.606 7.735 1.00 0.00 H new ATOM 0 HA GLU A 105 -6.863 12.601 8.280 1.00 0.00 H new ATOM 0 HB2 GLU A 105 -4.665 12.060 10.320 1.00 0.00 H new ATOM 0 HB3 GLU A 105 -5.936 13.230 10.622 1.00 0.00 H new ATOM 0 HG2 GLU A 105 -6.554 10.364 9.761 1.00 0.00 H new ATOM 0 HG3 GLU A 105 -6.367 10.803 11.447 1.00 0.00 H new TER 96 GLU A 105 ATOM 97 N MET B 140 -8.281 -7.295 -19.186 1.00 0.00 N ATOM 98 CA MET B 140 -7.344 -8.358 -18.726 1.00 0.00 C ATOM 99 C MET B 140 -6.606 -7.879 -17.474 1.00 0.00 C ATOM 100 O MET B 140 -5.462 -7.475 -17.533 1.00 0.00 O ATOM 101 CB MET B 140 -6.330 -8.659 -19.831 1.00 0.00 C ATOM 102 CG MET B 140 -7.050 -9.281 -21.030 1.00 0.00 C ATOM 103 SD MET B 140 -5.841 -10.089 -22.106 1.00 0.00 S ATOM 104 CE MET B 140 -6.824 -10.043 -23.626 1.00 0.00 C ATOM 0 HA MET B 140 -7.907 -9.262 -18.494 1.00 0.00 H new ATOM 0 HB2 MET B 140 -5.823 -7.743 -20.133 1.00 0.00 H new ATOM 0 HB3 MET B 140 -5.564 -9.340 -19.460 1.00 0.00 H new ATOM 0 HG2 MET B 140 -7.790 -10.005 -20.688 1.00 0.00 H new ATOM 0 HG3 MET B 140 -7.589 -8.512 -21.583 1.00 0.00 H new ATOM 0 HE1 MET B 140 -6.259 -10.500 -24.439 1.00 0.00 H new ATOM 0 HE2 MET B 140 -7.753 -10.594 -23.476 1.00 0.00 H new ATOM 0 HE3 MET B 140 -7.053 -9.008 -23.880 1.00 0.00 H new ATOM 116 N ASP B 141 -7.251 -7.922 -16.340 1.00 0.00 N ATOM 117 CA ASP B 141 -6.585 -7.470 -15.086 1.00 0.00 C ATOM 118 C ASP B 141 -7.143 -8.258 -13.899 1.00 0.00 C ATOM 119 O ASP B 141 -7.657 -7.694 -12.954 1.00 0.00 O ATOM 120 CB ASP B 141 -6.851 -5.977 -14.878 1.00 0.00 C ATOM 121 CG ASP B 141 -5.541 -5.201 -15.012 1.00 0.00 C ATOM 122 OD1 ASP B 141 -4.692 -5.357 -14.150 1.00 0.00 O ATOM 123 OD2 ASP B 141 -5.408 -4.464 -15.976 1.00 0.00 O ATOM 0 H ASP B 141 -8.210 -8.251 -16.228 1.00 0.00 H new ATOM 0 HA ASP B 141 -5.511 -7.641 -15.162 1.00 0.00 H new ATOM 0 HB2 ASP B 141 -7.574 -5.620 -15.612 1.00 0.00 H new ATOM 0 HB3 ASP B 141 -7.287 -5.808 -13.893 1.00 0.00 H new ATOM 128 N SER B 142 -7.046 -9.558 -13.940 1.00 0.00 N ATOM 129 CA SER B 142 -7.571 -10.381 -12.814 1.00 0.00 C ATOM 130 C SER B 142 -6.968 -9.887 -11.497 1.00 0.00 C ATOM 131 O SER B 142 -5.777 -9.669 -11.392 1.00 0.00 O ATOM 132 CB SER B 142 -7.189 -11.845 -13.031 1.00 0.00 C ATOM 133 OG SER B 142 -8.268 -12.677 -12.624 1.00 0.00 O ATOM 0 H SER B 142 -6.626 -10.086 -14.705 1.00 0.00 H new ATOM 0 HA SER B 142 -8.657 -10.291 -12.774 1.00 0.00 H new ATOM 0 HB2 SER B 142 -6.956 -12.020 -14.081 1.00 0.00 H new ATOM 0 HB3 SER B 142 -6.292 -12.087 -12.460 1.00 0.00 H new ATOM 0 HG SER B 142 -8.268 -13.498 -13.159 1.00 0.00 H new ATOM 139 N ILE B 143 -7.780 -9.709 -10.493 1.00 0.00 N ATOM 140 CA ILE B 143 -7.253 -9.230 -9.183 1.00 0.00 C ATOM 141 C ILE B 143 -6.304 -10.279 -8.600 1.00 0.00 C ATOM 142 O ILE B 143 -5.340 -9.957 -7.934 1.00 0.00 O ATOM 143 CB ILE B 143 -8.416 -9.003 -8.217 1.00 0.00 C ATOM 144 CG1 ILE B 143 -7.866 -8.690 -6.824 1.00 0.00 C ATOM 145 CG2 ILE B 143 -9.281 -10.263 -8.152 1.00 0.00 C ATOM 146 CD1 ILE B 143 -8.906 -7.897 -6.029 1.00 0.00 C ATOM 0 H ILE B 143 -8.786 -9.874 -10.522 1.00 0.00 H new ATOM 0 HA ILE B 143 -6.714 -8.294 -9.330 1.00 0.00 H new ATOM 0 HB ILE B 143 -9.021 -8.166 -8.567 1.00 0.00 H new ATOM 0 HG12 ILE B 143 -7.622 -9.615 -6.302 1.00 0.00 H new ATOM 0 HG13 ILE B 143 -6.942 -8.117 -6.907 1.00 0.00 H new ATOM 0 HG21 ILE B 143 -10.110 -10.100 -7.463 1.00 0.00 H new ATOM 0 HG22 ILE B 143 -9.673 -10.487 -9.144 1.00 0.00 H new ATOM 0 HG23 ILE B 143 -8.678 -11.101 -7.802 1.00 0.00 H new ATOM 0 HD11 ILE B 143 -8.513 -7.675 -5.037 1.00 0.00 H new ATOM 0 HD12 ILE B 143 -9.128 -6.965 -6.549 1.00 0.00 H new ATOM 0 HD13 ILE B 143 -9.818 -8.486 -5.934 1.00 0.00 H new ATOM 158 N GLN B 144 -6.569 -11.533 -8.846 1.00 0.00 N ATOM 159 CA GLN B 144 -5.683 -12.602 -8.307 1.00 0.00 C ATOM 160 C GLN B 144 -4.264 -12.410 -8.846 1.00 0.00 C ATOM 161 O GLN B 144 -3.300 -12.867 -8.264 1.00 0.00 O ATOM 162 CB GLN B 144 -6.212 -13.971 -8.739 1.00 0.00 C ATOM 163 CG GLN B 144 -6.520 -13.948 -10.237 1.00 0.00 C ATOM 164 CD GLN B 144 -5.937 -15.198 -10.899 1.00 0.00 C ATOM 165 OE1 GLN B 144 -5.108 -15.873 -10.321 1.00 0.00 O ATOM 166 NE2 GLN B 144 -6.336 -15.536 -12.094 1.00 0.00 N ATOM 0 H GLN B 144 -7.361 -11.863 -9.397 1.00 0.00 H new ATOM 0 HA GLN B 144 -5.669 -12.546 -7.219 1.00 0.00 H new ATOM 0 HB2 GLN B 144 -5.475 -14.743 -8.520 1.00 0.00 H new ATOM 0 HB3 GLN B 144 -7.111 -14.220 -8.176 1.00 0.00 H new ATOM 0 HG2 GLN B 144 -7.598 -13.908 -10.397 1.00 0.00 H new ATOM 0 HG3 GLN B 144 -6.097 -13.052 -10.692 1.00 0.00 H new ATOM 0 HE21 GLN B 144 -7.032 -14.969 -12.579 1.00 0.00 H new ATOM 0 HE22 GLN B 144 -5.952 -16.367 -12.544 1.00 0.00 H new ATOM 175 N ALA B 145 -4.128 -11.737 -9.957 1.00 42.36 N ATOM 176 CA ALA B 145 -2.772 -11.518 -10.533 1.00 39.52 C ATOM 177 C ALA B 145 -2.573 -10.027 -10.818 1.00 36.36 C ATOM 178 O ALA B 145 -2.365 -9.623 -11.945 1.00 36.34 O ATOM 179 CB ALA B 145 -2.638 -12.307 -11.837 1.00 40.62 C ATOM 0 H ALA B 145 -4.897 -11.330 -10.489 1.00 42.36 H new ATOM 0 HA ALA B 145 -2.017 -11.857 -9.823 1.00 39.52 H new ATOM 0 HB1 ALA B 145 -1.646 -12.147 -12.259 1.00 40.62 H new ATOM 0 HB2 ALA B 145 -2.780 -13.369 -11.636 1.00 40.62 H new ATOM 0 HB3 ALA B 145 -3.393 -11.968 -12.547 1.00 40.62 H new ATOM 185 N GLU B 146 -2.635 -9.206 -9.805 1.00 32.22 N ATOM 186 CA GLU B 146 -2.449 -7.743 -10.021 1.00 28.03 C ATOM 187 C GLU B 146 -0.955 -7.430 -10.127 1.00 24.38 C ATOM 188 O GLU B 146 -0.120 -8.175 -9.653 1.00 22.48 O ATOM 189 CB GLU B 146 -3.050 -6.973 -8.843 1.00 27.81 C ATOM 190 CG GLU B 146 -4.415 -6.410 -9.244 1.00 30.44 C ATOM 191 CD GLU B 146 -4.251 -5.481 -10.449 1.00 31.15 C ATOM 192 OE1 GLU B 146 -3.945 -4.319 -10.237 1.00 34.56 O ATOM 193 OE2 GLU B 146 -4.433 -5.948 -11.560 1.00 30.91 O ATOM 0 H GLU B 146 -2.806 -9.485 -8.839 1.00 32.22 H new ATOM 0 HA GLU B 146 -2.949 -7.445 -10.942 1.00 28.03 H new ATOM 0 HB2 GLU B 146 -3.155 -7.631 -7.981 1.00 27.81 H new ATOM 0 HB3 GLU B 146 -2.384 -6.163 -8.546 1.00 27.81 H new ATOM 0 HG2 GLU B 146 -5.098 -7.223 -9.489 1.00 30.44 H new ATOM 0 HG3 GLU B 146 -4.855 -5.865 -8.409 1.00 30.44 H new ATOM 200 N GLU B 147 -0.611 -6.334 -10.745 1.00 21.92 N ATOM 201 CA GLU B 147 0.829 -5.976 -10.881 1.00 21.70 C ATOM 202 C GLU B 147 1.408 -5.651 -9.502 1.00 19.46 C ATOM 203 O GLU B 147 2.603 -5.699 -9.293 1.00 19.28 O ATOM 204 CB GLU B 147 0.967 -4.755 -11.794 1.00 26.72 C ATOM 205 CG GLU B 147 0.298 -3.546 -11.136 1.00 37.15 C ATOM 206 CD GLU B 147 0.669 -2.277 -11.904 1.00 41.71 C ATOM 207 OE1 GLU B 147 0.434 -2.242 -13.102 1.00 46.00 O ATOM 208 OE2 GLU B 147 1.182 -1.360 -11.284 1.00 45.02 O ATOM 0 H GLU B 147 -1.265 -5.671 -11.162 1.00 21.92 H new ATOM 0 HA GLU B 147 1.373 -6.816 -11.313 1.00 21.70 H new ATOM 0 HB2 GLU B 147 2.020 -4.544 -11.980 1.00 26.72 H new ATOM 0 HB3 GLU B 147 0.506 -4.957 -12.761 1.00 26.72 H new ATOM 0 HG2 GLU B 147 -0.784 -3.676 -11.128 1.00 37.15 H new ATOM 0 HG3 GLU B 147 0.617 -3.461 -10.097 1.00 37.15 H new ATOM 215 N TRP B 148 0.569 -5.318 -8.559 1.00 17.10 N ATOM 216 CA TRP B 148 1.074 -4.991 -7.194 1.00 12.75 C ATOM 217 C TRP B 148 0.564 -6.033 -6.196 1.00 12.19 C ATOM 218 O TRP B 148 0.367 -5.746 -5.033 1.00 11.66 O ATOM 219 CB TRP B 148 0.581 -3.600 -6.777 1.00 14.42 C ATOM 220 CG TRP B 148 -0.791 -3.360 -7.324 1.00 13.12 C ATOM 221 CD1 TRP B 148 -1.074 -2.584 -8.396 1.00 13.11 C ATOM 222 CD2 TRP B 148 -2.067 -3.882 -6.848 1.00 12.81 C ATOM 223 NE1 TRP B 148 -2.442 -2.595 -8.610 1.00 12.63 N ATOM 224 CE2 TRP B 148 -3.097 -3.380 -7.683 1.00 13.14 C ATOM 225 CE3 TRP B 148 -2.427 -4.736 -5.783 1.00 10.52 C ATOM 226 CZ2 TRP B 148 -4.439 -3.713 -7.469 1.00 13.39 C ATOM 227 CZ3 TRP B 148 -3.778 -5.072 -5.565 1.00 12.83 C ATOM 228 CH2 TRP B 148 -4.781 -4.561 -6.407 1.00 12.53 C ATOM 0 H TRP B 148 -0.443 -5.258 -8.674 1.00 17.10 H new ATOM 0 HA TRP B 148 2.164 -4.999 -7.204 1.00 12.75 H new ATOM 0 HB2 TRP B 148 0.567 -3.520 -5.690 1.00 14.42 H new ATOM 0 HB3 TRP B 148 1.267 -2.837 -7.144 1.00 14.42 H new ATOM 0 HD1 TRP B 148 -0.350 -2.044 -8.988 1.00 13.11 H new ATOM 0 HE1 TRP B 148 -2.908 -2.086 -9.361 1.00 12.63 H new ATOM 0 HE3 TRP B 148 -1.663 -5.134 -5.132 1.00 10.52 H new ATOM 0 HZ2 TRP B 148 -5.207 -3.319 -8.118 1.00 13.39 H new ATOM 0 HZ3 TRP B 148 -4.044 -5.725 -4.747 1.00 12.83 H new ATOM 0 HH2 TRP B 148 -5.815 -4.822 -6.235 1.00 12.53 H new ATOM 239 N TYR B 149 0.350 -7.241 -6.640 1.00 11.66 N ATOM 240 CA TYR B 149 -0.148 -8.298 -5.715 1.00 13.63 C ATOM 241 C TYR B 149 0.926 -9.375 -5.543 1.00 14.73 C ATOM 242 O TYR B 149 1.446 -9.905 -6.504 1.00 16.34 O ATOM 243 CB TYR B 149 -1.414 -8.929 -6.298 1.00 12.52 C ATOM 244 CG TYR B 149 -1.955 -9.958 -5.334 1.00 15.49 C ATOM 245 CD1 TYR B 149 -2.657 -9.547 -4.189 1.00 14.45 C ATOM 246 CD2 TYR B 149 -1.758 -11.326 -5.585 1.00 19.03 C ATOM 247 CE1 TYR B 149 -3.162 -10.505 -3.294 1.00 15.99 C ATOM 248 CE2 TYR B 149 -2.262 -12.283 -4.689 1.00 20.41 C ATOM 249 CZ TYR B 149 -2.964 -11.873 -3.543 1.00 21.15 C ATOM 250 OH TYR B 149 -3.459 -12.815 -2.664 1.00 23.67 O ATOM 0 H TYR B 149 0.498 -7.542 -7.603 1.00 11.66 H new ATOM 0 HA TYR B 149 -0.375 -7.855 -4.746 1.00 13.63 H new ATOM 0 HB2 TYR B 149 -2.164 -8.160 -6.484 1.00 12.52 H new ATOM 0 HB3 TYR B 149 -1.192 -9.396 -7.258 1.00 12.52 H new ATOM 0 HD1 TYR B 149 -2.809 -8.495 -3.997 1.00 14.45 H new ATOM 0 HD2 TYR B 149 -1.219 -11.642 -6.466 1.00 19.03 H new ATOM 0 HE1 TYR B 149 -3.703 -10.189 -2.414 1.00 15.99 H new ATOM 0 HE2 TYR B 149 -2.110 -13.335 -4.881 1.00 20.41 H new ATOM 0 HH TYR B 149 -3.692 -12.381 -1.817 1.00 23.67 H new ATOM 260 N PHE B 150 1.266 -9.702 -4.324 1.00 14.41 N ATOM 261 CA PHE B 150 2.308 -10.743 -4.096 1.00 13.20 C ATOM 262 C PHE B 150 1.782 -11.805 -3.124 1.00 12.95 C ATOM 263 O PHE B 150 2.439 -12.792 -2.859 1.00 12.44 O ATOM 264 CB PHE B 150 3.560 -10.088 -3.507 1.00 13.34 C ATOM 265 CG PHE B 150 4.717 -10.275 -4.459 1.00 10.91 C ATOM 266 CD1 PHE B 150 4.605 -9.850 -5.794 1.00 10.09 C ATOM 267 CD2 PHE B 150 5.906 -10.875 -4.011 1.00 10.43 C ATOM 268 CE1 PHE B 150 5.681 -10.025 -6.679 1.00 7.94 C ATOM 269 CE2 PHE B 150 6.982 -11.049 -4.896 1.00 9.38 C ATOM 270 CZ PHE B 150 6.871 -10.624 -6.230 1.00 8.81 C ATOM 0 H PHE B 150 0.867 -9.293 -3.479 1.00 14.41 H new ATOM 0 HA PHE B 150 2.554 -11.218 -5.046 1.00 13.20 H new ATOM 0 HB2 PHE B 150 3.383 -9.026 -3.336 1.00 13.34 H new ATOM 0 HB3 PHE B 150 3.795 -10.531 -2.539 1.00 13.34 H new ATOM 0 HD1 PHE B 150 3.691 -9.389 -6.139 1.00 10.09 H new ATOM 0 HD2 PHE B 150 5.992 -11.202 -2.985 1.00 10.43 H new ATOM 0 HE1 PHE B 150 5.594 -9.699 -7.705 1.00 7.94 H new ATOM 0 HE2 PHE B 150 7.896 -11.510 -4.551 1.00 9.38 H new ATOM 0 HZ PHE B 150 7.699 -10.757 -6.910 1.00 8.81 H new ATOM 280 N GLY B 151 0.607 -11.614 -2.588 1.00 14.57 N ATOM 281 CA GLY B 151 0.051 -12.614 -1.637 1.00 13.68 C ATOM 282 C GLY B 151 0.465 -12.246 -0.213 1.00 15.95 C ATOM 283 O GLY B 151 0.490 -11.090 0.160 1.00 16.08 O ATOM 0 H GLY B 151 0.009 -10.808 -2.769 1.00 14.57 H new ATOM 0 HA2 GLY B 151 -1.036 -12.642 -1.716 1.00 13.68 H new ATOM 0 HA3 GLY B 151 0.414 -13.611 -1.887 1.00 13.68 H new ATOM 287 N LYS B 152 0.792 -13.222 0.583 1.00 14.92 N ATOM 288 CA LYS B 152 1.205 -12.943 1.981 1.00 16.57 C ATOM 289 C LYS B 152 2.724 -13.083 2.102 1.00 15.79 C ATOM 290 O LYS B 152 3.295 -14.089 1.733 1.00 15.62 O ATOM 291 CB LYS B 152 0.526 -13.938 2.924 1.00 19.39 C ATOM 292 CG LYS B 152 0.394 -15.305 2.245 1.00 26.20 C ATOM 293 CD LYS B 152 0.031 -16.360 3.292 1.00 32.70 C ATOM 294 CE LYS B 152 1.308 -16.886 3.951 1.00 38.73 C ATOM 295 NZ LYS B 152 1.059 -18.249 4.499 1.00 43.61 N ATOM 0 H LYS B 152 0.790 -14.208 0.322 1.00 14.92 H new ATOM 0 HA LYS B 152 0.910 -11.929 2.250 1.00 16.57 H new ATOM 0 HB2 LYS B 152 1.106 -14.034 3.842 1.00 19.39 H new ATOM 0 HB3 LYS B 152 -0.459 -13.568 3.207 1.00 19.39 H new ATOM 0 HG2 LYS B 152 -0.372 -15.266 1.471 1.00 26.20 H new ATOM 0 HG3 LYS B 152 1.330 -15.571 1.754 1.00 26.20 H new ATOM 0 HD2 LYS B 152 -0.628 -15.928 4.045 1.00 32.70 H new ATOM 0 HD3 LYS B 152 -0.514 -17.180 2.824 1.00 32.70 H new ATOM 0 HE2 LYS B 152 2.119 -16.918 3.223 1.00 38.73 H new ATOM 0 HE3 LYS B 152 1.622 -16.213 4.749 1.00 38.73 H new ATOM 0 HZ1 LYS B 152 1.927 -18.607 4.947 1.00 43.61 H new