USER MOD reduce.3.24.130724 H: found=0, std=0, add=890, rem=0, adj=31 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 173:sc= -1.58 USER MOD Set 1.2: B 243 THR OG1 : rot 180:sc= -0.0472 USER MOD Set 2.1: B 229 TYR OH : rot 61:sc= 0.443 USER MOD Set 2.2: B 233 HIS : no HD1:sc= 0.403 K(o=0.85,f=0) USER MOD Set 3.1: B 198 ASN : amide:sc= -6.35! C(o=-6.3!,f=-12!) USER MOD Set 3.2: B 200 LYS NZ :NH3+ 157:sc= 0.00769 (180deg=0) USER MOD Set 4.1: B 179 THR OG1 : rot 150:sc= -4.33! USER MOD Set 4.2: B 180 THR OG1 : rot 172:sc= -1.17! USER MOD Set 5.1: B 158 SER OG : rot 160:sc= -0.0849 USER MOD Set 5.2: B 201 HIS : no HD1:sc= -0.086 X(o=-0.17,f=0.013) USER MOD Single : B 140 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : B 142 SER OG : rot 180:sc= 0 USER MOD Single : B 144 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : B 149 TYR OH : rot 180:sc= 0 USER MOD Single : B 152 LYS NZ :NH3+ -112:sc= -0.144 (180deg=-0.827) USER MOD Single : B 154 THR OG1 : rot 180:sc= 0.0881 USER MOD Single : B 164 ASN : amide:sc= -0.16 X(o=-0.16,f=-0.038) USER MOD Single : B 167 ASN : amide:sc= -2.03 K(o=-2,f=-3.1!) USER MOD Single : B 171 THR OG1 : rot 79:sc= -0.463 USER MOD Single : B 177 SER OG : rot -83:sc= 0.0101 USER MOD Single : B 181 LYS NZ :NH3+ 172:sc= 0 (180deg=-0.0937) USER MOD Single : B 184 TYR OH : rot 180:sc= 0 USER MOD Single : B 185 CYS SG : rot -149:sc= 0.632 USER MOD Single : B 187 SER OG : rot -150:sc= -0.188 USER MOD Single : B 189 SER OG : rot 142:sc= 0.352 USER MOD Single : B 193 ASN : amide:sc= -0.494 K(o=-0.49,f=-3.8!) USER MOD Single : B 195 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 202 TYR OH : rot 180:sc= 0 USER MOD Single : B 203 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 206 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 209 SER OG : rot 180:sc= -0.541 USER MOD Single : B 213 TYR OH : rot 180:sc=-0.00688 USER MOD Single : B 215 THR OG1 : rot 180:sc= -0.0271 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= -0.0457 K(o=-0.046,f=-2!) USER MOD Single : B 221 ASN :FLIP amide:sc= 0 F(o=-1.3,f=0) USER MOD Single : B 222 SER OG : rot 180:sc=-4.17e-05 USER MOD Single : B 224 GLN : amide:sc= -0.0126 K(o=-0.013,f=-3!) USER MOD Single : B 225 GLN : amide:sc= -0.0752 K(o=-0.075,f=-4.8!) USER MOD Single : B 230 TYR OH : rot 150:sc= 0 USER MOD Single : B 231 SER OG : rot 83:sc= 0.147 USER MOD Single : B 232 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 238 CYS SG : rot -105:sc= -6.39! USER MOD Single : B 239 HIS : no HE2:sc= -0.813 K(o=-0.81,f=-2.3) USER MOD Single : B 245 CYS SG : rot 83:sc= -7.67! USER MOD ----------------------------------------------------------------- HETATM 1 C ACE A 100 