ATOM 0 HZ2 LYS B 152 0.297 -18.205 5.206 1.00 43.61 H new ATOM 0 HZ3 LYS B 152 0.779 -18.888 3.727 1.00 43.61 H new ATOM 309 N ILE B 153 3.382 -12.081 2.617 1.00 16.90 N ATOM 310 CA ILE B 153 4.862 -12.159 2.761 1.00 16.60 C ATOM 311 C ILE B 153 5.242 -11.949 4.228 1.00 17.59 C ATOM 312 O ILE B 153 4.395 -11.751 5.076 1.00 21.20 O ATOM 313 CB ILE B 153 5.517 -11.074 1.903 1.00 15.36 C ATOM 314 CG1 ILE B 153 5.181 -9.697 2.478 1.00 14.56 C ATOM 315 CG2 ILE B 153 4.990 -11.169 0.470 1.00 15.80 C ATOM 316 CD1 ILE B 153 6.037 -8.632 1.788 1.00 13.00 C ATOM 0 H ILE B 153 2.959 -11.212 2.944 1.00 16.90 H new ATOM 0 HA ILE B 153 5.208 -13.139 2.432 1.00 16.60 H new ATOM 0 HB ILE B 153 6.598 -11.215 1.903 1.00 15.36 H new ATOM 0 HG12 ILE B 153 4.123 -9.479 2.332 1.00 14.56 H new ATOM 0 HG13 ILE B 153 5.364 -9.685 3.552 1.00 14.56 H new ATOM 0 HG21 ILE B 153 5.456 -10.396 -0.141 1.00 15.80 H new ATOM 0 HG22 ILE B 153 5.228 -12.150 0.059 1.00 15.80 H new ATOM 0 HG23 ILE B 153 3.909 -11.029 0.470 1.00 15.80 H new ATOM 0 HD11 ILE B 153 5.797 -7.651 2.198 1.00 13.00 H new ATOM 0 HD12 ILE B 153 7.092 -8.848 1.957 1.00 13.00 H new ATOM 0 HD13 ILE B 153 5.832 -8.638 0.717 1.00 13.00 H new ATOM 328 N THR B 154 6.510 -11.989 4.533 1.00 16.79 N ATOM 329 CA THR B 154 6.942 -11.791 5.946 1.00 16.02 C ATOM 330 C THR B 154 7.148 -10.298 6.211 1.00 15.06 C ATOM 331 O THR B 154 7.116 -9.488 5.306 1.00 14.17 O ATOM 332 CB THR B 154 8.255 -12.540 6.186 1.00 18.43 C ATOM 333 OG1 THR B 154 9.310 -11.867 5.515 1.00 22.52 O ATOM 334 CG2 THR B 154 8.135 -13.967 5.652 1.00 19.67 C ATOM 0 H THR B 154 7.265 -12.150 3.866 1.00 16.79 H new ATOM 0 HA THR B 154 6.176 -12.176 6.619 1.00 16.02 H new ATOM 0 HB THR B 154 8.466 -12.572 7.255 1.00 18.43 H new ATOM 0 HG1 THR B 154 10.152 -12.344 5.669 1.00 22.52 H new ATOM 0 HG21 THR B 154 9.071 -14.499 5.823 1.00 19.67 H new ATOM 0 HG22 THR B 154 7.325 -14.482 6.168 1.00 19.67 H new ATOM 0 HG23 THR B 154 7.924 -13.939 4.583 1.00 19.67 H new ATOM 342 N ARG B 155 7.358 -9.928 7.445 1.00 15.92 N ATOM 343 CA ARG B 155 7.565 -8.487 7.764 1.00 14.63 C ATOM 344 C ARG B 155 8.972 -8.065 7.337 1.00 15.69 C ATOM 345 O ARG B 155 9.191 -6.954 6.897 1.00 13.45 O ATOM 346 CB ARG B 155 7.401 -8.269 9.270 1.00 13.07 C ATOM 347 CG ARG B 155 7.209 -6.779 9.555 1.00 14.81 C ATOM 348 CD ARG B 155 8.222 -6.324 10.606 1.00 13.27 C ATOM 349 NE ARG B 155 8.224 -7.289 11.742 1.00 16.05 N ATOM 350 CZ ARG B 155 9.350 -7.630 12.306 1.00 8.86 C ATOM 351 NH1 ARG B 155 10.359 -8.009 11.570 1.00 12.78 N ATOM 352 NH2 ARG B 155 9.468 -7.593 13.605 1.00 8.73 N ATOM 0 H ARG B 155 7.395 -10.560 8.245 1.00 15.92 H new ATOM 0 HA ARG B 155 6.829 -7.888 7.228 1.00 14.63 H new ATOM 0 HB2 ARG B 155 6.544 -8.833 9.638 1.00 13.07 H new ATOM 0 HB3 ARG B 155 8.279 -8.641 9.799 1.00 13.07 H new ATOM 0 HG2 ARG B 155 7.337 -6.203 8.638 1.00 14.81 H new ATOM 0 HG3 ARG B 155 6.195 -6.594 9.908 1.00 14.81 H new ATOM 0 HD2 ARG B 155 9.217 -6.262 10.165 1.00 13.27 H new ATOM 0 HD3 ARG B 155 7.969 -5.326 10.963 1.00 13.27 H new ATOM 0 HE ARG B 155 7.345 -7.683 12.078 1.00 16.05 H new ATOM 0 HH11 ARG B 155 10.267 -8.038 10.555 1.00 12.78 H new ATOM 0 HH12 ARG B 155 11.240 -8.276 12.010 1.00 12.78 H new ATOM 0 HH21 ARG B 155 8.679 -7.297 14.181 1.00 8.73 H new ATOM 0 HH22 ARG B 155 10.349 -7.860 14.045 1.00 8.73 H new ATOM 366 N ARG B 156 9.928 -8.945 7.460 1.00 16.92 N ATOM 367 CA ARG B 156 11.320 -8.593 7.059 1.00 18.61 C ATOM 368 C ARG B 156 11.379 -8.400 5.543 1.00 17.01 C ATOM 369 O ARG B 156 11.825 -7.381 5.055 1.00 17.04 O ATOM 370 CB ARG B 156 12.269 -9.722 7.467 1.00 24.11 C ATOM 371 CG ARG B 156 13.678 -9.160 7.666 1.00 33.87 C ATOM 372 CD ARG B 156 14.385 -9.062 6.312 1.00 41.26 C ATOM 373 NE ARG B 156 14.611 -10.430 5.770 1.00 49.98 N ATOM 374 CZ ARG B 156 15.823 -10.838 5.510 1.00 51.87 C ATOM 375 NH1 ARG B 156 16.409 -10.479 4.400 1.00 52.15 N ATOM 376 NH2 ARG B 156 16.450 -11.605 6.360 1.00 53.57 N ATOM 0 H ARG B 156 9.806 -9.891 7.820 1.00 16.92 H new ATOM 0 HA ARG B 156 11.619 -7.670 7.555 1.00 18.61 H new ATOM 0 HB2 ARG B 156 11.920 -10.190 8.387 1.00 24.11 H new ATOM 0 HB3 ARG B 156 12.280 -10.497 6.700 1.00 24.11 H new ATOM 0 HG2 ARG B 156 13.626 -8.176 8.133 1.00 33.87 H new ATOM 0 HG3 ARG B 156 14.246 -9.803 8.339 1.00 33.87 H new ATOM 0 HD2 ARG B 156 13.782 -8.479 5.616 1.00 41.26 H new ATOM 0 HD3 ARG B 156 15.336 -8.542 6.423 1.00 41.26 H new ATOM 0 HE ARG B 156 13.818 -11.049 5.602 1.00 49.98 H new ATOM 0 HH11 ARG B 156 15.920 -9.879 3.736 1.00 52.15 H new ATOM 0 HH12 ARG B 156 17.356 -10.798 4.197 1.00 52.15 H new ATOM 0 HH21 ARG B 156 15.993 -11.885 7.227 1.00 53.57 H new ATOM 0 HH22 ARG B 156 17.397 -11.924 6.157 1.00 53.57 H new ATOM 390 N GLU B 157 10.934 -9.372 4.795 1.00 15.73 N ATOM 391 CA GLU B 157 10.965 -9.247 3.310 1.00 15.26 C ATOM 392 C GLU B 157 10.240 -7.968 2.886 1.00 14.10 C ATOM 393 O GLU B 157 10.708 -7.230 2.041 1.00 15.48 O ATOM 394 CB GLU B 157 10.269 -10.457 2.683 1.00 19.30 C ATOM 395 CG GLU B 157 10.610 -10.527 1.193 1.00 28.11 C ATOM 396 CD GLU B 157 10.383 -11.951 0.683 1.00 29.65 C ATOM 397 OE1 GLU B 157 9.599 -12.660 1.293 1.00 28.63 O ATOM 398 OE2 GLU B 157 10.996 -12.309 -0.309 1.00 31.13 O ATOM 0 H GLU B 157 10.550 -10.248 5.148 1.00 15.73 H new ATOM 0 HA GLU B 157 12.001 -9.205 2.973 1.00 15.26 H new ATOM 0 HB2 GLU B 157 10.587 -11.372 3.183 1.00 19.30 H new ATOM 0 HB3 GLU B 157 9.190 -10.379 2.817 1.00 19.30 H new ATOM 0 HG2 GLU B 157 9.990 -9.826 0.634 1.00 28.11 H new ATOM 0 HG3 GLU B 157 11.647 -10.233 1.032 1.00 28.11 H new ATOM 405 N SER B 158 9.101 -7.699 3.463 1.00 11.43 N ATOM 406 CA SER B 158 8.346 -6.469 3.089 1.00 9.58 C ATOM 407 C SER B 158 9.268 -5.250 3.189 1.00 10.15 C ATOM 408 O SER B 158 9.537 -4.582 2.210 1.00 12.31 O ATOM 409 CB SER B 158 7.163 -6.289 4.040 1.00 8.90 C ATOM 410 OG SER B 158 6.776 -4.922 4.053 1.00 11.55 O ATOM 0 H SER B 158 8.660 -8.278 4.178 1.00 11.43 H new ATOM 0 HA SER B 158 7.982 -6.566 2.066 1.00 9.58 H new ATOM 0 HB2 SER B 158 6.327 -6.913 3.722 1.00 8.90 H new ATOM 0 HB3 SER B 158 7.437 -6.611 5.045 1.00 8.90 H new ATOM 0 HG SER B 158 6.016 -4.803 4.661 1.00 11.55 H new ATOM 416 N GLU B 159 9.753 -4.956 4.364 1.00 11.35 N ATOM 417 CA GLU B 159 10.652 -3.785 4.528 1.00 12.85 C ATOM 418 C GLU B 159 11.938 -4.009 3.730 1.00 15.16 C ATOM 419 O GLU B 159 12.703 -3.096 3.498 1.00 13.16 O ATOM 420 CB GLU B 159 10.992 -3.625 6.010 1.00 13.71 C ATOM 421 CG GLU B 159 9.701 -3.453 6.812 1.00 16.00 C ATOM 422 CD GLU B 159 9.829 -4.184 8.150 1.00 19.40 C ATOM 423 OE1 GLU B 159 10.908 -4.681 8.429 1.00 21.73 O ATOM 424 OE2 GLU B 159 8.847 -4.235 8.871 1.00 26.69 O ATOM 0 H GLU B 159 9.563 -5.480 5.219 1.00 11.35 H new ATOM 0 HA GLU B 159 10.156 -2.886 4.163 1.00 12.85 H new ATOM 0 HB2 GLU B 159 11.540 -4.498 6.365 1.00 13.71 H new ATOM 0 HB3 GLU B 159 11.641 -2.761 6.154 1.00 13.71 H new ATOM 0 HG2 GLU B 159 9.504 -2.394 6.981 1.00 16.00 H new ATOM 0 HG3 GLU B 159 8.855 -3.848 6.249 1.00 16.00 H new ATOM 431 N ARG B 160 12.183 -5.220 3.309 1.00 15.73 N ATOM 432 CA ARG B 160 13.421 -5.502 2.527 1.00 17.77 C ATOM 433 C ARG B 160 13.208 -5.101 1.065 1.00 17.96 C ATOM 434 O ARG B 160 14.144 -4.805 0.351 1.00 17.67 O ATOM 435 CB ARG B 160 13.737 -6.995 2.602 1.00 21.81 C ATOM 436 CG ARG B 160 15.240 -7.190 2.811 1.00 30.59 C ATOM 437 CD ARG B 160 15.757 -8.257 1.845 1.00 37.74 C ATOM 438 NE ARG B 160 15.447 -7.853 0.444 1.00 43.93 N ATOM 439 CZ ARG B 160 16.222 -8.238 -0.532 1.00 48.64 C ATOM 440 NH1 ARG B 160 16.056 -9.415 -1.071 1.00 50.79 N ATOM 441 NH2 ARG B 160 17.163 -7.448 -0.969 1.00 51.68 N ATOM 0 H ARG B 160 11.580 -6.026 3.473 1.00 15.73 H new ATOM 0 HA ARG B 160 14.251 -4.930 2.942 1.00 17.77 H new ATOM 0 HB2 ARG B 160 13.183 -7.454 3.421 1.00 21.81 H new ATOM 0 HB3 ARG B 160 13.419 -7.491 1.685 1.00 21.81 H new ATOM 0 HG2 ARG B 160 15.766 -6.250 2.646 1.00 30.59 H new ATOM 0 HG3 ARG B 160 15.439 -7.489 3.840 1.00 30.59 H new ATOM 0 HD2 ARG B 160 16.833 -8.384 1.968 1.00 37.74 H new ATOM 0 HD3 ARG B 160 15.295 -9.219 2.068 1.00 37.74 H new ATOM 0 HE ARG B 160 14.629 -7.276 0.249 1.00 43.93 H new ATOM 0 HH11 ARG B 160 15.320 -10.033 -0.729 1.00 50.79 H new ATOM 0 HH12 ARG B 160 16.662 -9.716 -1.834 1.00 50.79 H new ATOM 0 HH21 ARG B 160 17.293 -6.528 -0.548 1.00 51.68 H new ATOM 0 HH22 ARG B 160 17.769 -7.750 -1.732 1.00 51.68 H new ATOM 455 N LEU B 161 11.984 -5.097 0.615 1.00 16.19 N ATOM 456 CA LEU B 161 11.710 -4.722 -0.801 1.00 12.63 C ATOM 457 C LEU B 161 11.524 -3.208 -0.910 1.00 13.41 C ATOM 458 O LEU B 161 11.847 -2.605 -1.915 1.00 14.12 O ATOM 459 CB LEU B 161 10.433 -5.421 -1.271 1.00 10.23 C ATOM 460 CG LEU B 161 10.782 -6.796 -1.842 1.00 11.74 C ATOM 461 CD1 LEU B 161 9.511 -7.469 -2.364 1.00 10.85 C ATOM 462 CD2 LEU B 161 11.779 -6.631 -2.991 1.00 15.84 C ATOM 0 H LEU B 161 11.161 -5.337 1.167 1.00 16.19 H new ATOM 0 HA LEU B 161 12.551 -5.028 -1.423 1.00 12.63 H new ATOM 0 HB2 LEU B 161 9.737 -5.527 -0.439 1.00 10.23 H new ATOM 0 HB3 LEU B 161 9.934 -4.817 -2.029 1.00 10.23 H new ATOM 0 HG LEU B 161 11.225 -7.413 -1.060 1.00 11.74 H new ATOM 0 HD11 LEU B 161 9.759 -8.449 -2.771 1.00 10.85 H new ATOM 0 HD12 LEU B 161 8.799 -7.585 -1.547 1.00 10.85 H new ATOM 0 HD13 LEU B 161 9.068 -6.853 -3.146 1.00 10.85 H new ATOM 0 HD21 LEU B 161 12.029 -7.610 -3.399 1.00 15.84 H new ATOM 0 HD22 LEU B 161 11.335 -6.015 -3.773 1.00 15.84 H new ATOM 0 HD23 LEU B 161 12.685 -6.150 -2.621 1.00 15.84 H new ATOM 474 N LEU B 162 10.998 -2.588 0.110 1.00 12.10 N ATOM 475 CA LEU B 162 10.784 -1.115 0.052 1.00 13.70 C ATOM 476 C LEU B 162 12.028 -0.384 0.565 1.00 15.43 C ATOM 477 O LEU B 162 12.303 0.734 0.176 1.00 15.50 O ATOM 478 CB LEU B 162 9.576 -0.746 0.914 1.00 13.91 C ATOM 479 CG LEU B 162 8.316 -1.377 0.317 1.00 12.97 C ATOM 480 CD1 LEU B 162 7.308 -1.660 1.431 1.00 9.03 C ATOM 481 CD2 LEU B 162 7.696 -0.412 -0.696 1.00 11.59 C ATOM 0 H LEU B 162 10.708 -3.036 0.979 1.00 12.10 H new ATOM 0 HA LEU B 162 10.601 -0.817 -0.981 1.00 13.70 H new ATOM 0 HB2 LEU B 162 9.723 -1.097 1.935 1.00 13.91 H new ATOM 0 HB3 LEU B 162 9.466 0.337 0.962 1.00 13.91 H new ATOM 0 HG LEU B 162 8.579 -2.311 -0.180 1.00 12.97 H new ATOM 0 HD11 LEU B 162 6.411 -2.109 1.005 1.00 9.03 H new ATOM 0 HD12 LEU B 162 7.749 -2.346 2.155 1.00 9.03 H new ATOM 0 HD13 LEU B 162 7.045 -0.727 1.929 1.00 9.03 H new ATOM 0 HD21 LEU B 162 6.798 -0.860 -1.123 1.00 11.59 H new ATOM 0 HD22 LEU B 162 7.434 0.521 -0.197 1.00 11.59 H new ATOM 0 HD23 LEU B 162 8.413 -0.209 -1.491 1.00 11.59 H new ATOM 493 N LEU B 163 12.783 -1.002 1.434 1.00 17.97 N ATOM 494 CA LEU B 163 14.004 -0.334 1.962 1.00 23.68 C ATOM 495 C LEU B 163 15.183 -0.609 1.025 1.00 29.76 C ATOM 496 O LEU B 163 16.176 -1.187 1.415 1.00 34.43 O ATOM 497 CB LEU B 163 14.322 -0.882 3.353 1.00 20.30 C ATOM 498 CG LEU B 163 13.160 -0.576 4.300 1.00 19.42 C ATOM 499 CD1 LEU B 163 13.486 -1.104 5.697 1.00 19.86 C ATOM 500 CD2 LEU B 163 12.942 0.938 4.365 1.00 19.28 C ATOM 0 H LEU B 163 12.606 -1.938 1.799 1.00 17.97 H new ATOM 0 HA LEU B 163 13.832 0.741 2.024 1.00 23.68 H new ATOM 0 HB2 LEU B 163 14.490 -1.958 3.302 1.00 20.30 H new ATOM 0 HB3 LEU B 163 15.241 -0.434 3.731 1.00 20.30 H new ATOM 0 HG LEU B 163 12.255 -1.059 3.932 1.00 19.42 H new ATOM 0 HD11 LEU B 163 12.658 -0.886 6.371 1.00 19.86 H new ATOM 0 HD12 LEU B 163 13.642 -2.182 5.651 1.00 19.86 H new ATOM 0 HD13 LEU B 163 14.391 -0.622 6.066 1.00 19.86 H new ATOM 0 HD21 LEU B 163 12.114 1.158 5.039 1.00 19.28 H new ATOM 0 HD22 LEU B 163 13.848 1.421 4.733 1.00 19.28 H new ATOM 0 HD23 LEU B 163 12.709 1.315 3.369 1.00 19.28 H new ATOM 512 N ASN B 164 15.080 -0.196 -0.209 1.00 33.44 N ATOM 513 CA ASN B 164 16.193 -0.433 -1.168 1.00 37.75 C ATOM 514 C ASN B 164 16.843 0.903 -1.530 1.00 40.49 C ATOM 515 O ASN B 164 16.183 1.834 -1.946 1.00 41.14 O ATOM 516 CB ASN B 164 15.644 -1.093 -2.435 1.00 39.08 C ATOM 517 CG ASN B 164 16.269 -2.480 -2.601 1.00 42.87 C ATOM 518 OD1 ASN B 164 16.690 -2.844 -3.680 1.00 47.61 O ATOM 519 ND2 ASN B 164 16.347 -3.274 -1.568 1.00 46.52 N ATOM 0 H ASN B 164 14.273 0.295 -0.593 1.00 33.44 H new ATOM 0 HA ASN B 164 16.935 -1.088 -0.711 1.00 37.75 H new ATOM 0 HB2 ASN B 164 14.559 -1.177 -2.373 1.00 39.08 H new ATOM 0 HB3 ASN B 164 15.867 -0.476 -3.305 1.00 39.08 H new ATOM 0 HD21 ASN B 164 16.762 -4.201 -1.667 1.00 46.52 H new ATOM 0 HD22 ASN B 164 15.993 -2.968 -0.662 1.00 46.52 H new ATOM 526 N ALA B 165 18.135 1.004 -1.377 1.00 41.13 N ATOM 527 CA ALA B 165 18.827 2.280 -1.713 1.00 40.91 C ATOM 528 C ALA B 165 18.677 2.566 -3.210 1.00 39.78 C ATOM 529 O ALA B 165 18.954 3.655 -3.672 1.00 42.37 O ATOM 530 CB ALA B 165 20.313 2.160 -1.365 1.00 43.50 C ATOM 0 H ALA B 165 18.741 0.258 -1.034 1.00 41.13 H new ATOM 0 HA ALA B 165 18.382 3.095 -1.142 1.00 40.91 H new ATOM 0 HB1 ALA B 165 20.821 3.093 -1.610 1.00 43.50 H new ATOM 0 HB2 ALA B 165 20.422 1.957 -0.300 1.00 43.50 H new ATOM 0 HB3 ALA B 165 20.756 1.345 -1.937 1.00 43.50 H new ATOM 536 N GLU B 166 18.239 1.599 -3.970 1.00 36.31 N ATOM 537 CA GLU B 166 18.074 1.820 -5.434 1.00 32.86 C ATOM 538 C GLU B 166 16.585 1.836 -5.784 1.00 28.56 C ATOM 539 O GLU B 166 16.193 1.505 -6.885 1.00 27.16 O ATOM 540 CB GLU B 166 18.765 0.691 -6.199 1.00 35.96 C ATOM 541 CG GLU B 166 20.250 1.018 -6.364 1.00 44.79 C ATOM 542 CD GLU B 166 20.821 0.224 -7.539 1.00 50.54 C ATOM 543 OE1 GLU B 166 20.305 0.371 -8.635 1.00 54.06 O ATOM 544 OE2 GLU B 166 21.765 -0.520 -7.324 1.00 52.17 O ATOM 0 H GLU B 166 17.989 0.667 -3.640 1.00 36.31 H new ATOM 0 HA GLU B 166 18.521 2.775 -5.710 1.00 32.86 H new ATOM 0 HB2 GLU B 166 18.647 -0.251 -5.663 1.00 35.96 H new ATOM 0 HB3 GLU B 166 18.300 0.562 -7.176 1.00 35.96 H new ATOM 0 HG2 GLU B 166 20.381 2.086 -6.536 1.00 44.79 H new ATOM 0 HG3 GLU B 166 20.791 0.774 -5.450 1.00 44.79 H new ATOM 551 N ASN B 167 15.750 2.217 -4.856 1.00 24.51 N ATOM 552 CA ASN B 167 14.288 2.253 -5.140 1.00 21.82 C ATOM 553 C ASN B 167 13.837 3.711 -5.297 1.00 19.62 C ATOM 554 O ASN B 167 14.303 4.577 -4.583 1.00 20.78 O ATOM 555 CB ASN B 167 13.527 1.606 -3.980 1.00 20.91 C ATOM 556 CG ASN B 167 13.250 0.138 -4.306 1.00 21.84 C ATOM 557 OD1 ASN B 167 13.734 -0.379 -5.293 1.00 20.75 O ATOM 558 ND2 ASN B 167 12.486 -0.561 -3.511 1.00 24.01 N ATOM 0 H ASN B 167 16.017 2.505 -3.915 1.00 24.51 H new ATOM 0 HA ASN B 167 14.081 1.706 -6.060 1.00 21.82 H new ATOM 0 HB2 ASN B 167 14.110 1.682 -3.062 1.00 20.91 H new ATOM 0 HB3 ASN B 167 12.589 2.134 -3.807 1.00 20.91 H new ATOM 0 HD21 ASN B 167 12.295 -1.541 -3.719 1.00 24.01 H new ATOM 0 HD22 ASN B 167 12.080 -0.127 -2.682 1.00 24.01 H new ATOM 565 N PRO B 168 12.943 3.945 -6.229 1.00 18.42 N ATOM 566 CA PRO B 168 12.417 5.295 -6.497 1.00 16.88 C ATOM 567 C PRO B 168 11.353 5.670 -5.461 1.00 16.36 C ATOM 568 O PRO B 168 10.455 4.904 -5.175 1.00 15.23 O ATOM 569 CB PRO B 168 11.796 5.170 -7.890 1.00 18.00 C ATOM 570 CG PRO B 168 11.493 3.667 -8.100 1.00 17.15 C ATOM 571 CD PRO B 168 12.375 2.895 -7.102 1.00 16.33 C ATOM 0 HA PRO B 168 13.182 6.070 -6.443 1.00 16.88 H new ATOM 0 HB2 PRO B 168 10.885 5.764 -7.964 1.00 18.00 H new ATOM 0 HB3 PRO B 168 12.480 5.539 -8.655 1.00 18.00 H new ATOM 0 HG2 PRO B 168 10.438 3.457 -7.927 1.00 17.15 H new ATOM 0 HG3 PRO B 168 11.714 3.367 -9.124 1.00 17.15 H new ATOM 0 HD2 PRO B 168 11.791 2.174 -6.529 1.00 16.33 H new ATOM 0 HD3 PRO B 168 13.159 2.336 -7.613 1.00 16.33 H new ATOM 579 N ARG B 169 11.446 6.844 -4.901 1.00 16.48 N ATOM 580 CA ARG B 169 10.439 7.268 -3.888 1.00 15.86 C ATOM 581 C ARG B 169 9.037 7.158 -4.492 1.00 13.88 C ATOM 582 O ARG B 169 8.591 8.029 -5.211 1.00 15.48 O ATOM 583 CB ARG B 169 10.705 8.719 -3.481 1.00 15.75 C ATOM 584 CG ARG B 169 9.619 9.186 -2.510 1.00 19.73 C ATOM 585 CD ARG B 169 9.559 10.715 -2.506 1.00 22.87 C ATOM 586 NE ARG B 169 10.943 11.267 -2.566 1.00 21.47 N ATOM 587 CZ ARG B 169 11.363 11.858 -3.650 1.00 20.61 C ATOM 588 NH1 ARG B 169 10.602 12.729 -4.255 1.00 22.31 N ATOM 589 NH2 ARG B 169 12.544 11.579 -4.129 1.00 23.69 N ATOM 0 H ARG B 169 12.176 7.528 -5.101 1.00 16.48 H new ATOM 0 HA ARG B 169 10.511 6.626 -3.010 1.00 15.86 H new ATOM 0 HB2 ARG B 169 11.686 8.802 -3.013 1.00 15.75 H new ATOM 0 HB3 ARG B 169 10.718 9.359 -4.364 1.00 15.75 H new ATOM 0 HG2 ARG B 169 8.653 8.775 -2.803 1.00 19.73 H new ATOM 0 HG3 ARG B 169 9.831 8.817 -1.506 1.00 19.73 H new ATOM 0 HD2 ARG B 169 8.978 11.069 -3.357 1.00 22.87 H new ATOM 0 HD3 ARG B 169 9.054 11.067 -1.607 1.00 22.87 H new ATOM 0 HE ARG B 169 11.561 11.182 -1.759 1.00 21.47 H new ATOM 0 HH11 ARG B 169 9.679 12.947 -3.880 1.00 22.31 H new ATOM 0 HH12 ARG B 169 10.930 13.191 -5.103 1.00 22.31 H new ATOM 0 HH21 ARG B 169 13.139 10.899 -3.656 1.00 23.69 H new ATOM 0 HH22 ARG B 169 12.873 12.041 -4.977 1.00 23.69 H new ATOM 603 N GLY B 170 8.339 6.093 -4.205 1.00 11.61 N ATOM 604 CA GLY B 170 6.966 5.934 -4.763 1.00 10.78 C ATOM 605 C GLY B 170 6.655 4.449 -4.953 1.00 11.90 C ATOM 606 O GLY B 170 5.514 4.059 -5.101 1.00 11.93 O ATOM 0 H GLY B 170 8.659 5.329 -3.610 1.00 11.61 H new ATOM 0 HA2 GLY B 170 6.236 6.385 -4.091 1.00 10.78 H new ATOM 0 HA3 GLY B 170 6.888 6.457 -5.716 1.00 10.78 H new ATOM 610 N THR B 171 7.659 3.613 -4.948 1.00 11.18 N ATOM 611 CA THR B 171 7.411 2.156 -5.126 1.00 10.98 C ATOM 612 C THR B 171 6.437 1.677 -4.049 1.00 10.39 C ATOM 613 O THR B 171 6.535 2.056 -2.899 1.00 11.11 O ATOM 614 CB THR B 171 8.731 1.391 -4.999 1.00 12.81 C ATOM 615 OG1 THR B 171 9.645 1.860 -5.981 1.00 15.73 O ATOM 616 CG2 THR B 171 8.479 -0.103 -5.206 1.00 10.54 C ATOM 0 H THR B 171 8.637 3.877 -4.829 1.00 11.18 H new ATOM 0 HA THR B 171 6.985 1.976 -6.113 1.00 10.98 H new ATOM 0 HB THR B 171 9.150 1.552 -4.006 1.00 12.81 H new ATOM 0 HG1 THR B 171 9.934 2.768 -5.752 1.00 15.73 H new ATOM 0 HG21 THR B 171 9.419 -0.647 -5.115 1.00 10.54 H new ATOM 0 HG22 THR B 171 7.778 -0.462 -4.452 1.00 10.54 H new ATOM 0 HG23 THR B 171 8.059 -0.267 -6.198 1.00 10.54 H new ATOM 624 N PHE B 172 5.493 0.851 -4.409 1.00 9.86 N ATOM 625 CA PHE B 172 4.515 0.361 -3.399 1.00 10.31 C ATOM 626 C PHE B 172 4.122 -1.084 -3.714 1.00 9.74 C ATOM 627 O PHE B 172 4.550 -1.657 -4.697 1.00 10.89 O ATOM 628 CB PHE B 172 3.266 1.242 -3.433 1.00 8.42 C ATOM 629 CG PHE B 172 2.588 1.104 -4.774 1.00 10.33 C ATOM 630 CD1 PHE B 172 1.619 0.106 -4.972 1.00 10.22 C ATOM 631 CD2 PHE B 172 2.930 1.970 -5.827 1.00 9.32 C ATOM 632 CE1 PHE B 172 0.989 -0.024 -6.221 1.00 9.66 C ATOM 633 CE2 PHE B 172 2.299 1.841 -7.076 1.00 10.82 C ATOM 634 CZ PHE B 172 1.330 0.843 -7.273 1.00 11.64 C ATOM 0 H PHE B 172 5.357 0.496 -5.355 1.00 9.86 H new ATOM 0 HA PHE B 172 4.970 0.403 -2.409 1.00 10.31 H new ATOM 0 HB2 PHE B 172 2.581 0.951 -2.636 1.00 8.42 H new ATOM 0 HB3 PHE B 172 3.537 2.283 -3.256 1.00 8.42 H new ATOM 0 HD1 PHE B 172 1.358 -0.561 -4.164 1.00 10.22 H new ATOM 0 HD2 PHE B 172 3.678 2.735 -5.676 1.00 9.32 H new ATOM 0 HE1 PHE B 172 0.243 -0.790 -6.373 1.00 9.66 H new ATOM 0 HE2 PHE B 172 2.559 2.509 -7.884 1.00 10.82 H new ATOM 0 HZ PHE B 172 0.847 0.742 -8.234 1.00 11.64 H new ATOM 644 N LEU B 173 3.306 -1.675 -2.885 1.00 8.06 N ATOM 645 CA LEU B 173 2.876 -3.081 -3.126 1.00 6.70 C ATOM 646 C LEU B 173 1.664 -3.397 -2.249 1.00 8.22 C ATOM 647 O LEU B 173 1.331 -2.657 -1.344 1.00 8.04 O ATOM 648 CB LEU B 173 4.022 -4.034 -2.777 1.00 7.47 C ATOM 649 CG LEU B 173 4.688 -3.580 -1.477 1.00 8.31 C ATOM 650 CD1 LEU B 173 3.783 -3.925 -0.294 1.00 7.11 C ATOM 651 CD2 LEU B 173 6.029 -4.298 -1.316 1.00 7.67 C ATOM 0 H LEU B 173 2.917 -1.242 -2.047 1.00 8.06 H new ATOM 0 HA LEU B 173 2.610 -3.206 -4.176 1.00 6.70 H new ATOM 0 HB2 LEU B 173 3.643 -5.050 -2.668 1.00 7.47 H new ATOM 0 HB3 LEU B 173 4.753 -4.051 -3.585 1.00 7.47 H new ATOM 0 HG LEU B 173 4.852 -2.503 -1.509 1.00 8.31 H new ATOM 0 HD11 LEU B 173 4.257 -3.602 0.633 1.00 7.11 H new ATOM 0 HD12 LEU B 173 2.825 -3.417 -0.408 1.00 7.11 H new ATOM 0 HD13 LEU B 173 3.621 -5.002 -0.262 1.00 7.11 H new ATOM 0 HD21 LEU B 173 6.505 -3.976 -0.390 1.00 7.67 H new ATOM 0 HD22 LEU B 173 5.864 -5.375 -1.283 1.00 7.67 H new ATOM 0 HD23 LEU B 173 6.675 -4.056 -2.160 1.00 7.67 H new ATOM 663 N VAL B 174 1.001 -4.490 -2.506 1.00 9.95 N ATOM 664 CA VAL B 174 -0.190 -4.852 -1.684 1.00 10.61 C ATOM 665 C VAL B 174 -0.156 -6.350 -1.375 1.00 10.97 C ATOM 666 O VAL B 174 0.109 -7.163 -2.237 1.00 13.68 O ATOM 667 CB VAL B 174 -1.467 -4.523 -2.458 1.00 8.85 C ATOM 668 CG1 VAL B 174 -2.663 -4.560 -1.504 1.00 7.48 C ATOM 669 CG2 VAL B 174 -1.351 -3.125 -3.070 1.00 7.46 C ATOM 0 H VAL B 174 1.232 -5.149 -3.250 1.00 9.95 H new ATOM 0 HA VAL B 174 -0.174 -4.285 -0.753 1.00 10.61 H new ATOM 0 HB VAL B 174 -1.608 -5.256 -3.252 1.00 8.85 H new ATOM 0 HG11 VAL B 174 -3.574 -4.326 -2.054 1.00 7.48 H new ATOM 0 HG12 VAL B 174 -2.749 -5.555 -1.066 1.00 7.48 H new ATOM 0 HG13 VAL B 174 -2.519 -3.826 -0.711 1.00 7.48 H new ATOM 0 HG21 VAL B 174 -2.262 -2.892 -3.621 1.00 7.46 H new ATOM 0 HG22 VAL B 174 -1.210 -2.391 -2.277 1.00 7.46 H new ATOM 0 HG23 VAL B 174 -0.499 -3.094 -3.749 1.00 7.46 H new ATOM 679 N ARG B 175 -0.424 -6.720 -0.154 1.00 12.04 N ATOM 680 CA ARG B 175 -0.406 -8.168 0.203 1.00 13.07 C ATOM 681 C ARG B 175 -1.474 -8.451 1.261 1.00 15.49 C ATOM 682 O ARG B 175 -2.000 -7.550 1.884 1.00 11.34 O ATOM 683 CB ARG B 175 0.972 -8.549 0.755 1.00 10.24 C ATOM 684 CG ARG B 175 1.560 -7.373 1.539 1.00 10.97 C ATOM 685 CD ARG B 175 2.591 -6.649 0.671 1.00 8.81 C ATOM 686 NE ARG B 175 3.566 -7.638 0.130 1.00 7.82 N ATOM 687 CZ ARG B 175 4.003 -7.520 -1.095 1.00 8.03 C ATOM 688 NH1 ARG B 175 3.178 -7.198 -2.054 1.00 11.06 N ATOM 689 NH2 ARG B 175 5.264 -7.724 -1.361 1.00 7.60 N ATOM 0 H ARG B 175 -0.654 -6.086 0.611 1.00 12.04 H new ATOM 0 HA ARG B 175 -0.614 -8.758 -0.690 1.00 13.07 H new ATOM 0 HB2 ARG B 175 0.886 -9.422 1.402 1.00 10.24 H new ATOM 0 HB3 ARG B 175 1.639 -8.822 -0.063 1.00 10.24 H new ATOM 0 HG2 ARG B 175 0.767 -6.685 1.832 1.00 10.97 H new ATOM 0 HG3 ARG B 175 2.027 -7.731 2.456 1.00 10.97 H new ATOM 0 HD2 ARG B 175 2.093 -6.129 -0.147 1.00 8.81 H new ATOM 0 HD3 ARG B 175 3.111 -5.893 1.259 1.00 8.81 H new ATOM 0 HE ARG B 175 3.892 -8.407 0.716 1.00 7.82 H new ATOM 0 HH11 ARG B 175 2.192 -7.039 -1.847 1.00 11.06 H new ATOM 0 HH12 ARG B 175 3.519 -7.106 -3.011 1.00 11.06 H new ATOM 0 HH21 ARG B 175 5.909 -7.976 -0.612 1.00 7.60 H new ATOM 0 HH22 ARG B 175 5.605 -7.632 -2.318 1.00 7.60 H new ATOM 703 N GLU B 176 -1.799 -9.697 1.468 1.00 20.91 N ATOM 704 CA GLU B 176 -2.833 -10.040 2.484 1.00 26.31 C ATOM 705 C GLU B 176 -2.331 -9.643 3.874 1.00 29.76 C ATOM 706 O GLU B 176 -1.351 -10.168 4.363 1.00 30.61 O ATOM 707 CB GLU B 176 -3.100 -11.546 2.450 1.00 25.39 C ATOM 708 CG GLU B 176 -4.606 -11.797 2.339 1.00 29.84 C ATOM 709 CD GLU B 176 -4.865 -12.906 1.317 1.00 32.50 C ATOM 710 OE1 GLU B 176 -4.523 -12.712 0.163 1.00 36.79 O ATOM 711 OE2 GLU B 176 -5.401 -13.931 1.707 1.00 34.32 O ATOM 0 H GLU B 176 -1.393 -10.493 0.977 1.00 20.91 H new ATOM 0 HA GLU B 176 -3.755 -9.502 2.262 1.00 26.31 H new ATOM 0 HB2 GLU B 176 -2.582 -11.999 1.604 1.00 25.39 H new ATOM 0 HB3 GLU B 176 -2.708 -12.016 3.352 1.00 25.39 H new ATOM 0 HG2 GLU B 176 -5.011 -12.081 3.310 1.00 29.84 H new ATOM 0 HG3 GLU B 176 -5.116 -10.883 2.036 1.00 29.84 H new ATOM 718 N SER B 177 -2.994 -8.720 4.514 1.00 36.14 N ATOM 719 CA SER B 177 -2.553 -8.292 5.871 1.00 41.98 C ATOM 720 C SER B 177 -2.327 -9.528 6.744 1.00 43.00 C ATOM 721 O SER B 177 -3.251 -10.243 7.074 1.00 43.66 O ATOM 722 CB SER B 177 -3.631 -7.411 6.504 1.00 45.78 C ATOM 723 OG SER B 177 -3.018 -6.279 7.105 1.00 51.84 O ATOM 0 H SER B 177 -3.822 -8.244 4.156 1.00 36.14 H new ATOM 0 HA SER B 177 -1.624 -7.727 5.791 1.00 41.98 H new ATOM 0 HB2 SER B 177 -4.347 -7.092 5.747 1.00 45.78 H new ATOM 0 HB3 SER B 177 -4.188 -7.977 7.251 1.00 45.78 H new ATOM 0 HG SER B 177 -3.522 -6.020 7.904 1.00 51.84 H new ATOM 729 N GLU B 178 -1.105 -9.787 7.120 1.00 23.97 N ATOM 730 CA GLU B 178 -0.828 -10.979 7.970 1.00 25.52 C ATOM 731 C GLU B 178 -1.557 -10.832 9.308 1.00 30.02 C ATOM 732 O GLU B 178 -1.936 -11.806 9.929 1.00 31.55 O ATOM 733 CB GLU B 178 0.678 -11.089 8.218 1.00 23.29 C ATOM 734 CG GLU B 178 1.368 -11.594 6.950 1.00 29.79 C ATOM 735 CD GLU B 178 0.878 -13.008 6.629 1.00 33.17 C ATOM 736 OE1 GLU B 178 1.403 -13.943 7.211 1.00 39.84 O ATOM 737 OE2 GLU B 178 -0.016 -13.132 5.807 1.00 21.15 O ATOM 0 H GLU B 178 -0.288 -9.227 6.876 1.00 23.97 H new ATOM 0 HA GLU B 178 -1.179 -11.877 7.462 