2.048 0.448 11.314 1.00 14.10 C HETATM 2 O ACE A 100 2.656 0.238 10.284 1.00 14.64 O HETATM 3 CH3 ACE A 100 2.524 -0.129 12.649 1.00 14.17 C HETATM 0 H1 ACE A 100 2.729 0.685 13.345 1.00 14.17 H new HETATM 0 H2 ACE A 100 1.749 -0.774 13.064 1.00 14.17 H new HETATM 0 H3 ACE A 100 3.433 -0.709 12.491 1.00 14.17 H new HETATM 7 N PTR A 101 0.964 1.174 11.325 1.00 14.28 N HETATM 8 CA PTR A 101 0.449 1.764 10.056 1.00 13.54 C HETATM 9 C PTR A 101 0.376 3.286 10.194 1.00 14.12 C HETATM 10 O PTR A 101 0.576 3.832 11.260 1.00 13.97 O HETATM 11 CB PTR A 101 -0.946 1.208 9.765 1.00 13.83 C HETATM 12 CG PTR A 101 -0.846 -0.268 9.460 1.00 12.91 C HETATM 13 CD1 PTR A 101 -0.615 -0.699 8.143 1.00 12.17 C HETATM 14 CD2 PTR A 101 -0.985 -1.210 10.494 1.00 12.70 C HETATM 15 CE1 PTR A 101 -0.521 -2.072 7.859 1.00 12.08 C HETATM 16 CE2 PTR A 101 -0.891 -2.583 10.211 1.00 11.44 C HETATM 17 CZ PTR A 101 -0.660 -3.014 8.893 1.00 13.78 C HETATM 18 OH PTR A 101 -0.565 -4.412 8.604 1.00 14.51 O HETATM 19 P PTR A 101 -0.930 -5.502 9.731 1.00 17.94 P HETATM 20 O1P PTR A 101 -2.345 -5.198 10.046 1.00 18.17 O HETATM 21 O2P PTR A 101 0.031 -5.198 10.815 1.00 15.88 O HETATM 22 O3P PTR A 101 -0.706 -6.789 9.037 1.00 18.41 O HETATM 0 HE2 PTR A 101 -0.997 -3.314 11.013 1.00 11.44 H new HETATM 0 HE1 PTR A 101 -0.340 -2.406 6.837 1.00 12.08 H new HETATM 0 HD2 PTR A 101 -1.166 -0.875 11.515 1.00 12.70 H new HETATM 0 HD1 PTR A 101 -0.509 0.032 7.341 1.00 12.17 H new HETATM 0 HB3 PTR A 101 -1.600 1.370 10.622 1.00 13.83 H new HETATM 0 HB2 PTR A 101 -1.391 1.735 8.921 1.00 13.83 H new HETATM 0 HA PTR A 101 1.120 1.507 9.236 1.00 13.54 H new ATOM 31 N GLU A 102 0.095 3.975 9.122 1.00 15.01 N ATOM 32 CA GLU A 102 0.011 5.462 9.193 1.00 18.67 C ATOM 33 C GLU A 102 -1.452 5.897 9.096 1.00 23.30 C ATOM 34 O GLU A 102 -2.355 5.086 9.129 1.00 23.42 O ATOM 35 CB GLU A 102 0.803 6.072 8.035 1.00 18.41 C ATOM 36 CG GLU A 102 2.223 5.502 8.031 1.00 20.30 C ATOM 37 CD GLU A 102 3.029 6.129 9.170 1.00 19.75 C ATOM 38 OE1 GLU A 102 2.417 6.699 10.059 1.00 21.81 O ATOM 39 OE2 GLU A 102 4.244 6.029 9.134 1.00 19.69 O ATOM 0 H GLU A 102 -0.080 3.573 8.201 1.00 15.01 H new ATOM 0 HA GLU A 102 0.428 5.805 10.140 1.00 18.67 H new ATOM 0 HB2 GLU A 102 0.309 5.853 7.088 1.00 18.41 H new ATOM 0 HB3 GLU A 102 0.836 7.157 8.135 1.00 18.41 H new ATOM 0 HG2 GLU A 102 2.191 4.419 8.147 1.00 20.30 H new ATOM 0 HG3 GLU A 102 2.705 5.706 7.075 1.00 20.30 H new ATOM 46 N GLU A 103 -1.694 7.175 8.978 1.00 29.30 N ATOM 47 CA GLU A 103 -3.098 7.662 8.881 1.00 35.63 C ATOM 48 C GLU A 103 -3.201 8.713 7.772 1.00 37.94 C ATOM 49 O GLU A 103 -2.270 9.447 7.511 1.00 40.44 O ATOM 50 CB GLU A 103 -3.515 8.288 10.214 1.00 