1.00 25.52 H new ATOM 0 HB2 GLU B 178 1.082 -10.118 8.503 1.00 23.29 H new ATOM 0 HB3 GLU B 178 0.872 -11.770 9.046 1.00 23.29 H new ATOM 0 HG2 GLU B 178 1.154 -10.926 6.116 1.00 29.79 H new ATOM 0 HG3 GLU B 178 2.449 -11.595 7.088 1.00 29.79 H new ATOM 744 N THR B 179 -1.757 -9.623 9.756 1.00 26.98 N ATOM 745 CA THR B 179 -2.460 -9.414 11.051 1.00 31.67 C ATOM 746 C THR B 179 -3.970 -9.352 10.810 1.00 34.54 C ATOM 747 O THR B 179 -4.760 -9.688 11.670 1.00 34.85 O ATOM 748 CB THR B 179 -1.989 -8.099 11.677 1.00 26.17 C ATOM 749 OG1 THR B 179 -2.700 -7.018 11.090 1.00 28.58 O ATOM 750 CG2 THR B 179 -0.490 -7.921 11.430 1.00 35.55 C ATOM 0 H THR B 179 -1.463 -8.770 9.280 1.00 26.98 H new ATOM 0 HA THR B 179 -2.235 -10.241 11.725 1.00 31.67 H new ATOM 0 HB THR B 179 -2.177 -8.119 12.751 1.00 26.17 H new ATOM 0 HG1 THR B 179 -2.402 -6.175 11.490 1.00 28.58 H new ATOM 0 HG21 THR B 179 -0.156 -6.984 11.876 1.00 35.55 H new ATOM 0 HG22 THR B 179 0.054 -8.751 11.880 1.00 35.55 H new ATOM 0 HG23 THR B 179 -0.298 -7.900 10.357 1.00 35.55 H new ATOM 758 N THR B 180 -4.376 -8.923 9.646 1.00 27.03 N ATOM 759 CA THR B 180 -5.836 -8.839 9.351 1.00 25.08 C ATOM 760 C THR B 180 -6.257 -10.045 8.509 1.00 30.09 C ATOM 761 O THR B 180 -5.503 -10.540 7.697 1.00 30.04 O ATOM 762 CB THR B 180 -6.124 -7.550 8.575 1.00 29.37 C ATOM 763 OG1 THR B 180 -5.182 -6.554 8.948 1.00 38.10 O ATOM 764 CG2 THR B 180 -7.538 -7.063 8.895 1.00 40.88 C ATOM 0 H THR B 180 -3.762 -8.627 8.887 1.00 27.03 H new ATOM 0 HA THR B 180 -6.397 -8.836 10.286 1.00 25.08 H new ATOM 0 HB THR B 180 -6.044 -7.745 7.506 1.00 29.37 H new ATOM 0 HG1 THR B 180 -5.364 -5.729 8.451 1.00 38.10 H new ATOM 0 HG21 THR B 180 -7.741 -6.146 8.342 1.00 40.88 H new ATOM 0 HG22 THR B 180 -8.260 -7.827 8.607 1.00 40.88 H new ATOM 0 HG23 THR B 180 -7.622 -6.868 9.964 1.00 40.88 H new ATOM 772 N LYS B 181 -7.456 -10.524 8.696 1.00 32.42 N ATOM 773 CA LYS B 181 -7.919 -11.698 7.906 1.00 38.97 C ATOM 774 C LYS B 181 -9.053 -11.272 6.972 1.00 35.28 C ATOM 775 O LYS B 181 -10.175 -11.072 7.393 1.00 34.92 O ATOM 776 CB LYS B 181 -8.422 -12.786 8.856 1.00 51.02 C ATOM 777 CG LYS B 181 -8.344 -14.147 8.163 1.00 72.35 C ATOM 778 CD LYS B 181 -9.592 -14.964 8.499 1.00 84.05 C ATOM 779 CE LYS B 181 -9.496 -16.340 7.836 1.00 88.20 C ATOM 780 NZ LYS B 181 -10.118 -16.283 6.482 1.00 87.98 N ATOM 0 H LYS B 181 -8.134 -10.153 9.361 1.00 32.42 H new ATOM 0 HA LYS B 181 -7.090 -12.086 7.315 1.00 38.97 H new ATOM 0 HB2 LYS B 181 -7.822 -12.795 9.766 1.00 51.02 H new ATOM 0 HB3 LYS B 181 -9.449 -12.576 9.154 1.00 51.02 H new ATOM 0 HG2 LYS B 181 -8.264 -14.013 7.084 1.00 72.35 H new ATOM 0 HG3 LYS B 181 -7.450 -14.680 8.486 1.00 72.35 H new ATOM 0 HD2 LYS B 181 -9.687 -15.075 9.579 1.00 84.05 H new ATOM 0 HD3 LYS B 181 -10.485 -14.443 8.152 1.00 84.05 H new ATOM 0 HE2 LYS B 181 -8.453 -16.645 7.756 1.00 88.20 H new ATOM 0 HE3 LYS B 181 -10.001 -17.087 8.449 1.00 88.20 H new ATOM 0 HZ1 LYS B 181 -10.053 -17.218 6.031 1.00 87.98 H new ATOM 0 HZ2 LYS B 181 -11.118 -16.010 6.570 1.00 87.98 H new ATOM 0 HZ3 LYS B 181 -9.618 -15.582 5.899 1.00 87.98 H new ATOM 794 N GLY B 182 -8.771 -11.132 5.705 1.00 38.03 N ATOM 795 CA GLY B 182 -9.835 -10.720 4.746 1.00 30.70 C ATOM 796 C GLY B 182 -9.490 -9.355 4.149 1.00 29.58 C ATOM 797 O GLY B 182 -9.944 -9.004 3.078 1.00 31.67 O ATOM 0 H GLY B 182 -7.851 -11.285 5.293 1.00 38.03 H new ATOM 0 HA2 GLY B 182 -9.930 -11.461 3.953 1.00 30.70 H new ATOM 0 HA3 GLY B 182 -10.798 -10.672 5.255 1.00 30.70 H new ATOM 801 N ALA B 183 -8.691 -8.581 4.832 1.00 35.86 N ATOM 802 CA ALA B 183 -8.322 -7.240 4.298 1.00 32.70 C ATOM 803 C ALA B 183 -6.854 -7.247 3.865 1.00 28.65 C ATOM 804 O ALA B 183 -6.016 -7.874 4.484 1.00 29.39 O ATOM 805 CB ALA B 183 -8.528 -6.185 5.386 1.00 31.44 C ATOM 0 H ALA B 183 -8.279 -8.819 5.734 1.00 35.86 H new ATOM 0 HA ALA B 183 -8.951 -7.006 3.439 1.00 32.70 H new ATOM 0 HB1 ALA B 183 -8.258 -5.203 4.997 1.00 31.44 H new ATOM 0 HB2 ALA B 183 -9.574 -6.179 5.693 1.00 31.44 H new ATOM 0 HB3 ALA B 183 -7.899 -6.420 6.245 1.00 31.44 H new ATOM 811 N TYR B 184 -6.536 -6.553 2.807 1.00 24.43 N ATOM 812 CA TYR B 184 -5.124 -6.519 2.334 1.00 19.69 C ATOM 813 C TYR B 184 -4.415 -5.303 2.933 1.00 15.67 C ATOM 814 O TYR B 184 -4.944 -4.622 3.789 1.00 11.54 O ATOM 815 CB TYR B 184 -5.100 -6.423 0.807 1.00 20.89 C ATOM 816 CG TYR B 184 -5.912 -7.551 0.210 1.00 21.46 C ATOM 817 CD1 TYR B 184 -6.001 -8.786 0.875 1.00 23.38 C ATOM 818 CD2 TYR B 184 -6.577 -7.365 -1.015 1.00 21.81 C ATOM 819 CE1 TYR B 184 -6.754 -9.833 0.318 1.00 24.77 C ATOM 820 CE2 TYR B 184 -7.330 -8.413 -1.571 1.00 21.77 C ATOM 821 CZ TYR B 184 -7.419 -9.646 -0.905 1.00 25.72 C ATOM 822 OH TYR B 184 -8.159 -10.674 -1.452 1.00 27.17 O ATOM 0 H TYR B 184 -7.194 -6.008 2.250 1.00 24.43 H new ATOM 0 HA TYR B 184 -4.613 -7.429 2.649 1.00 19.69 H new ATOM 0 HB2 TYR B 184 -5.505 -5.463 0.487 1.00 20.89 H new ATOM 0 HB3 TYR B 184 -4.073 -6.472 0.446 1.00 20.89 H new ATOM 0 HD1 TYR B 184 -5.490 -8.930 1.815 1.00 23.38 H new ATOM 0 HD2 TYR B 184 -6.509 -6.417 -1.528 1.00 21.81 H new ATOM 0 HE1 TYR B 184 -6.822 -10.782 0.830 1.00 24.77 H new ATOM 0 HE2 TYR B 184 -7.841 -8.270 -2.512 1.00 21.77 H new ATOM 0 HH TYR B 184 -8.554 -10.378 -2.298 1.00 27.17 H new ATOM 832 N CYS B 185 -3.220 -5.024 2.489 1.00 12.49 N ATOM 833 CA CYS B 185 -2.479 -3.851 3.032 1.00 13.07 C ATOM 834 C CYS B 185 -1.652 -3.210 1.917 1.00 11.90 C ATOM 835 O CYS B 185 -0.821 -3.849 1.301 1.00 11.52 O ATOM 836 CB CYS B 185 -1.549 -4.308 4.159 1.00 13.05 C ATOM 837 SG CYS B 185 -0.738 -5.856 3.686 1.00 27.90 S ATOM 0 H CYS B 185 -2.725 -5.557 1.774 1.00 12.49 H new ATOM 0 HA CYS B 185 -3.190 -3.123 3.422 1.00 13.07 H new ATOM 0 HB2 CYS B 185 -0.801 -3.541 4.361 1.00 13.05 H new ATOM 0 HB3 CYS B 185 -2.117 -4.449 5.078 1.00 13.05 H new ATOM 0 HG CYS B 185 -1.600 -6.638 3.107 1.00 27.90 H new ATOM 843 N LEU B 186 -1.876 -1.952 1.651 1.00 10.41 N ATOM 844 CA LEU B 186 -1.104 -1.266 0.576 1.00 10.82 C ATOM 845 C LEU B 186 0.049 -0.476 1.202 1.00 10.91 C ATOM 846 O LEU B 186 -0.149 0.571 1.784 1.00 11.30 O ATOM 847 CB LEU B 186 -2.031 -0.310 -0.183 1.00 8.57 C ATOM 848 CG LEU B 186 -1.205 0.590 -1.104 1.00 8.23 C ATOM 849 CD1 LEU B 186 -0.532 -0.260 -2.183 1.00 10.17 C ATOM 850 CD2 LEU B 186 -2.124 1.617 -1.768 1.00 8.76 C ATOM 0 H LEU B 186 -2.561 -1.369 2.132 1.00 10.41 H new ATOM 0 HA LEU B 186 -0.701 -2.006 -0.115 1.00 10.82 H new ATOM 0 HB2 LEU B 186 -2.755 -0.878 -0.768 1.00 8.57 H new ATOM 0 HB3 LEU B 186 -2.598 0.298 0.522 1.00 8.57 H new ATOM 0 HG LEU B 186 -0.442 1.104 -0.519 1.00 8.23 H new ATOM 0 HD11 LEU B 186 0.056 0.383 -2.838 1.00 10.17 H new ATOM 0 HD12 LEU B 186 0.122 -0.994 -1.713 1.00 10.17 H new ATOM 0 HD13 LEU B 186 -1.294 -0.775 -2.768 1.00 10.17 H new ATOM 0 HD21 LEU B 186 -1.537 2.259 -2.425 1.00 8.76 H new ATOM 0 HD22 LEU B 186 -2.886 1.100 -2.352 1.00 8.76 H new ATOM 0 HD23 LEU B 186 -2.605 2.224 -1.001 1.00 8.76 H new ATOM 862 N SER B 187 1.252 -0.967 1.084 1.00 10.50 N ATOM 863 CA SER B 187 2.415 -0.241 1.671 1.00 9.18 C ATOM 864 C SER B 187 3.037 0.667 0.608 1.00 8.50 C ATOM 865 O SER B 187 2.792 0.514 -0.572 1.00 9.53 O ATOM 866 CB SER B 187 3.457 -1.250 2.153 1.00 7.49 C ATOM 867 OG SER B 187 2.803 -2.313 2.833 1.00 5.18 O ATOM 0 H SER B 187 1.480 -1.839 0.607 1.00 10.50 H new ATOM 0 HA SER B 187 2.079 0.363 2.514 1.00 9.18 H new ATOM 0 HB2 SER B 187 4.023 -1.638 1.306 1.00 7.49 H new ATOM 0 HB3 SER B 187 4.171 -0.763 2.817 1.00 7.49 H new ATOM 0 HG SER B 187 3.469 -2.962 3.142 1.00 5.18 H new ATOM 873 N VAL B 188 3.842 1.613 1.015 1.00 11.78 N ATOM 874 CA VAL B 188 4.476 2.527 0.022 1.00 12.79 C ATOM 875 C VAL B 188 5.911 2.841 0.453 1.00 14.65 C ATOM 876 O VAL B 188 6.292 2.625 1.587 1.00 14.43 O ATOM 877 CB VAL B 188 3.675 3.827 -0.058 1.00 12.22 C ATOM 878 CG1 VAL B 188 4.272 4.729 -1.141 1.00 11.34 C ATOM 879 CG2 VAL B 188 2.220 3.509 -0.407 1.00 12.23 C ATOM 0 H VAL B 188 4.087 1.791 1.989 1.00 11.78 H new ATOM 0 HA VAL B 188 4.489 2.044 -0.955 1.00 12.79 H new ATOM 0 HB VAL B 188 3.716 4.338 0.904 1.00 12.22 H new ATOM 0 HG11 VAL B 188 3.701 5.656 -1.198 1.00 11.34 H new ATOM 0 HG12 VAL B 188 5.309 4.956 -0.894 1.00 11.34 H new ATOM 0 HG13 VAL B 188 4.232 4.218 -2.103 1.00 11.34 H new ATOM 0 HG21 VAL B 188 1.649 4.436 -0.464 1.00 12.23 H new ATOM 0 HG22 VAL B 188 2.180 2.998 -1.369 1.00 12.23 H new ATOM 0 HG23 VAL B 188 1.793 2.866 0.363 1.00 12.23 H new ATOM 889 N SER B 189 6.708 3.354 -0.445 1.00 14.39 N ATOM 890 CA SER B 189 8.118 3.686 -0.091 1.00 13.97 C ATOM 891 C SER B 189 8.263 5.202 0.057 1.00 14.32 C ATOM 892 O SER B 189 7.480 5.965 -0.475 1.00 13.16 O ATOM 893 CB SER B 189 9.051 3.193 -1.199 1.00 12.52 C ATOM 894 OG SER B 189 8.453 3.449 -2.464 1.00 13.11 O ATOM 0 H SER B 189 6.444 3.558 -1.409 1.00 14.39 H new ATOM 0 HA SER B 189 8.380 3.201 0.849 1.00 13.97 H new ATOM 0 HB2 SER B 189 10.015 3.698 -1.130 1.00 12.52 H new ATOM 0 HB3 SER B 189 9.241 2.126 -1.083 1.00 12.52 H new ATOM 0 HG SER B 189 7.628 2.926 -2.548 1.00 13.11 H new ATOM 900 N ASP B 190 9.259 5.646 0.775 1.00 17.22 N ATOM 901 CA ASP B 190 9.450 7.114 0.954 1.00 20.71 C ATOM 902 C ASP B 190 10.946 7.427 1.039 1.00 19.82 C ATOM 903 O ASP B 190 11.739 6.609 1.460 1.00 20.14 O ATOM 904 CB ASP B 190 8.759 7.564 2.242 1.00 25.05 C ATOM 905 CG ASP B 190 8.690 9.092 2.278 1.00 26.93 C ATOM 906 OD1 ASP B 190 7.822 9.642 1.622 1.00 30.74 O ATOM 907 OD2 ASP B 190 9.508 9.686 2.961 1.00 31.13 O ATOM 0 H ASP B 190 9.947 5.057 1.244 1.00 17.22 H new ATOM 0 HA ASP B 190 9.017 7.644 0.106 1.00 20.71 H new ATOM 0 HB2 ASP B 190 7.755 7.143 2.295 1.00 25.05 H new ATOM 0 HB3 ASP B 190 9.306 7.194 3.109 1.00 25.05 H new ATOM 912 N PHE B 191 11.337 8.608 0.643 1.00 21.67 N ATOM 913 CA PHE B 191 12.780 8.975 0.702 1.00 24.27 C ATOM 914 C PHE B 191 12.921 10.427 1.164 1.00 28.02 C ATOM 915 O PHE B 191 12.148 11.286 0.788 1.00 25.66 O ATOM 916 CB PHE B 191 13.402 8.818 -0.687 1.00 23.13 C ATOM 917 CG PHE B 191 14.815 9.354 -0.670 1.00 21.13 C ATOM 918 CD1 PHE B 191 15.882 8.509 -0.325 1.00 20.50 C ATOM 919 CD2 PHE B 191 15.060 10.698 -1.000 1.00 18.20 C ATOM 920 CE1 PHE B 191 17.196 9.007 -0.311 1.00 19.46 C ATOM 921 CE2 PHE B 191 16.374 11.196 -0.985 1.00 16.51 C ATOM 922 CZ PHE B 191 17.442 10.351 -0.640 1.00 17.79 C ATOM 0 H PHE B 191 10.719 9.334 0.281 1.00 21.67 H new ATOM 0 HA PHE B 191 13.293 8.320 1.407 1.00 24.27 H new ATOM 0 HB2 PHE B 191 13.403 7.768 -0.980 1.00 23.13 H new ATOM 0 HB3 PHE B 191 12.807 9.354 -1.426 1.00 23.13 H new ATOM 0 HD1 PHE B 191 15.693 7.477 -0.070 1.00 20.50 H new ATOM 0 HD2 PHE B 191 14.239 11.348 -1.265 1.00 18.20 H new ATOM 0 HE1 PHE B 191 18.017 8.357 -0.047 1.00 19.46 H new ATOM 0 HE2 PHE B 191 16.563 12.229 -1.239 1.00 16.51 H new ATOM 0 HZ PHE B 191 18.452 10.734 -0.628 1.00 17.79 H new ATOM 932 N ASP B 192 13.903 10.708 1.977 1.00 32.66 N ATOM 933 CA ASP B 192 14.094 12.104 2.461 1.00 38.82 C ATOM 934 C ASP B 192 15.564 12.498 2.317 1.00 41.14 C ATOM 935 O ASP B 192 16.433 11.658 2.191 1.00 38.49 O ATOM 936 CB ASP B 192 13.683 12.196 3.933 1.00 42.78 C ATOM 937 CG ASP B 192 13.236 13.625 4.249 1.00 45.03 C ATOM 938 OD1 ASP B 192 14.088 14.428 4.593 1.00 46.40 O ATOM 939 OD2 ASP B 192 12.050 13.890 4.144 1.00 49.15 O ATOM 0 H ASP B 192 14.581 10.031 2.327 1.00 32.66 H new ATOM 0 HA ASP B 192 13.477 12.780 1.869 1.00 38.82 H new ATOM 0 HB2 ASP B 192 12.873 11.496 4.140 1.00 42.78 H new ATOM 0 HB3 ASP B 192 14.519 11.915 4.573 1.00 42.78 H new ATOM 944 N ASN B 193 15.850 13.771 2.333 1.00 45.91 N ATOM 945 CA ASN B 193 17.261 14.221 2.197 1.00 50.53 C ATOM 946 C ASN B 193 17.814 14.601 3.572 1.00 51.37 C ATOM 947 O ASN B 193 18.271 15.707 3.782 1.00 52.38 O ATOM 948 CB ASN B 193 17.322 15.435 1.268 1.00 54.84 C ATOM 949 CG ASN B 193 17.441 14.964 -0.182 1.00 60.46 C ATOM 950 OD1 ASN B 193 17.857 13.852 -0.440 1.00 63.78 O ATOM 951 ND2 ASN B 193 17.092 15.769 -1.148 1.00 62.09 N ATOM 0 H ASN B 193 15.164 14.519 2.435 1.00 45.91 H new ATOM 0 HA ASN B 193 17.860 13.412 1.778 1.00 50.53 H new ATOM 0 HB2 ASN B 193 16.427 16.045 1.391 1.00 54.84 H new ATOM 0 HB3 ASN B 193 18.174 16.063 1.528 1.00 54.84 H new ATOM 0 HD21 ASN B 193 17.169 15.464 -2.118 1.00 62.09 H new ATOM 0 HD22 ASN B 193 16.743 16.703 -0.933 1.00 62.09 H new ATOM 958 N ALA B 194 17.774 13.695 4.510 1.00 51.03 N ATOM 959 CA ALA B 194 18.297 14.009 5.870 1.00 49.87 C ATOM 960 C ALA B 194 18.831 12.730 6.519 1.00 48.78 C ATOM 961 O ALA B 194 20.019 12.570 6.711 1.00 50.16 O ATOM 962 CB ALA B 194 17.170 14.584 6.730 1.00 50.70 C ATOM 0 H ALA B 194 17.402 12.752 4.394 1.00 51.03 H new ATOM 0 HA ALA B 194 19.102 14.740 5.790 1.00 49.87 H new ATOM 0 HB1 ALA B 194 17.552 14.814 7.725 1.00 50.70 H new ATOM 0 HB2 ALA B 194 16.789 15.495 6.269 1.00 50.70 H new ATOM 0 HB3 ALA B 194 16.365 13.854 6.810 1.00 50.70 H new ATOM 968 N LYS B 195 17.962 11.819 6.862 1.00 45.35 N ATOM 969 CA LYS B 195 18.421 10.554 7.499 1.00 41.76 C ATOM 970 C LYS B 195 18.488 9.445 6.446 1.00 38.59 C ATOM 971 O LYS B 195 19.435 8.685 6.390 1.00 39.85 O ATOM 972 CB LYS B 195 17.437 10.151 8.600 1.00 42.95 C ATOM 973 CG LYS B 195 17.793 10.884 9.895 1.00 45.27 C ATOM 974 CD LYS B 195 18.612 9.959 10.797 1.00 47.56 C ATOM 975 CE LYS B 195 17.896 9.787 12.138 1.00 50.16 C ATOM 976 NZ LYS B 195 16.547 9.199 11.910 1.00 50.69 N ATOM 0 H LYS B 195 16.954 11.897 6.728 1.00 45.35 H new ATOM 0 HA LYS B 195 19.410 10.705 7.931 1.00 41.76 H new ATOM 0 HB2 LYS B 195 16.418 10.395 8.299 1.00 42.95 H new ATOM 0 HB3 LYS B 195 17.473 9.073 8.758 1.00 42.95 H new ATOM 0 HG2 LYS B 195 18.361 11.786 9.670 1.00 45.27 H new ATOM 0 HG3 LYS B 195 16.885 11.199 10.408 1.00 45.27 H new ATOM 0 HD2 LYS B 195 18.745 8.990 10.317 1.00 47.56 H new ATOM 0 HD3 LYS B 195 19.607 10.375 10.955 1.00 47.56 H new ATOM 0 HE2 LYS B 195 18.480 9.141 12.794 1.00 50.16 H new ATOM 0 HE3 LYS B 195 17.804 10.750 12.639 1.00 50.16 H new ATOM 0 HZ1 LYS B 195 16.294 8.589 12.713 1.00 50.69 H new ATOM 0 HZ2 LYS B 195 15.846 9.962 11.821 1.00 50.69 H new ATOM 0 HZ3 LYS B 195 16.557 8.635 11.036 1.00 50.69 H new ATOM 990 N GLY B 196 17.491 9.348 5.610 1.00 34.40 N ATOM 991 CA GLY B 196 17.500 8.288 4.561 1.00 29.38 C ATOM 992 C GLY B 196 16.071 8.040 4.074 1.00 25.82 C ATOM 993 O GLY B 196 15.261 8.943 4.015 1.00 25.14 O ATOM 0 H GLY B 196 16.672 9.955 5.607 1.00 34.40 H new ATOM 0 HA2 GLY B 196 18.132 8.592 3.727 1.00 29.38 H new ATOM 0 HA3 GLY B 196 17.924 7.367 4.963 1.00 29.38 H new ATOM 997 N LEU B 197 15.756 6.823 3.724 1.00 25.09 N ATOM 998 CA LEU B 197 14.379 6.521 3.241 1.00 24.92 C ATOM 999 C LEU B 197 13.630 5.719 4.308 1.00 23.75 C ATOM 1000 O LEU B 197 14.228 5.099 5.166 1.00 23.93 O ATOM 1001 CB LEU B 197 14.456 5.703 1.950 1.00 25.84 C ATOM 1002 CG LEU B 197 15.426 4.537 2.141 1.00 30.07 C ATOM 1003 CD1 LEU B 197 14.774 3.244 1.646 1.00 29.71 C ATOM 1004 CD2 LEU B 197 16.703 4.800 1.340 1.00 30.59 C ATOM 0 H LEU B 197 16.392 6.026 3.752 1.00 25.09 H new ATOM 0 HA LEU B 197 13.850 7.454 3.047 1.00 24.92 H new ATOM 0 HB2 LEU B 197 13.467 5.328 1.685 1.00 25.84 H new ATOM 0 HB3 LEU B 197 14.788 6.335 1.126 1.00 25.84 H new ATOM 0 HG LEU B 197 15.672 4.439 3.198 1.00 30.07 H new ATOM 0 HD11 LEU B 197 15.466 2.413 1.782 1.00 29.71 H new ATOM 0 HD12 LEU B 197 13.863 3.055 2.214 1.00 29.71 H new ATOM 0 HD13 LEU B 197 14.528 3.342 0.589 1.00 29.71 H new ATOM 0 HD21 LEU B 197 17.395 3.969 1.476 1.00 30.59 H new ATOM 0 HD22 LEU B 197 16.456 4.897 0.283 1.00 30.59 H new ATOM 0 HD23 LEU B 197 17.169 5.721 1.690 1.00 30.59 H new ATOM 1016 N ASN B 198 12.327 5.727 4.262 1.00 21.78 N ATOM 1017 CA ASN B 198 11.540 4.965 5.273 1.00 19.17 C ATOM 1018 C ASN B 198 10.401 4.220 4.576 1.00 16.90 C ATOM 1019 O ASN B 198 10.164 4.390 3.396 1.00 15.60 O ATOM 1020 CB ASN B 198 10.961 5.935 6.304 1.00 18.45 C ATOM 1021 CG ASN B 198 12.015 6.983 6.668 1.00 20.04 C ATOM 1022 OD1 ASN B 198 12.283 7.941 5.824 1.00 23.65 O flip ATOM 1023 ND2 ASN B 198 12.600 6.929 7.732 1.00 21.55 N flip ATOM 0 H ASN B 198 11.772 6.228 3.568 1.00 21.78 H new ATOM 0 HA ASN B 198 12.189 4.247 5.774 1.00 19.17 H new ATOM 0 HB2 ASN B 198 10.073 6.422 5.902 1.00 18.45 H new ATOM 0 HB3 ASN B 198 10.650 5.391 7.196 1.00 18.45 H new ATOM 0 HD21 ASN B 198 12.390 6.180 8.392 1.00 21.55 H new ATOM 0 HD22 ASN B 198 13.301 7.633 7.965 1.00 21.55 H new ATOM 1030 N VAL B 199 9.692 3.393 5.297 1.00 14.62 N ATOM 1031 CA VAL B 199 8.568 2.638 4.675 1.00 11.82 C ATOM 1032 C VAL B 199 7.279 2.916 5.451 1.00 10.68 C ATOM 1033 O VAL B 199 7.240 2.821 6.662 1.00 13.24 O ATOM 1034 CB VAL B 199 8.874 1.140 4.719 1.00 9.61 C ATOM 1035 CG1 VAL B 199 7.691 0.361 4.143 1.00 11.94 C ATOM 1036 CG2 VAL B 199 10.126 0.850 3.888 1.00 10.00 C ATOM 0 H VAL B 199 9.843 3.208 6.289 1.00 14.62 H new ATOM 0 HA VAL B 199 8.446 2.954 3.639 1.00 11.82 H new ATOM 0 HB VAL B 199 9.043 0.835 5.752 1.00 9.61 H new ATOM 0 HG11 VAL B 199 7.909 -0.707 4.174 1.00 11.94 H new ATOM 0 HG12 VAL B 199 6.798 0.567 4.733 1.00 11.94 H new ATOM 0 HG13 VAL B 199 7.522 0.667 3.111 1.00 11.94 H new ATOM 0 HG21 VAL B 199 10.344 -0.217 3.919 1.00 10.00 H new ATOM 0 HG22 VAL B 199 9.956 1.156 2.856 1.00 10.00 H new ATOM 0 HG23 VAL B 199 10.970 1.405 4.297 1.00 10.00 H new ATOM 1046 N LYS B 200 6.224 3.257 4.765 1.00 11.30 N ATOM 1047 CA LYS B 200 4.940 3.538 5.467 1.00 11.14 C ATOM 1048 C LYS B 200 3.902 2.488 5.066 1.00 8.78 C ATOM 1049 O LYS B 200 3.501 2.400 3.923 1.00 9.63 O ATOM 1050 CB LYS B 200 4.437 4.930 5.077 1.00 11.27 C ATOM 1051 CG LYS B 200 5.022 5.969 6.038 1.00 16.97 C ATOM 1052 CD LYS B 200 4.843 7.369 5.449 1.00 21.04 C ATOM 1053 CE LYS B 200 5.285 8.414 6.475 1.00 28.12 C ATOM 1054 NZ LYS B 200 6.147 9.431 5.808 1.00 32.40 N ATOM 0 H LYS B 200 6.195 3.353 3.750 1.00 11.30 H new ATOM 0 HA LYS B 200 5.099 3.500 6.545 1.00 11.14 H new ATOM 0 HB2 LYS B 200 4.729 5.161 4.053 1.00 11.27 H new ATOM 0 HB3 LYS B 200 3.348 4.958 5.112 1.00 11.27 H new ATOM 0 HG2 LYS B 200 4.525 5.904 7.006 1.00 16.97 H new ATOM 0 HG3 LYS B 200 6.080 5.767 6.208 1.00 16.97 H new ATOM 0 HD2 LYS B 200 5.430 7.469 4.536 1.00 21.04 H new ATOM 0 HD3 LYS B 200 3.800 7.530 5.176 1.00 21.04 H new ATOM 0 HE2 LYS B 200 4.413 8.895 6.919 1.00 28.12 H new ATOM 0 HE3 LYS B 200 5.832 7.934 7.287 1.00 28.12 H new ATOM 0 HZ1 LYS B 200 6.448 10.142 6.505 1.00 32.40 H new ATOM 0 HZ2 LYS B 200 6.985 8.965 5.405 1.00 32.40 H new ATOM 0 HZ3 LYS B 200 5.610 9.896 5.048 1.00 32.40 H new ATOM 1068 N HIS B 201 3.470 1.685 6.000 1.00 7.82 N ATOM 1069 CA HIS B 201 2.464 0.635 5.675 1.00 7.41 C ATOM 1070 C HIS B 201 1.053 1.214 5.805 1.00 9.79 C ATOM 1071 O HIS B 201 0.676 1.729 6.837 1.00 10.36 O ATOM 1072 CB HIS B 201 2.621 -0.536 6.646 1.00 6.15 C ATOM 1073 CG HIS B 201 4.056 -0.987 6.660 1.00 5.80 C ATOM 1074 ND1 HIS B 201 4.705 -1.350 7.830 1.00 7.97 N ATOM 1075 CD2 HIS B 201 4.980 -1.138 5.656 1.00 7.69 C ATOM 1076 CE1 HIS B 201 5.963 -1.698 7.505 1.00 7.75 C ATOM 1077 NE2 HIS B 201 6.183 -1.586 6.192 1.00 6.51 N ATOM 0 H HIS B 201 3.771 1.711 6.974 1.00 7.82 H new ATOM 0 HA HIS B 201 2.621 0.289 4.653 1.00 7.41 H new ATOM 0 HB2 HIS B 201 2.313 -0.236 7.648 1.00 6.15 H new ATOM 0 HB3 HIS B 201 1.973 -1.360 6.347 1.00 6.15 H new ATOM 0 HD1 HIS B 201 4.302 -1.353 8.767 1.00 7.97 H new ATOM 0 HD2 HIS B 201 4.800 -0.939 4.610 1.00 7.69 H new ATOM 0 HE1 HIS B 201 6.704 -2.028 8.218 1.00 7.75 H new ATOM 1085 N TYR B 202 0.270 1.129 4.765 1.00 10.61 N ATOM 1086 CA TYR B 202 -1.117 1.667 4.831 1.00 10.61 C ATOM 1087 C TYR B 202 -2.112 0.512 4.719 1.00 10.67 C ATOM 1088 O TYR B 202 -2.524 0.137 3.639 1.00 11.97 O ATOM 1089 CB TYR B 202 -1.341 2.648 3.679 1.00 10.02 C ATOM 1090 CG TYR B 202 -0.867 4.022 4.089 1.00 10.20 C ATOM 1091 CD1 TYR B 202 -1.738 4.891 4.766 1.00 10.92 C ATOM 1092 CD2 TYR B 202 0.446 4.429 3.796 1.00 9.08 C ATOM 1093 CE1 TYR B 202 -1.297 6.168 5.151 1.00 11.72 C ATOM 1094 CE2 TYR B 202 0.887 5.706 4.181 1.00 11.32 C ATOM 1095 CZ TYR B 202 0.016 6.576 4.858 1.00 12.88 C ATOM 1096 OH TYR B 202 0.449 7.831 5.236 1.00 13.22 O ATOM 0 H TYR B 202 0.531 0.710 3.872 1.00 10.61 H new ATOM 0 HA TYR B 202 -1.263 2.185 5.779 1.00 10.61 H new ATOM 0 HB2 TYR B 202 -0.801 2.315 2.793 1.00 10.02 H new ATOM 0 HB3 TYR B 202 -2.398 2.680 3.415 1.00 10.02 H new ATOM 0 HD1 TYR B 202 -2.747 4.578 4.991 1.00 10.92 H new ATOM 0 HD2 TYR B 202 1.115 3.760 3.275 1.00 9.08 H new ATOM 0 HE1 TYR B 202 -1.967 6.836 5.672 1.00 11.72 H new ATOM 0 HE2 TYR B 202 1.896 6.019 3.956 1.00 11.32 H new ATOM 0 HH TYR B 202 1.158 7.744 5.907 1.00 13.22 H new ATOM 1106 N LYS B 203 -2.496 -0.061 5.825 1.00 11.16 N ATOM 1107 CA LYS B 203 -3.458 -1.195 5.780 1.00 13.85 C ATOM 1108 C LYS B 203 -4.767 -0.737 5.134 1.00 13.44 C ATOM 1109 O LYS B 203 -5.316 0.291 5.480 1.00 12.80 O ATOM 1110 CB LYS B 203 -3.735 -1.691 7.203 1.00 19.04 C ATOM 1111 CG LYS B 203 -4.246 -0.533 8.062 1.00 23.92 C ATOM 1112 CD LYS B 203 -5.519 -0.964 8.793 1.00 29.39 C ATOM 1113 CE LYS B 203 -5.419 -0.569 10.268 1.00 31.37 C ATOM 1114 NZ LYS B 203 -6.525 -1.214 11.031 1.00 36.57 N ATOM 0 H LYS B 203 -2.185 0.208 6.758 1.00 11.16 H new ATOM 0 HA LYS B 203 -3.030 -2.006 5.190 1.00 13.85 H new ATOM 0 HB2 LYS B 203 -4.472 -2.494 7.182 1.00 19.04 H new ATOM 0 HB3 LYS B 203 -2.825 -2.105 7.638 1.00 19.04 H new ATOM 0 HG2 LYS B 203 -3.483 -0.236 8.782 1.00 23.92 H new ATOM 0 HG3 LYS B 203 -4.450 0.336 7.436 1.00 23.92 H new ATOM 0 HD2 LYS B 203 -6.390 -0.493 8.338 1.00 29.39 H new ATOM 0 HD3 LYS B 203 -5.656 -2.042 8.703 1.00 29.39 H new ATOM 0 HE2 LYS B 203 -4.455 -0.877 10.673 1.00 31.37 H new ATOM 0 HE3 LYS B 203 -5.476 0.515 10.370 1.00 31.37 H new ATOM 0 HZ1 LYS B 203 -6.458 -0.946 12.034 1.00 36.57 H new ATOM 0 HZ2 LYS B 203 -7.440 -0.899 10.649 1.00 36.57 H new ATOM 0 HZ3 LYS B 203 -6.451 -2.248 10.943 1.00 36.57 H new ATOM 1128 N ILE B 204 -5.272 -1.495 4.201 1.00 14.05 N ATOM 1129 CA ILE B 204 -6.547 -1.111 3.534 1.00 13.51 C ATOM 1130 C ILE B 204 -7.714 -1.717 4.317 1.00 14.04 C ATOM 1131 O ILE B 204 -7.845 -2.919 4.426 1.00 15.82 O ATOM 1132 CB ILE B 204 -6.544 -1.640 2.096 1.00 12.30 C ATOM 1133 CG1 ILE B 204 -5.598 -0.788 1.247 1.00 11.29 C ATOM 1134 CG2 ILE B 204 -7.956 -1.568 1.508 1.00 14.21 C ATOM 1135 CD1 ILE B 204 -5.097 -1.609 0.057 1.00 13.89 C ATOM 0 H ILE B 204 -4.856 -2.366 3.871 1.00 14.05 H new ATOM 0 HA ILE B 204 -6.651 -0.026 3.511 1.00 13.51 H new ATOM 0 HB ILE B 204 -6.210 -2.677 2.096 1.00 12.30 H new ATOM 0 HG12 ILE B 204 -6.114 0.105 0.894 1.00 11.29 H new ATOM 0 HG13 ILE B 204 -4.755 -0.451 1.850 1.00 11.29 H new ATOM 0 HG21 ILE B 204 -7.944 -1.946 0.486 1.00 14.21 H new ATOM 0 HG22 ILE B 204 -8.633 -2.174 2.111 1.00 14.21 H new ATOM 0 HG23 ILE B 204 -8.298 -0.533 1.508 1.00 14.21 H new ATOM 0 HD11 ILE B 204 -4.423 -1.001 -0.547 1.00 13.89 H new ATOM 0 HD12 ILE B 204 -4.565 -2.488 0.420 1.00 13.89 H new ATOM 0 HD13 ILE B 204 -5.945 -1.923 -0.551 1.00 13.89 H new ATOM 1147 N ARG B 205 -8.551 -0.887 4.873 1.00 15.56 N ATOM 1148 CA ARG B 205 -9.701 -1.405 5.664 1.00 13.76 C ATOM 1149 C ARG B 205 -10.791 -1.923 4.726 1.00 13.72 C ATOM 1150 O ARG B 205 -10.720 -1.768 3.522 1.00 13.25 O ATOM 1151 CB ARG B 205 -10.268 -0.281 6.528 1.00 15.23 C ATOM 1152 CG ARG B 205 -9.125 0.412 7.267 1.00 20.69 C ATOM 1153 CD ARG B 205 -9.692 1.264 8.404 1.00 28.70 C ATOM 1154 NE ARG B 205 -8.770 2.401 8.681 1.00 38.45 N ATOM 1155 CZ ARG B 205 -8.843 3.038 9.818 1.00 41.91 C ATOM 1156 NH1 ARG B 205 -9.785 3.920 10.013 1.00 41.78 N ATOM 1157 NH2 ARG B 205 -7.974 2.793 10.760 1.00 44.96 N ATOM 0 H ARG B 205 -8.488 0.129 4.814 1.00 15.56 H new ATOM 0 HA ARG B 205 -9.359 -2.222 6.299 1.00 13.76 H new ATOM 0 HB2 ARG B 205 -10.803 0.437 5.906 1.00 15.23 H new ATOM 0 HB3 ARG B 205 -10.987 -0.683 7.242 1.00 15.23 H new ATOM 0 HG2 ARG B 205 -8.433 -0.330 7.665 1.00 20.69 H new ATOM 0 HG3 ARG B 205 -8.559 1.038 6.577 1.00 20.69 H new ATOM 0 HD2 ARG B 205 -10.679 1.640 8.134 1.00 28.70 H new ATOM 0 HD3 ARG B 205 -9.817 0.657 9.300 1.00 28.70 H new ATOM 0 HE ARG B 205 -8.082 2.682 7.982 1.00 38.45 H new ATOM 0 HH11 ARG B 205 -10.464 4.112 9.277 1.00 41.78 H new ATOM 0 HH12 ARG B 205 -9.842 4.418 10.902 1.00 41.78 H new ATOM 0 HH21 ARG B 205 -7.238 2.104 10.608 1.00 44.96 H new ATOM 0 HH22 ARG B 205 -8.031 3.291 11.648 1.00 44.96 H new ATOM 1171 N LYS B 206 -11.801 -2.536 5.276 1.00 14.89 N ATOM 1172 CA LYS B 206 -12.906 -3.072 4.431 1.00 18.13 C ATOM 1173 C LYS B 206 -14.252 -2.757 5.089 1.00 