38.84 C ATOM 51 CG GLU A 103 -4.076 7.202 11.135 1.00 44.99 C ATOM 52 CD GLU A 103 -5.356 7.709 11.802 1.00 50.48 C ATOM 53 OE1 GLU A 103 -6.069 8.470 11.169 1.00 53.57 O ATOM 54 OE2 GLU A 103 -5.602 7.327 12.934 1.00 53.04 O ATOM 0 H GLU A 103 -0.979 7.902 8.945 1.00 29.30 H new ATOM 0 HA GLU A 103 -3.756 6.824 8.650 1.00 35.63 H new ATOM 0 HB2 GLU A 103 -2.659 8.772 10.684 1.00 38.84 H new ATOM 0 HB3 GLU A 103 -4.265 9.061 10.046 1.00 38.84 H new ATOM 0 HG2 GLU A 103 -4.285 6.298 10.563 1.00 44.99 H new ATOM 0 HG3 GLU A 103 -3.339 6.937 11.893 1.00 44.99 H new ATOM 61 N ILE A 104 -4.330 8.791 7.122 1.00 39.26 N ATOM 62 CA ILE A 104 -4.495 9.795 6.033 1.00 40.91 C ATOM 63 C ILE A 104 -5.057 11.091 6.621 1.00 42.72 C ATOM 64 O ILE A 104 -6.226 11.185 6.939 1.00 43.33 O ATOM 65 CB ILE A 104 -5.463 9.244 4.980 1.00 40.30 C ATOM 66 CG1 ILE A 104 -4.787 8.102 4.215 1.00 39.28 C ATOM 67 CG2 ILE A 104 -5.848 10.356 3.999 1.00 41.44 C ATOM 68 CD1 ILE A 104 -3.670 8.665 3.334 1.00 37.66 C ATOM 0 H ILE A 104 -5.145 8.203 7.298 1.00 39.26 H new ATOM 0 HA ILE A 104 -3.530 9.997 5.568 1.00 40.91 H new ATOM 0 HB ILE A 104 -6.361 8.873 5.475 1.00 40.30 H new ATOM 0 HG12 ILE A 104 -4.379 7.373 4.915 1.00 39.28 H new ATOM 0 HG13 ILE A 104 -5.520 7.579 3.601 1.00 39.28 H new ATOM 0 HG21 ILE A 104 -6.536 9.960 3.252 1.00 41.44 H new ATOM 0 HG22 ILE A 104 -6.330 11.169 4.542 1.00 41.44 H new ATOM 0 HG23 ILE A 104 -4.952 10.731 3.504 1.00 41.44 H new ATOM 0 HD11 ILE A 104 -3.190 7.851 2.790 1.00 37.66 H new ATOM 0 HD12 ILE A 104 -4.091 9.377 2.624 1.00 37.66 H new ATOM 0 HD13 ILE A 104 -2.932 9.168 3.959 1.00 37.66 H new ATOM 80 N GLU A 105 -4.233 12.093 6.768 1.00 0.00 N ATOM 81 CA GLU A 105 -4.721 13.381 7.336 1.00 0.00 C ATOM 82 C GLU A 105 -4.451 14.513 6.342 1.00 0.00 C ATOM 83 O GLU A 105 -3.481 15.226 6.539 1.00 0.00 O ATOM 84 CB GLU A 105 -3.991 13.668 8.650 1.00 0.00 C ATOM 85 CG GLU A 105 -4.365 12.605 9.685 1.00 0.00 C ATOM 86 CD GLU A 105 -5.006 13.278 10.900 1.00 0.00 C ATOM 87 OE1 GLU A 105 -4.566 14.360 11.253 1.00 0.00 O ATOM 88 OE2 GLU A 105 -5.927 12.702 11.454 1.00 0.00 O ATOM 89 OXT GLU A 105 -5.217 14.645 5.403 1.00 0.00 O ATOM 0 H GLU A 105 -3.244 12.075 6.519 1.00 0.00 H new ATOM 0 HA GLU A 105 -5.792 13.313 7.524 1.00 0.00 H new ATOM 0 HB2 GLU A 105 -2.913 13.669 8.487 1.00 0.00 H new ATOM 0 HB3 GLU A 105 -4.258 14.659 9.018 1.00 0.00 H new ATOM 0 HG2 GLU A 105 -5.057 11.885 9.248 1.00 0.00 H new ATOM 0 HG3 GLU A 105 -3.477 12.051 9.989 1.00 0.00 H new TER 96 GLU A 105 ATOM 97 N MET B 140 -12.331 -12.030 -18.076 1.00 0.00 N ATOM 98 CA MET B 140 -10.967 -12.297 -18.613 1.00 0.00 C ATOM 99 C MET B 140 -9.925 -11.975 -17.542 1.00 0.00 C ATOM 