17.74 C ATOM 1174 O LYS B 206 -14.520 -3.166 6.202 1.00 18.39 O ATOM 1175 CB LYS B 206 -12.744 -4.591 4.289 1.00 21.97 C ATOM 1176 CG LYS B 206 -14.030 -5.203 3.721 1.00 27.97 C ATOM 1177 CD LYS B 206 -13.785 -6.670 3.364 1.00 32.27 C ATOM 1178 CE LYS B 206 -12.999 -6.754 2.054 1.00 33.99 C ATOM 1179 NZ LYS B 206 -11.889 -7.737 2.203 1.00 35.74 N ATOM 0 H LYS B 206 -11.910 -2.690 6.278 1.00 14.89 H new ATOM 0 HA LYS B 206 -12.871 -2.609 3.445 1.00 18.13 H new ATOM 0 HB2 LYS B 206 -11.903 -4.816 3.633 1.00 21.97 H new ATOM 0 HB3 LYS B 206 -12.518 -5.034 5.259 1.00 21.97 H new ATOM 0 HG2 LYS B 206 -14.835 -5.125 4.451 1.00 27.97 H new ATOM 0 HG3 LYS B 206 -14.348 -4.651 2.836 1.00 27.97 H new ATOM 0 HD2 LYS B 206 -13.232 -7.162 4.164 1.00 32.27 H new ATOM 0 HD3 LYS B 206 -14.735 -7.194 3.264 1.00 32.27 H new ATOM 0 HE2 LYS B 206 -13.659 -7.055 1.240 1.00 33.99 H new ATOM 0 HE3 LYS B 206 -12.599 -5.774 1.794 1.00 33.99 H new ATOM 0 HZ1 LYS B 206 -11.219 -7.626 1.415 1.00 35.74 H new ATOM 0 HZ2 LYS B 206 -11.396 -7.570 3.103 1.00 35.74 H new ATOM 0 HZ3 LYS B 206 -12.276 -8.702 2.195 1.00 35.74 H new ATOM 1193 N LEU B 207 -15.103 -2.041 4.409 1.00 17.31 N ATOM 1194 CA LEU B 207 -16.433 -1.714 4.993 1.00 19.33 C ATOM 1195 C LEU B 207 -17.282 -2.985 5.042 1.00 21.64 C ATOM 1196 O LEU B 207 -17.395 -3.703 4.068 1.00 21.80 O ATOM 1197 CB LEU B 207 -17.132 -0.667 4.123 1.00 19.68 C ATOM 1198 CG LEU B 207 -16.421 0.678 4.270 1.00 19.58 C ATOM 1199 CD1 LEU B 207 -17.201 1.753 3.511 1.00 16.81 C ATOM 1200 CD2 LEU B 207 -16.346 1.055 5.752 1.00 16.39 C ATOM 0 H LEU B 207 -14.935 -1.668 3.474 1.00 17.31 H new ATOM 0 HA LEU B 207 -16.304 -1.317 6.000 1.00 19.33 H new ATOM 0 HB2 LEU B 207 -17.124 -0.982 3.080 1.00 19.68 H new ATOM 0 HB3 LEU B 207 -18.177 -0.572 4.419 1.00 19.68 H new ATOM 0 HG LEU B 207 -15.413 0.603 3.861 1.00 19.58 H new ATOM 0 HD11 LEU B 207 -16.694 2.712 3.616 1.00 16.81 H new ATOM 0 HD12 LEU B 207 -17.257 1.485 2.456 1.00 16.81 H new ATOM 0 HD13 LEU B 207 -18.209 1.828 3.920 1.00 16.81 H new ATOM 0 HD21 LEU B 207 -15.839 2.014 5.858 1.00 16.39 H new ATOM 0 HD22 LEU B 207 -17.354 1.130 6.160 1.00 16.39 H new ATOM 0 HD23 LEU B 207 -15.791 0.289 6.295 1.00 16.39 H new ATOM 1212 N ASP B 208 -17.877 -3.272 6.165 1.00 24.31 N ATOM 1213 CA ASP B 208 -18.712 -4.501 6.268 1.00 27.33 C ATOM 1214 C ASP B 208 -19.805 -4.469 5.197 1.00 28.23 C ATOM 1215 O ASP B 208 -20.395 -5.479 4.869 1.00 28.17 O ATOM 1216 CB ASP B 208 -19.359 -4.567 7.653 1.00 32.44 C ATOM 1217 CG ASP B 208 -18.302 -4.948 8.692 1.00 36.84 C ATOM 1218 OD1 ASP B 208 -17.130 -4.759 8.413 1.00 41.58 O ATOM 1219 OD2 ASP B 208 -18.684 -5.422 9.750 1.00 40.11 O ATOM 0 H ASP B 208 -17.822 -2.710 7.015 1.00 24.31 H new ATOM 0 HA ASP B 208 -18.082 -5.378 6.119 1.00 27.33 H new ATOM 0 HB2 ASP B 208 -19.802 -3.604 7.906 1.00 32.44 H new ATOM 0 HB3 ASP B 208 -20.166 -5.299 7.654 1.00 32.44 H new ATOM 1224 N SER B 209 -20.079 -3.317 4.647 1.00 30.57 N ATOM 1225 CA SER B 209 -21.126 -3.220 3.602 1.00 30.81 C ATOM 1226 C SER B 209 -20.646 -3.919 2.328 1.00 31.86 C ATOM 1227 O SER B 209 -21.400 -4.596 1.658 1.00 34.96 O ATOM 1228 CB SER B 209 -21.390 -1.749 3.312 1.00 29.35 C ATOM 1229 OG SER B 209 -20.203 -1.002 3.545 1.00 27.77 O ATOM 0 H SER B 209 -19.618 -2.438 4.881 1.00 30.57 H new ATOM 0 HA SER B 209 -22.042 -3.700 3.946 1.00 30.81 H new ATOM 0 HB2 SER B 209 -21.715 -1.623 2.279 1.00 29.35 H new ATOM 0 HB3 SER B 209 -22.196 -1.380 3.947 1.00 29.35 H new ATOM 0 HG SER B 209 -20.370 -0.055 3.357 1.00 27.77 H new ATOM 1235 N GLY B 210 -19.395 -3.762 1.990 1.00 31.91 N ATOM 1236 CA GLY B 210 -18.868 -4.418 0.760 1.00 30.37 C ATOM 1237 C GLY B 210 -17.943 -3.451 0.021 1.00 29.39 C ATOM 1238 O GLY B 210 -17.995 -3.328 -1.187 1.00 32.51 O ATOM 0 H GLY B 210 -18.716 -3.208 2.512 1.00 31.91 H new ATOM 0 HA2 GLY B 210 -18.326 -5.326 1.024 1.00 30.37 H new ATOM 0 HA3 GLY B 210 -19.693 -4.715 0.112 1.00 30.37 H new ATOM 1242 N GLY B 211 -17.093 -2.763 0.735 1.00 27.09 N ATOM 1243 CA GLY B 211 -16.165 -1.805 0.070 1.00 22.75 C ATOM 1244 C GLY B 211 -14.843 -1.757 0.839 1.00 20.54 C ATOM 1245 O GLY B 211 -14.534 -2.638 1.616 1.00 21.66 O ATOM 0 H GLY B 211 -17.002 -2.823 1.749 1.00 27.09 H new ATOM 0 HA2 GLY B 211 -15.987 -2.111 -0.961 1.00 22.75 H new ATOM 0 HA3 GLY B 211 -16.614 -0.812 0.035 1.00 22.75 H new ATOM 1249 N PHE B 212 -14.063 -0.733 0.631 1.00 18.17 N ATOM 1250 CA PHE B 212 -12.762 -0.625 1.352 1.00 17.54 C ATOM 1251 C PHE B 212 -12.417 0.852 1.541 1.00 15.84 C ATOM 1252 O PHE B 212 -12.997 1.715 0.914 1.00 18.26 O ATOM 1253 CB PHE B 212 -11.658 -1.303 0.535 1.00 16.88 C ATOM 1254 CG PHE B 212 -12.215 -2.514 -0.178 1.00 18.16 C ATOM 1255 CD1 PHE B 212 -13.052 -2.346 -1.295 1.00 18.64 C ATOM 1256 CD2 PHE B 212 -11.896 -3.804 0.272 1.00 18.25 C ATOM 1257 CE1 PHE B 212 -13.570 -3.471 -1.959 1.00 19.59 C ATOM 1258 CE2 PHE B 212 -12.413 -4.930 -0.392 1.00 18.17 C ATOM 1259 CZ PHE B 212 -13.250 -4.762 -1.508 1.00 18.19 C ATOM 0 H PHE B 212 -14.270 0.035 -0.008 1.00 18.17 H new ATOM 0 HA PHE B 212 -12.843 -1.115 2.322 1.00 17.54 H new ATOM 0 HB2 PHE B 212 -11.247 -0.601 -0.190 1.00 16.88 H new ATOM 0 HB3 PHE B 212 -10.839 -1.601 1.190 1.00 16.88 H new ATOM 0 HD1 PHE B 212 -13.297 -1.353 -1.643 1.00 18.64 H new ATOM 0 HD2 PHE B 212 -11.252 -3.932 1.130 1.00 18.25 H new ATOM 0 HE1 PHE B 212 -14.214 -3.343 -2.816 1.00 19.59 H new ATOM 0 HE2 PHE B 212 -12.167 -5.923 -0.045 1.00 18.17 H new ATOM 0 HZ PHE B 212 -13.648 -5.626 -2.019 1.00 18.19 H new ATOM 1269 N TYR B 213 -11.476 1.154 2.392 1.00 14.56 N ATOM 1270 CA TYR B 213 -11.102 2.581 2.604 1.00 12.35 C ATOM 1271 C TYR B 213 -9.965 2.672 3.623 1.00 12.92 C ATOM 1272 O TYR B 213 -9.962 1.999 4.634 1.00 12.14 O ATOM 1273 CB TYR B 213 -12.327 3.375 3.090 1.00 12.55 C ATOM 1274 CG TYR B 213 -12.576 3.135 4.564 1.00 14.01 C ATOM 1275 CD1 TYR B 213 -12.504 1.837 5.096 1.00 13.18 C ATOM 1276 CD2 TYR B 213 -12.889 4.219 5.401 1.00 13.49 C ATOM 1277 CE1 TYR B 213 -12.742 1.624 6.465 1.00 14.46 C ATOM 1278 CE2 TYR B 213 -13.125 4.007 6.770 1.00 13.06 C ATOM 1279 CZ TYR B 213 -13.052 2.709 7.301 1.00 15.80 C ATOM 1280 OH TYR B 213 -13.287 2.498 8.645 1.00 18.90 O ATOM 0 H TYR B 213 -10.952 0.478 2.948 1.00 14.56 H new ATOM 0 HA TYR B 213 -10.761 3.010 1.662 1.00 12.35 H new ATOM 0 HB2 TYR B 213 -12.170 4.439 2.912 1.00 12.55 H new ATOM 0 HB3 TYR B 213 -13.206 3.082 2.516 1.00 12.55 H new ATOM 0 HD1 TYR B 213 -12.266 1.002 4.453 1.00 13.18 H new ATOM 0 HD2 TYR B 213 -12.948 5.217 4.992 1.00 13.49 H new ATOM 0 HE1 TYR B 213 -12.686 0.626 6.874 1.00 14.46 H new ATOM 0 HE2 TYR B 213 -13.362 4.842 7.413 1.00 13.06 H new ATOM 0 HH TYR B 213 -13.486 3.353 9.080 1.00 18.90 H new ATOM 1290 N ILE B 214 -8.997 3.501 3.359 1.00 13.74 N ATOM 1291 CA ILE B 214 -7.857 3.644 4.303 1.00 13.80 C ATOM 1292 C ILE B 214 -8.022 4.938 5.106 1.00 14.16 C ATOM 1293 O ILE B 214 -7.221 5.251 5.965 1.00 12.50 O ATOM 1294 CB ILE B 214 -6.551 3.686 3.503 1.00 10.15 C ATOM 1295 CG1 ILE B 214 -6.224 2.279 2.999 1.00 9.57 C ATOM 1296 CG2 ILE B 214 -5.405 4.182 4.391 1.00 8.37 C ATOM 1297 CD1 ILE B 214 -5.221 2.371 1.847 1.00 7.18 C ATOM 0 H ILE B 214 -8.946 4.088 2.527 1.00 13.74 H new ATOM 0 HA ILE B 214 -7.833 2.799 4.992 1.00 13.80 H new ATOM 0 HB ILE B 214 -6.670 4.367 2.660 1.00 10.15 H new ATOM 0 HG12 ILE B 214 -5.810 1.678 3.809 1.00 9.57 H new ATOM 0 HG13 ILE B 214 -7.134 1.780 2.665 1.00 9.57 H new ATOM 0 HG21 ILE B 214 -4.482 4.208 3.813 1.00 8.37 H new ATOM 0 HG22 ILE B 214 -5.634 5.184 4.755 1.00 8.37 H new ATOM 0 HG23 ILE B 214 -5.283 3.508 5.239 1.00 8.37 H new ATOM 0 HD11 ILE B 214 -4.987 1.369 1.487 1.00 7.18 H new ATOM 0 HD12 ILE B 214 -5.652 2.957 1.035 1.00 7.18 H new ATOM 0 HD13 ILE B 214 -4.308 2.853 2.197 1.00 7.18 H new ATOM 1309 N THR B 215 -9.053 5.695 4.836 1.00 15.77 N ATOM 1310 CA THR B 215 -9.255 6.964 5.589 1.00 18.20 C ATOM 1311 C THR B 215 -10.719 7.085 6.018 1.00 17.81 C ATOM 1312 O THR B 215 -11.380 6.102 6.268 1.00 15.56 O ATOM 1313 CB THR B 215 -8.852 8.149 4.696 1.00 20.21 C ATOM 1314 OG1 THR B 215 -8.644 9.301 5.501 1.00 26.81 O ATOM 1315 CG2 THR B 215 -9.950 8.429 3.666 1.00 22.31 C ATOM 0 H THR B 215 -9.760 5.489 4.130 1.00 15.77 H new ATOM 0 HA THR B 215 -8.634 6.967 6.485 1.00 18.20 H new ATOM 0 HB THR B 215 -7.930 7.902 4.170 1.00 20.21 H new ATOM 0 HG1 THR B 215 -8.919 10.100 5.005 1.00 26.81 H new ATOM 0 HG21 THR B 215 -9.655 9.270 3.039 1.00 22.31 H new ATOM 0 HG22 THR B 215 -10.099 7.547 3.044 1.00 22.31 H new ATOM 0 HG23 THR B 215 -10.880 8.670 4.182 1.00 22.31 H new ATOM 1323 N SER B 216 -11.226 8.281 6.121 1.00 18.97 N ATOM 1324 CA SER B 216 -12.644 8.453 6.545 1.00 18.71 C ATOM 1325 C SER B 216 -13.308 9.535 5.692 1.00 18.69 C ATOM 1326 O SER B 216 -13.433 10.672 6.101 1.00 20.53 O ATOM 1327 CB SER B 216 -12.691 8.865 8.017 1.00 20.19 C ATOM 1328 OG SER B 216 -14.025 8.748 8.495 1.00 22.41 O ATOM 0 H SER B 216 -10.721 9.146 5.930 1.00 18.97 H new ATOM 0 HA SER B 216 -13.176 7.511 6.413 1.00 18.71 H new ATOM 0 HB2 SER B 216 -12.025 8.233 8.605 1.00 20.19 H new ATOM 0 HB3 SER B 216 -12.340 9.891 8.131 1.00 20.19 H new ATOM 0 HG SER B 216 -14.058 9.010 9.439 1.00 22.41 H new ATOM 1334 N ARG B 217 -13.738 9.190 4.508 1.00 0.00 N ATOM 1335 CA ARG B 217 -14.397 10.198 3.629 1.00 0.00 C ATOM 1336 C ARG B 217 -14.536 9.633 2.214 1.00 0.00 C ATOM 1337 O ARG B 217 -15.423 10.004 1.471 1.00 0.00 O ATOM 1338 CB ARG B 217 -13.552 11.473 3.584 1.00 0.00 C ATOM 1339 CG ARG B 217 -12.073 11.103 3.444 1.00 0.00 C ATOM 1340 CD ARG B 217 -11.266 12.351 3.082 1.00 0.00 C ATOM 1341 NE ARG B 217 -12.024 13.164 2.089 1.00 0.00 N ATOM 1342 CZ ARG B 217 -12.198 14.442 2.287 1.00 0.00 C ATOM 1343 NH1 ARG B 217 -13.236 14.862 2.957 1.00 0.00 N ATOM 1344 NH2 ARG B 217 -11.334 15.299 1.816 1.00 0.00 N ATOM 0 H ARG B 217 -13.661 8.253 4.112 1.00 0.00 H new ATOM 0 HA ARG B 217 -15.385 10.430 4.028 1.00 0.00 H new ATOM 0 HB2 ARG B 217 -13.862 12.098 2.746 1.00 0.00 H new ATOM 0 HB3 ARG B 217 -13.707 12.057 4.491 1.00 0.00 H new ATOM 0 HG2 ARG B 217 -11.704 10.677 4.377 1.00 0.00 H new ATOM 0 HG3 ARG B 217 -11.949 10.341 2.674 1.00 0.00 H new ATOM 0 HD2 ARG B 217 -11.069 12.942 3.977 1.00 0.00 H new ATOM 0 HD3 ARG B 217 -10.298 12.064 2.670 1.00 0.00 H new ATOM 0 HE ARG B 217 -12.407 12.721 1.254 1.00 0.00 H new ATOM 0 HH11 ARG B 217 -13.911 14.192 3.325 1.00 0.00 H new ATOM 0 HH12 ARG B 217 -13.373 15.861 3.112 1.00 0.00 H new ATOM 0 HH21 ARG B 217 -10.522 14.970 1.293 1.00 0.00 H new ATOM 0 HH22 ARG B 217 -11.470 16.298 1.971 1.00 0.00 H new ATOM 1358 N THR B 218 -13.664 8.739 1.831 1.00 23.45 N ATOM 1359 CA THR B 218 -13.749 8.157 0.462 1.00 23.59 C ATOM 1360 C THR B 218 -13.789 6.631 0.552 1.00 19.84 C ATOM 1361 O THR B 218 -12.898 6.006 1.094 1.00 20.24 O ATOM 1362 CB THR B 218 -12.524 8.587 -0.349 1.00 26.45 C ATOM 1363 OG1 THR B 218 -12.150 9.906 0.024 1.00 30.31 O ATOM 1364 CG2 THR B 218 -12.860 8.552 -1.841 1.00 27.38 C ATOM 0 H THR B 218 -12.898 8.388 2.406 1.00 23.45 H new ATOM 0 HA THR B 218 -14.656 8.513 -0.027 1.00 23.59 H new ATOM 0 HB THR B 218 -11.698 7.905 -0.149 1.00 26.45 H new ATOM 0 HG1 THR B 218 -11.365 10.182 -0.493 1.00 30.31 H new ATOM 0 HG21 THR B 218 -11.987 8.858 -2.418 1.00 27.38 H new ATOM 0 HG22 THR B 218 -13.146 7.540 -2.126 1.00 27.38 H new ATOM 0 HG23 THR B 218 -13.686 9.233 -2.044 1.00 27.38 H new ATOM 1372 N GLN B 219 -14.815 6.023 0.021 1.00 18.30 N ATOM 1373 CA GLN B 219 -14.913 4.537 0.070 1.00 20.11 C ATOM 1374 C GLN B 219 -14.842 3.980 -1.351 1.00 19.45 C ATOM 1375 O GLN B 219 -15.602 4.361 -2.218 1.00 20.30 O ATOM 1376 CB GLN B 219 -16.241 4.129 0.711 1.00 20.56 C ATOM 1377 CG GLN B 219 -16.583 5.100 1.843 1.00 23.60 C ATOM 1378 CD GLN B 219 -15.556 4.954 2.969 1.00 19.08 C ATOM 1379 OE1 GLN B 219 -14.378 5.164 2.762 1.00 17.99 O ATOM 1380 NE2 GLN B 219 -15.958 4.598 4.159 1.00 17.08 N ATOM 0 H GLN B 219 -15.591 6.493 -0.445 1.00 18.30 H new ATOM 0 HA GLN B 219 -14.090 4.138 0.663 1.00 20.11 H new ATOM 0 HB2 GLN B 219 -17.034 4.133 -0.037 1.00 20.56 H new ATOM 0 HB3 GLN B 219 -16.173 3.112 1.098 1.00 20.56 H new ATOM 0 HG2 GLN B 219 -16.586 6.124 1.470 1.00 23.60 H new ATOM 0 HG3 GLN B 219 -17.585 4.896 2.221 1.00 23.60 H new ATOM 0 HE21 GLN B 219 -16.948 4.422 4.331 1.00 17.08 H new ATOM 0 HE22 GLN B 219 -15.282 4.496 4.916 1.00 17.08 H new ATOM 1389 N PHE B 220 -13.931 3.081 -1.597 1.00 18.96 N ATOM 1390 CA PHE B 220 -13.804 2.498 -2.960 1.00 17.73 C ATOM 1391 C PHE B 220 -14.560 1.170 -3.023 1.00 17.76 C ATOM 1392 O PHE B 220 -14.735 0.497 -2.026 1.00 19.11 O ATOM 1393 CB PHE B 220 -12.326 2.259 -3.275 1.00 14.17 C ATOM 1394 CG PHE B 220 -11.520 3.466 -2.858 1.00 14.07 C ATOM 1395 CD1 PHE B 220 -11.087 3.597 -1.528 1.00 12.87 C ATOM 1396 CD2 PHE B 220 -11.202 4.458 -3.801 1.00 14.01 C ATOM 1397 CE1 PHE B 220 -10.337 4.720 -1.141 1.00 13.31 C ATOM 1398 CE2 PHE B 220 -10.452 5.580 -3.415 1.00 11.11 C ATOM 1399 CZ PHE B 220 -10.019 5.712 -2.085 1.00 13.09 C ATOM 0 H PHE B 220 -13.267 2.724 -0.910 1.00 18.96 H new ATOM 0 HA PHE B 220 -14.226 3.189 -3.690 1.00 17.73 H new ATOM 0 HB2 PHE B 220 -11.970 1.372 -2.750 1.00 14.17 H new ATOM 0 HB3 PHE B 220 -12.196 2.072 -4.341 1.00 14.17 H new ATOM 0 HD1 PHE B 220 -11.331 2.834 -0.803 1.00 12.87 H new ATOM 0 HD2 PHE B 220 -11.535 4.357 -4.823 1.00 14.01 H new ATOM 0 HE1 PHE B 220 -10.005 4.821 -0.118 1.00 13.31 H new ATOM 0 HE2 PHE B 220 -10.208 6.342 -4.140 1.00 11.11 H new ATOM 0 HZ PHE B 220 -9.442 6.575 -1.788 1.00 13.09 H new ATOM 1409 N ASN B 221 -15.010 0.787 -4.186 1.00 20.00 N ATOM 1410 CA ASN B 221 -15.753 -0.497 -4.312 1.00 21.48 C ATOM 1411 C ASN B 221 -14.840 -1.557 -4.932 1.00 22.18 C ATOM 1412 O ASN B 221 -15.293 -2.583 -5.399 1.00 24.56 O ATOM 1413 CB ASN B 221 -16.978 -0.293 -5.206 1.00 26.12 C ATOM 1414 CG ASN B 221 -18.227 -0.806 -4.488 1.00 28.62 C ATOM 1415 OD1 ASN B 221 -18.622 -1.941 -4.667 1.00 32.09 O ATOM 1416 ND2 ASN B 221 -18.872 -0.012 -3.678 1.00 31.44 N ATOM 0 H ASN B 221 -14.895 1.309 -5.055 1.00 20.00 H new ATOM 0 HA ASN B 221 -16.075 -0.828 -3.325 1.00 21.48 H new ATOM 0 HB2 ASN B 221 -17.093 0.764 -5.447 1.00 26.12 H new ATOM 0 HB3 ASN B 221 -16.845 -0.823 -6.149 1.00 26.12 H new ATOM 0 HD21 ASN B 221 -19.707 -0.344 -3.196 1.00 31.44 H new ATOM 0 HD22 ASN B 221 -18.541 0.941 -3.527 1.00 31.44 H new ATOM 1423 N SER B 222 -13.557 -1.317 -4.940 1.00 20.04 N ATOM 1424 CA SER B 222 -12.618 -2.310 -5.530 1.00 17.84 C ATOM 1425 C SER B 222 -11.189 -1.986 -5.088 1.00 17.08 C ATOM 1426 O SER B 222 -10.714 -0.881 -5.251 1.00 17.94 O ATOM 1427 CB SER B 222 -12.704 -2.250 -7.056 1.00 15.42 C ATOM 1428 OG SER B 222 -13.046 -0.929 -7.454 1.00 19.15 O ATOM 0 H SER B 222 -13.120 -0.476 -4.563 1.00 20.04 H new ATOM 0 HA SER B 222 -12.887 -3.310 -5.190 1.00 17.84 H new ATOM 0 HB2 SER B 222 -11.751 -2.540 -7.497 1.00 15.42 H new ATOM 0 HB3 SER B 222 -13.451 -2.956 -7.418 1.00 15.42 H new ATOM 0 HG SER B 222 -13.100 -0.886 -8.432 1.00 19.15 H new ATOM 1434 N LEU B 223 -10.500 -2.943 -4.528 1.00 17.11 N ATOM 1435 CA LEU B 223 -9.104 -2.690 -4.077 1.00 16.96 C ATOM 1436 C LEU B 223 -8.335 -1.959 -5.180 1.00 17.05 C ATOM 1437 O LEU B 223 -7.484 -1.133 -4.914 1.00 18.74 O ATOM 1438 CB LEU B 223 -8.421 -4.024 -3.776 1.00 15.68 C ATOM 1439 CG LEU B 223 -9.072 -4.668 -2.552 1.00 18.50 C ATOM 1440 CD1 LEU B 223 -8.969 -6.190 -2.659 1.00 17.89 C ATOM 1441 CD2 LEU B 223 -8.354 -4.198 -1.285 1.00 17.50 C ATOM 0 H LEU B 223 -10.845 -3.889 -4.364 1.00 17.11 H new ATOM 0 HA LEU B 223 -9.117 -2.075 -3.177 1.00 16.96 H new ATOM 0 HB2 LEU B 223 -8.503 -4.688 -4.636 1.00 15.68 H new ATOM 0 HB3 LEU B 223 -7.358 -3.867 -3.595 1.00 15.68 H new ATOM 0 HG LEU B 223 -10.121 -4.377 -2.505 1.00 18.50 H new ATOM 0 HD11 LEU B 223 -9.433 -6.648 -1.786 1.00 17.89 H new ATOM 0 HD12 LEU B 223 -9.480 -6.527 -3.561 1.00 17.89 H new ATOM 0 HD13 LEU B 223 -7.920 -6.481 -2.707 1.00 17.89 H new ATOM 0 HD21 LEU B 223 -8.818 -4.657 -0.412 1.00 17.50 H new ATOM 0 HD22 LEU B 223 -7.304 -4.488 -1.333 1.00 17.50 H new ATOM 0 HD23 LEU B 223 -8.427 -3.113 -1.206 1.00 17.50 H new ATOM 1453 N GLN B 224 -8.628 -2.256 -6.417 1.00 17.04 N ATOM 1454 CA GLN B 224 -7.914 -1.579 -7.535 1.00 17.80 C ATOM 1455 C GLN B 224 -8.275 -0.093 -7.546 1.00 17.42 C ATOM 1456 O GLN B 224 -7.420 0.762 -7.660 1.00 17.16 O ATOM 1457 CB GLN B 224 -8.333 -2.213 -8.865 1.00 21.63 C ATOM 1458 CG GLN B 224 -7.127 -2.903 -9.504 1.00 27.99 C ATOM 1459 CD GLN B 224 -7.480 -3.330 -10.930 1.00 31.34 C ATOM 1460 OE1 GLN B 224 -8.273 -4.228 -11.129 1.00 31.30 O ATOM 1461 NE2 GLN B 224 -6.921 -2.717 -11.938 1.00 33.99 N ATOM 0 H GLN B 224 -9.331 -2.938 -6.701 1.00 17.04 H new ATOM 0 HA GLN B 224 -6.838 -1.691 -7.399 1.00 17.80 H new ATOM 0 HB2 GLN B 224 -9.133 -2.935 -8.700 1.00 21.63 H new ATOM 0 HB3 GLN B 224 -8.726 -1.449 -9.536 1.00 21.63 H new ATOM 0 HG2 GLN B 224 -6.272 -2.227 -9.517 1.00 27.99 H new ATOM 0 HG3 GLN B 224 -6.837 -3.772 -8.914 1.00 27.99 H new ATOM 0 HE21 GLN B 224 -6.255 -1.963 -11.771 1.00 33.99 H new ATOM 0 HE22 GLN B 224 -7.150 -2.992 -12.893 1.00 33.99 H new ATOM 1470 N GLN B 225 -9.536 0.221 -7.429 1.00 17.93 N ATOM 1471 CA GLN B 225 -9.949 1.653 -7.433 1.00 17.77 C ATOM 1472 C GLN B 225 -9.156 2.414 -6.368 1.00 14.93 C ATOM 1473 O GLN B 225 -8.618 3.473 -6.621 1.00 15.44 O ATOM 1474 CB GLN B 225 -11.444 1.749 -7.126 1.00 23.54 C ATOM 1475 CG GLN B 225 -11.980 3.095 -7.616 1.00 32.83 C ATOM 1476 CD GLN B 225 -13.491 3.156 -7.386 1.00 37.70 C ATOM 1477 OE1 GLN B 225 -13.963 2.893 -6.298 1.00 41.31 O ATOM 1478 NE2 GLN B 225 -14.275 3.497 -8.372 1.00 38.92 N ATOM 0 H GLN B 225 -10.297 -0.451 -7.331 1.00 17.93 H new ATOM 0 HA GLN B 225 -9.750 2.089 -8.412 1.00 17.77 H new ATOM 0 HB2 GLN B 225 -11.979 0.934 -7.613 1.00 23.54 H new ATOM 0 HB3 GLN B 225 -11.613 1.647 -6.054 1.00 23.54 H new ATOM 0 HG2 GLN B 225 -11.487 3.910 -7.085 1.00 32.83 H new ATOM 0 HG3 GLN B 225 -11.757 3.224 -8.675 1.00 32.83 H new ATOM 0 HE21 GLN B 225 -13.879 3.718 -9.286 1.00 38.92 H new ATOM 0 HE22 GLN B 225 -15.284 3.543 -8.229 1.00 38.92 H new ATOM 1487 N LEU B 226 -9.079 1.881 -5.179 1.00 13.83 N ATOM 1488 CA LEU B 226 -8.318 2.573 -4.100 1.00 13.09 C ATOM 1489 C LEU B 226 -6.858 2.732 -4.529 1.00 11.87 C ATOM 1490 O LEU B 226 -6.237 3.749 -4.289 1.00 12.13 O ATOM 1491 CB LEU B 226 -8.390 1.742 -2.816 1.00 12.56 C ATOM 1492 CG LEU B 226 -7.662 2.471 -1.683 1.00 13.63 C ATOM 1493 CD1 LEU B 226 -8.140 1.924 -0.336 1.00 13.34 C ATOM 1494 CD2 LEU B 226 -6.154 2.243 -1.816 1.00 14.36 C ATOM 0 H LEU B 226 -9.510 0.997 -4.908 1.00 13.83 H new ATOM 0 HA LEU B 226 -8.750 3.557 -3.920 1.00 13.09 H new ATOM 0 HB2 LEU B 226 -9.431 1.571 -2.541 1.00 12.56 H new ATOM 0 HB3 LEU B 226 -7.939 0.763 -2.980 1.00 12.56 H new ATOM 0 HG LEU B 226 -7.876 3.538 -1.741 1.00 13.63 H new ATOM 0 HD11 LEU B 226 -7.623 2.442 0.471 1.00 13.34 H new ATOM 0 HD12 LEU B 226 -9.214 2.083 -0.239 1.00 13.34 H new ATOM 0 HD13 LEU B 226 -7.924 0.857 -0.279 1.00 13.34 H new ATOM 0 HD21 LEU B 226 -5.635 2.762 -1.010 1.00 14.36 H new ATOM 0 HD22 LEU B 226 -5.941 1.176 -1.757 1.00 14.36 H new ATOM 0 HD23 LEU B 226 -5.811 2.629 -2.776 1.00 14.36 H new ATOM 1506 N VAL B 227 -6.303 1.734 -5.163 1.00 11.28 N ATOM 1507 CA VAL B 227 -4.884 1.831 -5.605 1.00 13.23 C ATOM 1508 C VAL B 227 -4.772 2.846 -6.745 1.00 13.64 C ATOM 1509 O VAL B 227 -3.711 3.366 -7.022 1.00 15.96 O ATOM 1510 CB VAL B 227 -4.405 0.463 -6.093 1.00 9.89 C ATOM 1511 CG1 VAL B 227 -2.897 0.509 -6.343 1.00 9.85 C ATOM 1512 CG2 VAL B 227 -4.713 -0.593 -5.029 1.00 9.58 C ATOM 0 H VAL B 227 -6.771 0.857 -5.393 1.00 11.28 H new ATOM 0 HA VAL B 227 -4.266 2.155 -4.768 1.00 13.23 H new ATOM 0 HB VAL B 227 -4.919 0.208 -7.020 1.00 9.89 H new ATOM 0 HG11 VAL B 227 -2.556 -0.466 -6.691 1.00 9.85 H new ATOM 0 HG12 VAL B 227 -2.676 1.262 -7.100 1.00 9.85 H new ATOM 0 HG13 VAL B 227 -2.382 0.764 -5.417 1.00 9.85 H new ATOM 0 HG21 VAL B 227 -4.372 -1.569 -5.375 1.00 9.58 H new ATOM 0 HG22 VAL B 227 -4.199 -0.337 -4.103 1.00 9.58 H new ATOM 0 HG23 VAL B 227 -5.788 -0.627 -4.850 1.00 9.58 H new ATOM 1522 N ALA B 228 -5.860 3.132 -7.406 1.00 16.21 N ATOM 1523 CA ALA B 228 -5.812 4.115 -8.525 1.00 16.05 C ATOM 1524 C ALA B 228 -6.044 5.523 -7.975 1.00 16.38 C ATOM 1525 O ALA B 228 -5.675 6.507 -8.583 1.00 17.42 O ATOM 1526 CB ALA B 228 -6.903 3.780 -9.545 1.00 17.50 C ATOM 0 H ALA B 228 -6.778 2.729 -7.220 1.00 16.21 H new ATOM 0 HA ALA B 228 -4.836 4.069 -9.008 1.00 16.05 H new ATOM 0 HB1 ALA B 228 -6.869 4.499 -10.364 1.00 17.50 H new ATOM 0 HB2 ALA B 228 -6.739 2.776 -9.936 1.00 17.50 H new ATOM 0 HB3 ALA B 228 -7.879 3.827 -9.062 1.00 17.50 H new ATOM 1532 N TYR B 229 -6.652 5.625 -6.824 1.00 17.24 N ATOM 1533 CA TYR B 229 -6.907 6.969 -6.234 1.00 15.90 C ATOM 1534 C TYR B 229 -5.613 7.504 -5.615 1.00 15.53 C ATOM 1535 O TYR B 229 -5.142 8.569 -5.963 1.00 15.40 O ATOM 1536 CB TYR B 229 -7.981 6.855 -5.151 1.00 17.41 C ATOM 1537 CG TYR B 229 -8.715 8.169 -5.029 1.00 19.62 C ATOM 1538 CD1 TYR B 229 -9.725 8.497 -5.949 1.00 19.06 C ATOM 1539 CD2 TYR B 229 -8.386 9.064 -3.997 1.00 20.00 C ATOM 1540 CE1 TYR B 229 -10.407 9.720 -5.836 1.00 20.67 C ATOM 1541 CE2 TYR B 229 -9.068 10.287 -3.885 1.00 22.03 C ATOM 1542 CZ TYR B 229 -10.078 10.616 -4.804 1.00 22.97 C ATOM 1543 OH TYR B 229 -10.749 11.817 -4.693 1.00 24.81 O ATOM 0 H TYR B 229 -6.983 4.836 -6.268 1.00 17.24 H new ATOM 0 HA TYR B 229 -7.249 7.651 -7.013 1.00 15.90 H new ATOM 0 HB2 TYR B 229 -8.681 6.057 -5.400 1.00 17.41 H new ATOM 0 HB3 TYR B 229 -7.524 6.592 -4.197 1.00 17.41 H new ATOM 0 HD1 TYR B 229 -9.977 7.809 -6.743 1.00 19.06 H new ATOM 0 HD2 TYR B 229 -7.609 8.812 -3.290 1.00 20.00 H new ATOM 0 HE1 TYR B 229 -11.184 9.972 -6.542 1.00 20.67 H new ATOM 0 HE2 TYR B 229 -8.816 10.975 -3.092 1.00 22.03 H new ATOM 0 HH TYR B 229 -10.400 12.317 -3.926 1.00 24.81 H new ATOM 1553 N TYR B 230 -5.033 6.771 -4.704 1.00 15.18 N ATOM 1554 CA TYR B 230 -3.767 7.240 -4.069 1.00 16.33 C ATOM 1555 C TYR B 230 -2.612 7.116 -5.068 1.00 16.83 C ATOM 1556 O TYR B 230 -1.492 7.498 -4.785 1.00 16.71 O ATOM 1557 CB TYR B 230 -3.472 6.387 -2.834 1.00 14.52 C ATOM 1558 CG TYR B 230 -4.653 6.440 -1.896 1.00 16.10 C ATOM 1559 CD1 TYR B 230 -5.364 7.640 -1.730 1.00 15.88 C ATOM 1560 CD2 TYR B 230 -5.042 5.290 -1.188 1.00 17.17 C ATOM 1561 CE1 TYR B 230 -6.464 7.691 -0.857 1.00 17.12 C ATOM 1562 CE2 TYR B 230 -6.142 5.340 -0.315 1.00 17.84 C ATOM 1563 CZ TYR B 230 -6.853 6.541 -0.150 1.00 17.32 C ATOM 1564 OH TYR B 230 -7.933 6.591 0.708 1.00 19.89 O ATOM 0 H TYR B 230 -5.379 5.871 -4.372 1.00 15.18 H new ATOM 0 HA TYR B 230 -3.874 8.284 -3.773 1.00 16.33 H new ATOM 0 HB2 TYR B 230 -3.273 5.357 -3.129 1.00 14.52 H new ATOM 0 HB3 TYR B 230 -2.577 6.753 -2.331 1.00 14.52 H new ATOM 0 HD1 TYR B 230 -5.065 8.524 -2.274 1.00 15.88 H new ATOM 0 HD2 TYR B 230 -4.495 4.367 -1.315 1.00 17.17 H new ATOM 0 HE1 TYR B 230 -7.010 8.614 -0.730 1.00 17.12 H new ATOM 0 HE2 TYR B 230 -6.441 4.456 0.229 1.00 17.84 H new ATOM 0 HH TYR B 230 -8.724 6.227 0.259 1.00 19.89 H new ATOM 1574 N SER B 231 -2.869 6.587 -6.235 1.00 17.92 N ATOM 1575 CA SER B 231 -1.783 6.445 -7.241 1.00 22.15 C ATOM 1576 C SER B 231 -1.652 7.742 -8.040 1.00 22.66 C ATOM 1577 O SER B 231 -0.631 8.009 -8.643 1.00 24.35 O ATOM 1578 CB SER B 231 -2.114 5.295 -8.193 1.00 21.66 C ATOM 1579 OG SER B 231 -1.566 4.088 -7.682 1.00 28.41 O ATOM 0 H SER B 231 -3.784 6.248 -6.532 1.00 17.92 H new ATOM 0 HA SER B 231 -0.843 6.236 -6.730 1.00 22.15 H new ATOM 0 HB2 SER B 231 -3.194 5.199 -8.304 1.00 21.66 H new ATOM 0 HB3 SER B 231 -1.709 5.500 -9.184 1.00 21.66 H new ATOM 0 HG SER B 231 -2.281 3.543 -7.293 1.00 28.41 H new ATOM 1585 N LYS B 232 -2.675 8.551 -8.055 1.00 24.70 N ATOM 1586 CA LYS B 232 -2.600 9.825 -8.821 1.00 27.78 C ATOM 1587 C LYS B 232 -2.859 11.010 -7.888 1.00 29.48 C ATOM 1588 O LYS B 232 -2.661 12.152 -8.253 1.00 31.78 O ATOM 1589 CB LYS B 232 -3.649 9.814 -9.930 1.00 28.95 C ATOM 1590 CG LYS B 232 -3.106 9.052 -11.140 1.00 35.04 C ATOM 1591 CD LYS B 232 -3.269 9.906 -12.400 1.00 42.20 C ATOM 1592 CE LYS B 232 -2.275 11.068 -12.362 1.00 46.43 C ATOM 1593 NZ LYS B 232 -3.011 12.356 -12.501 1.00 50.42 N ATOM 0 H LYS B 232 -3.557 8.385 -7.571 1.00 24.70 H new ATOM 0 HA LYS B 232 -1.606 9.922 -9.257 1.00 27.78 H new ATOM 0 HB2 LYS B 232 -4.566 9.345 -9.573 1.00 28.95 H new ATOM 0 HB3 LYS B 232 -3.903 10.835 -10.214 1.00 28.95 H new ATOM 0 HG2 LYS B 232 -2.055 8.808 -10.987 1.00 35.04 H new ATOM 0 HG3 LYS B 232 -3.638 8.108 -11.257 1.00 35.04 H new ATOM 0 HD2 LYS B 232 -3.100 9.298 -13.289 1.00 42.20 H new ATOM 0 HD3 LYS B 232 -4.288 10.287 -12.464 1.00 42.20 H new ATOM 0 HE2 LYS B 232 -1.719 11.054 -11.425 1.00 46.43 H new ATOM 0 HE3 LYS B 232 -1.547 10.964 -13.167 1.00 46.43 H new ATOM 0 HZ1 LYS B 232 -2.336 13.146 -12.475 1.00 50.42 H new ATOM 0 HZ2 LYS B 232 -3.523 12.367 -13.406 1.00 50.42 H new ATOM 0 HZ3 LYS B 232 -3.689 12.455 -11.719 1.00 50.42 H new ATOM 1607 N HIS B 233 -3.300 10.753 -6.687 1.00 31.24 N ATOM 1608 CA HIS B 233 -3.567 11.871 -5.739 1.00 31.51 C ATOM 1609 C HIS B 233 -3.170 11.449 -4.324 1.00 28.20 C ATOM 1610 O HIS B 233 -3.924 10.802 -3.624 1.00 29.72 O ATOM 1611 CB HIS B 233 -5.056 12.220 -5.768 1.00 33.74 C ATOM 1612 CG HIS B 233 -5.267 13.453 -6.603 1.00 39.30 C ATOM 1613 ND1 HIS B 233 -4.903 14.715 -6.163 1.00 40.06 N ATOM 1614 CD2 HIS B 233 -5.805 13.633 -7.854 1.00 39.81 C ATOM 1615 CE1 HIS B 233 -5.221 15.591 -7.134 1.00 41.81 C ATOM 1616 NE2 HIS B 233 -5.775 14.983 -8.187 1.00 42.50 N ATOM 0 H HIS B 233 -3.487 9.819 -6.322 1.00 31.24 H new ATOM 0 HA HIS B 233 -2.983 12.743 -6.034 1.00 31.51 H new ATOM 0 HB2 HIS B 233 -5.627 11.388 -6.179 1.00 33.74 H new ATOM 0 HB3 HIS B 233 -5.421 12.388 -4.755 1.00 33.74 H new ATOM 0 HD2 HIS B 233 -6.193 12.846 -8.484 1.00 39.81 H new ATOM 0 HE1 HIS B 233 -5.049 16.655 -7.070 1.00 41.81 H new ATOM 0 HE2 HIS B 233 -6.105 15.416 -9.050 1.00 42.50 H new ATOM 1624 N ALA B 234 -1.993 11.814 -3.898 1.00 24.22 N ATOM 1625 CA ALA B 234 -1.547 11.436 -2.527 1.00 22.83 C ATOM 1626 C ALA B 234 -2.627 11.826 -1.516 1.00 24.43 C ATOM 1627 O ALA B 234 -2.916 11.098 -0.589 1.00 23.70 O ATOM 1628 CB ALA B 234 -0.246 12.172 -2.194 1.00 19.43 C ATOM 0 H ALA B 234 -1.321 12.357 -4.439 1.00 24.22 H new ATOM 0 HA ALA B 234 -1.378 10.360 -2.482 1.00 22.83 H new ATOM 0 HB1 ALA B 234 0.081 11.897 -1.192 1.00 19.43 H new ATOM 0 HB2 ALA B 234 0.523 11.896 -2.916 1.00 19.43 H new ATOM 0 HB3 ALA B 234 -0.415 13.248 -2.238 1.00 19.43 H new ATOM 1634 N ASP B 235 -3.226 12.972 -1.689 1.00 27.21 N ATOM 1635 CA ASP B 235 -4.287 13.410 -0.740 1.00 29.29 C ATOM 1636 C ASP B 235 -3.725 13.426 0.683 1.00 28.86 C ATOM 1637 O ASP B 235 -4.368 12.996 1.620 1.00 29.80 O ATOM 1638 CB ASP B 235 -5.466 12.437 -0.811 1.00 35.17 C ATOM 1639 CG ASP B 235 -6.751 13.215 -1.102 1.00 40.61 C ATOM 1640 OD1 ASP B 235 -6.928 14.269 -0.514 1.00 46.14 O ATOM 1641 OD2 ASP B 235 -7.536 12.743 -1.908 1.00 45.11 O ATOM 0 H ASP B 235 -3.026 13.624 -2.447 1.00 27.21 H new ATOM 0 HA ASP B 235 -4.624 14.411 -1.008 1.00 29.29 H new ATOM 0 HB2 ASP B 235 -5.293 11.695 -1.590 1.00 35.17 H new ATOM 0 HB3 ASP B 235 -5.561 11.895 0.130 1.00 35.17 H new ATOM 1646 N GLY B 236 -2.530 13.922 0.854 1.00 27.14 N ATOM 1647 CA GLY B 236 -1.929 13.967 2.216 1.00 25.64 C ATOM 1648 C GLY B 236 -1.298 12.613 2.547 1.00 24.14 C ATOM 1649 O GLY B 236 -0.946 12.342 3.678 1.00 24.47 O ATOM 0 H GLY B 236 -1.944 14.298 0.109 1.00 27.14 H new ATOM 0 HA2 GLY B 236 -1.175 14.752 2.265 1.00 25.64 H new ATOM 0 HA3 GLY B 236 -2.693 14.213 2.953 1.00 25.64 H new ATOM 1653 N LEU B 237 -1.150 11.759 1.571 1.00 20.92 N ATOM 1654 CA LEU B 237 -0.540 10.426 1.836 1.00 19.13 C ATOM 1655 C LEU B 237 0.980 10.570 1.914 1.00 18.42 C ATOM 1656 O LEU B 237 1.519 11.649 1.774 1.00 19.85 O ATOM 1657 CB LEU B 237 -0.902 9.462 0.704 1.00 19.72 C ATOM 1658 CG LEU B 237 -2.133 8.646 1.103 1.00 21.67 C ATOM 1659 CD1 LEU B 237 -2.987 8.373 -0.135 1.00 17.09 C ATOM 1660 CD2 LEU B 237 -1.686 7.318 1.717 1.00 22.76 C ATOM 0 H LEU B 237 -1.425 11.927 0.603 1.00 20.92 H new ATOM 0 HA LEU B 237 -0.919 10.035 2.780 1.00 19.13 H new ATOM 0 HB2 LEU B 237 -1.102 10.018 -0.212 1.00 19.72 H new ATOM 0 HB3 LEU B 237 -0.064 8.797 0.496 1.00 19.72 H new ATOM 0 HG LEU B 237 -2.719 9.205 1.832 1.00 21.67 H new ATOM 0 HD11 LEU B 237 -3.864 7.792 0.149 1.00 17.09 H new ATOM 0 HD12 LEU B 237 -3.305 9.319 -0.573 1.00 17.09 H new ATOM 0 HD13 LEU B 237 -2.402 7.814 -0.865 1.00 17.09 H new ATOM 0 HD21 LEU B 237 -2.562 6.736 2.002 1.00 22.76 H new ATOM 0 HD22 LEU B 237 -1.100 6.759 0.988 1.00 22.76 H new ATOM 0 HD23 LEU B 237 -1.077 7.512 2.600 1.00 22.76 H new ATOM 1672 N CYS B 238 1.676 9.489 2.136 1.00 18.29 N ATOM 1673 CA CYS B 238 3.159 9.564 2.223 1.00 17.21 C ATOM 1674 C CYS B 238 3.720 10.091 0.901 1.00 18.80 C ATOM 1675 O CYS B 238 4.667 10.850 0.877 1.00 19.09 O ATOM 1676 CB CYS B 238 3.724 8.169 2.498 1.00 17.49 C ATOM 1677 SG CYS B 238 3.347 7.079 1.103 1.00 18.25 S ATOM 0 H CYS B 238 1.280 8.557 2.261 1.00 18.29 H new ATOM 0 HA CYS B 238 3.443 10.237 3.032 1.00 17.21 H new ATOM 0 HB2 CYS B 238 4.802 8.225 2.649 1.00 17.49 H new ATOM 0 HB3 CYS B 238 3.295 7.765 3.415 1.00 17.49 H new ATOM 0 HG CYS B 238 4.278 7.189 0.203 1.00 18.25 H new ATOM 1683 N HIS B 239 3.140 9.695 -0.201 1.00 17.96 N ATOM 1684 CA HIS B 239 3.641 10.176 -1.521 1.00 18.41 C ATOM 1685 C HIS B 239 2.837 9.521 -2.646 1.00 18.79 C ATOM 1686 O HIS B 239 2.524 8.348 -2.598 1.00 19.28 O ATOM 1687 CB HIS B 239 5.118 9.803 -1.672 1.00 18.77 C ATOM 1688 CG HIS B 239 5.808 10.826 -2.532 1.00 18.40 C ATOM 1689 ND1 HIS B 239 5.488 11.005 -3.869 1.00 18.53 N ATOM 1690 CD2 HIS B 239 6.801 11.732 -2.260 1.00 19.51 C ATOM 1691 CE1 HIS B 239 6.276 11.986 -4.347 1.00 19.04 C ATOM 1692 NE2 HIS B 239 7.095 12.464 -3.408 1.00 20.02 N ATOM 0 H HIS B 239 2.343 9.060 -0.244 1.00 17.96 H new ATOM 0 HA HIS B 239 3.528 11.259 -1.577 1.00 18.41 H new ATOM 0 HB2 HIS B 239 5.594 9.755 -0.693 1.00 18.77 H new ATOM 0 HB3 HIS B 239 5.210 8.814 -2.120 1.00 18.77 H new ATOM 0 HD2 HIS B 239 7.282 11.859 -1.301 1.00 19.51 H new ATOM 0 HE1 HIS B 239 6.249 12.343 -5.366 1.00 19.04 H new ATOM 0 HE2 HIS B 239 7.788 13.206 -3.509 1.00 20.02 H new ATOM 1700 N ARG B 240 2.505 10.268 -3.664 1.00 19.17 N ATOM 1701 CA ARG B 240 1.728 9.688 -4.795 1.00 20.76 C ATOM 1702 C ARG B 240 2.444 8.439 -5.310 1.00 18.50 C ATOM 1703 O ARG B 240 3.639 8.443 -5.523 1.00 17.06 O ATOM 1704 CB ARG B 240 1.630 10.716 -5.923 1.00 25.30 C ATOM 1705 CG ARG B 240 0.548 10.288 -6.916 1.00 30.23 C ATOM 1706 CD ARG B 240 -0.084 11.532 -7.539 1.00 37.22 C ATOM 1707 NE ARG B 240 0.973 12.549 -7.800 1.00 43.41 N ATOM 1708 CZ ARG B 240 1.663 12.507 -8.906 1.00 45.15 C ATOM 1709 NH1 ARG B 240 2.355 11.440 -9.203 1.00 46.15 N ATOM 1710 NH2 ARG B 240 1.663 13.530 -9.716 1.00 46.50 N ATOM 0 H ARG B 240 2.739 11.256 -3.761 1.00 19.17 H new ATOM 0 HA ARG B 240 0.727 9.423 -4.454 1.00 20.76 H new ATOM 0 HB2 ARG B 240 1.394 11.698 -5.514 1.00 25.30 H new ATOM 0 HB3 ARG B 240 2.590 10.805 -6.432 1.00 25.30 H new ATOM 0 HG2 ARG B 240 0.980 9.657 -7.693 1.00 30.23 H new ATOM 0 HG3 ARG B 240 -0.213 9.694 -6.409 1.00 30.23 H new ATOM 0 HD2 ARG B 240 -0.589 11.270 -8.469 1.00 37.22 H new ATOM 0 HD3 ARG B 240 -0.841 11.942 -6.870 1.00 37.22 H new ATOM 0 HE ARG B 240 1.157 13.280 -7.112 1.00 43.41 H new ATOM 0 HH11 ARG B 240 2.356 10.640 -8.570 1.00 46.15 H new ATOM 0 HH12 ARG B 240 2.895 11.407 -10.068 1.00 46.15 H new ATOM 0 HH21 ARG B 240 1.123 14.364 -9.485 1.00 46.50 H new ATOM 0 HH22 ARG B 240 2.203 13.496 -10.581 1.00 46.50 H new ATOM 1724 N LEU B 241 1.726 7.368 -5.513 1.00 16.42 N ATOM 1725 CA LEU B 241 2.379 6.127 -6.017 1.00 16.95 C ATOM 1726 C LEU B 241 3.157 6.448 -7.293 1.00 18.53 C ATOM 1727 O LEU B 241 2.798 7.333 -8.044 1.00 19.32 O ATOM 1728 CB LEU B 241 1.316 5.072 -6.323 1.00 12.02 C ATOM 1729 CG LEU B 241 0.388 4.908 -5.115 1.00 10.93 C ATOM 1730 CD1 LEU B 241 -0.526 3.701 -5.333 1.00 7.07 C ATOM 1731 CD2 LEU B 241 1.227 4.687 -3.853 1.00 9.30 C ATOM 0 H LEU B 241 0.721 7.299 -5.353 1.00 16.42 H new ATOM 0 HA LEU B 241 3.060 5.743 -5.258 1.00 16.95 H new ATOM 0 HB2 LEU B 241 0.739 5.367 -7.200 1.00 12.02 H new ATOM 0 HB3 LEU B 241 1.792 4.120 -6.560 1.00 12.02 H new ATOM 0 HG LEU B 241 -0.217 5.807 -4.999 1.00 10.93 H new ATOM 0 HD11 LEU B 241 -1.186 3.585 -4.473 1.00 7.07 H new ATOM 0 HD12 LEU B 241 -1.124 3.855 -6.231 1.00 7.07 H new ATOM 0 HD13 LEU B 241 0.080 2.802 -5.450 1.00 7.07 H new ATOM 0 HD21 LEU B 241 0.567 4.570 -2.993 1.00 9.30 H new ATOM 0 HD22 LEU B 241 1.832 3.788 -3.971 1.00 9.30 H new ATOM 0 HD23 LEU B 241 1.880 5.545 -3.695 1.00 9.30 H new ATOM 1743 N THR B 242 4.219 5.736 -7.548 1.00 20.81 N ATOM 1744 CA THR B 242 5.017 6.007 -8.777 1.00 20.89 C ATOM 1745 C THR B 242 5.385 4.683 -9.453 1.00 21.74 C ATOM 1746 O THR B 242 5.398 4.578 -10.663 1.00 24.76 O ATOM 1747 CB THR B 242 6.293 6.761 -8.398 1.00 20.18 C ATOM 1748 OG1 THR B 242 7.203 5.865 -7.774 1.00 22.88 O ATOM 1749 CG2 THR B 242 5.948 7.898 -7.435 1.00 19.22 C ATOM 0 H THR B 242 4.569 4.979 -6.960 1.00 20.81 H new ATOM 0 HA THR B 242 4.428 6.612 -9.467 1.00 20.89 H new ATOM 0 HB THR B 242 6.752 7.176 -9.295 1.00 20.18 H new ATOM 0 HG1 THR B 242 8.022 6.346 -7.532 1.00 22.88 H new ATOM 0 HG21 THR B 242 6.857 8.435 -7.165 1.00 19.22 H new ATOM 0 HG22 THR B 242 5.251 8.584 -7.917 1.00 19.22 H new ATOM 0 HG23 THR B 242 5.489 7.487 -6.536 1.00 19.22 H new ATOM 1757 N THR B 243 5.688 3.674 -8.684 1.00 20.71 N ATOM 1758 CA THR B 243 6.056 2.363 -9.290 1.00 18.86 C ATOM 1759 C THR B 243 5.642 1.229 -8.350 1.00 18.56 C ATOM 1760 O THR B 243 5.156 1.458 -7.259 1.00 18.28 O ATOM 1761 CB THR B 243 7.569 2.314 -9.512 1.00 20.42 C ATOM 1762 OG1 THR B 243 8.024 3.590 -9.941 1.00 20.70 O ATOM 1763 CG2 THR B 243 7.898 1.267 -10.577 1.00 16.38 C ATOM 0 H THR B 243 5.697 3.700 -7.664 1.00 20.71 H new ATOM 0 HA THR B 243 5.542 2.247 -10.244 1.00 18.86 H new ATOM 0 HB THR B 243 8.065 2.046 -8.579 1.00 20.42 H new ATOM 0 HG1 THR B 243 8.993 3.561 -10.082 1.00 20.70 H new ATOM 0 HG21 THR B 243 8.976 1.234 -10.734 1.00 16.38 H new ATOM 0 HG22 THR B 243 7.549 0.289 -10.246 1.00 16.38 H new ATOM 0 HG23 THR B 243 7.404 1.531 -11.512 1.00 16.38 H new ATOM 1771 N VAL B 244 5.830 0.006 -8.764 1.00 16.29 N ATOM 1772 CA VAL B 244 5.449 -1.144 -7.897 1.00 16.81 C ATOM 1773 C VAL B 244 6.688 -1.989 -7.601 1.00 16.74 C ATOM 1774 O VAL B 244 7.720 -1.838 -8.226 1.00 17.40 O ATOM 1775 CB VAL B 244 4.411 -2.003 -8.619 1.00 17.29 C ATOM 1776 CG1 VAL B 244 3.687 -2.893 -7.608 1.00 17.99 C ATOM 1777 CG2 VAL B 244 3.395 -1.096 -9.317 1.00 17.19 C ATOM 0 H VAL B 244 6.232 -0.247 -9.667 1.00 16.29 H new ATOM 0 HA VAL B 244 5.029 -0.772 -6.963 1.00 16.81 H new ATOM 0 HB VAL B 244 4.911 -2.628 -9.359 1.00 17.29 H new ATOM 0 HG11 VAL B 244 2.948 -3.504 -8.125 1.00 17.99 H new ATOM 0 HG12 VAL B 244 4.409 -3.540 -7.111 1.00 17.99 H new ATOM 0 HG13 VAL B 244 3.188 -2.269 -6.866 1.00 17.99 H new ATOM 0 HG21 VAL B 244 2.655 -1.708 -9.832 1.00 17.19 H new ATOM 0 HG22 VAL B 244 2.897 -0.470 -8.576 1.00 17.19 H new ATOM 0 HG23 VAL B 244 3.909 -0.463 -10.040 1.00 17.19 H new ATOM 1787 N CYS B 245 6.595 -2.881 -6.654 1.00 15.40 N ATOM 1788 CA CYS B 245 7.768 -3.739 -6.320 1.00 16.70 C ATOM 1789 C CYS B 245 7.319 -5.201 -6.226 1.00 16.64 C ATOM 1790 O CYS B 245 7.347 -5.786 -5.163 1.00 17.47 O ATOM 1791 CB CYS B 245 8.364 -3.300 -4.979 1.00 15.93 C ATOM 1792 SG CYS B 245 7.030 -2.923 -3.815 1.00 18.24 S ATOM 0 H CYS B 245 5.758 -3.053 -6.097 1.00 15.40 H new ATOM 0 HA CYS B 245 8.523 -3.638 -7.100 1.00 16.70 H new ATOM 0 HB2 CYS B 245 8.999 -4.089 -4.576 1.00 15.93 H new ATOM 0 HB3 CYS B 245 8.996 -2.423 -5.120 1.00 15.93 H new ATOM 0 HG CYS B 245 6.205 -2.079 -4.359 1.00 18.24 H new ATOM 1798 N PRO B 246 6.917 -5.749 -7.348 1.00 18.63 N ATOM 1799 CA PRO B 246 6.453 -7.145 -7.425 1.00 19.52 C ATOM 1800 C PRO B 246 7.648 -8.104 -7.427 1.00 19.33 C ATOM 1801 O PRO B 246 7.836 -8.781 -8.425 1.00 19.97 O ATOM 1802 CB PRO B 246 5.703 -7.203 -8.759 1.00 18.97 C ATOM 1803 CG PRO B 246 6.251 -6.038 -9.618 1.00 18.88 C ATOM 1804 CD PRO B 246 6.885 -5.030 -8.641 1.00 17.74 C ATOM 1805 OXT PRO B 246 8.352 -8.144 -6.433 1.00 0.00 O ATOM 0 HA PRO B 246 5.830 -7.437 -6.580 1.00 19.52 H new ATOM 0 HB2 PRO B 246 5.865 -8.160 -9.254 1.00 18.97 H new ATOM 0 HB3 PRO B 246 4.629 -7.101 -8.606 1.00 18.97 H new ATOM 0 HG2 PRO B 246 6.989 -6.399 -10.335 1.00 18.88 H new ATOM 0 HG3 PRO B 246 5.451 -5.570 -10.192 1.00 18.88 H new ATOM 0 HD2 PRO B 246 7.886 -4.741 -8.961 1.00 17.74 H new ATOM 0 HD3 PRO B 246 6.295 -4.116 -8.574 1.00 17.74 H new TER 1813 PRO B 246