100 O MET B 140 -9.009 -12.737 -17.303 1.00 0.00 O ATOM 101 CB MET B 140 -10.723 -11.420 -19.843 1.00 0.00 C ATOM 102 CG MET B 140 -11.064 -9.967 -19.510 1.00 0.00 C ATOM 103 SD MET B 140 -11.778 -9.165 -20.966 1.00 0.00 S ATOM 104 CE MET B 140 -13.453 -8.959 -20.312 1.00 0.00 C ATOM 0 HA MET B 140 -10.886 -13.347 -18.894 1.00 0.00 H new ATOM 0 HB2 MET B 140 -9.682 -11.497 -20.157 1.00 0.00 H new ATOM 0 HB3 MET B 140 -11.334 -11.766 -20.677 1.00 0.00 H new ATOM 0 HG2 MET B 140 -11.768 -9.929 -18.679 1.00 0.00 H new ATOM 0 HG3 MET B 140 -10.167 -9.436 -19.192 1.00 0.00 H new ATOM 0 HE1 MET B 140 -14.079 -8.473 -21.061 1.00 0.00 H new ATOM 0 HE2 MET B 140 -13.871 -9.936 -20.068 1.00 0.00 H new ATOM 0 HE3 MET B 140 -13.419 -8.344 -19.413 1.00 0.00 H new ATOM 116 N ASP B 141 -10.056 -10.851 -16.892 1.00 0.00 N ATOM 117 CA ASP B 141 -9.072 -10.481 -15.836 1.00 0.00 C ATOM 118 C ASP B 141 -9.716 -10.648 -14.459 1.00 0.00 C ATOM 119 O ASP B 141 -10.924 -10.675 -14.327 1.00 0.00 O ATOM 120 CB ASP B 141 -8.643 -9.025 -16.026 1.00 0.00 C ATOM 121 CG ASP B 141 -7.478 -8.961 -17.015 1.00 0.00 C ATOM 122 OD1 ASP B 141 -7.738 -8.966 -18.207 1.00 0.00 O ATOM 123 OD2 ASP B 141 -6.346 -8.907 -16.564 1.00 0.00 O ATOM 0 H ASP B 141 -10.802 -10.173 -17.047 1.00 0.00 H new ATOM 0 HA ASP B 141 -8.199 -11.129 -15.910 1.00 0.00 H new ATOM 0 HB2 ASP B 141 -9.481 -8.433 -16.396 1.00 0.00 H new ATOM 0 HB3 ASP B 141 -8.346 -8.595 -15.070 1.00 0.00 H new ATOM 128 N SER B 142 -8.920 -10.760 -13.431 1.00 0.00 N ATOM 129 CA SER B 142 -9.487 -10.924 -12.063 1.00 0.00 C ATOM 130 C SER B 142 -8.641 -10.136 -11.063 1.00 0.00 C ATOM 131 O SER B 142 -7.450 -9.971 -11.235 1.00 0.00 O ATOM 132 CB SER B 142 -9.480 -12.405 -11.683 1.00 0.00 C ATOM 133 OG SER B 142 -8.425 -13.062 -12.374 1.00 0.00 O ATOM 0 H SER B 142 -7.901 -10.745 -13.480 1.00 0.00 H new ATOM 0 HA SER B 142 -10.511 -10.550 -12.046 1.00 0.00 H new ATOM 0 HB2 SER B 142 -9.349 -12.516 -10.607 1.00 0.00 H new ATOM 0 HB3 SER B 142 -10.437 -12.862 -11.937 1.00 0.00 H new ATOM 0 HG SER B 142 -8.416 -14.011 -12.131 1.00 0.00 H new ATOM 139 N ILE B 143 -9.247 -9.647 -10.015 1.00 0.00 N ATOM 140 CA ILE B 143 -8.476 -8.871 -9.004 1.00 0.00 C ATOM 141 C ILE B 143 -7.539 -9.809 -8.238 1.00 0.00 C ATOM 142 O ILE B 143 -6.698 -9.373 -7.477 1.00 0.00 O ATOM 143 CB ILE B 143 -9.446 -8.208 -8.024 1.00 0.00 C ATOM 144 CG1 ILE B 143 -8.654 -7.397 -6.997 1.00 0.00 C ATOM 145 CG2 ILE B 143 -10.261 -9.285 -7.306 1.00 0.00 C ATOM 146 CD1 ILE B 143 -9.623 -6.635 -6.090 1.00 0.00 C ATOM 0 H ILE B 143 -10.242 -9.752 -9.816 1.00 0.00 H new ATOM 0 HA ILE B 143 -7.886 -8.106 -9.509 1.00 0.00 H new ATOM 0 HB ILE B 143 -10.120 -7.547 -8.569 1.00 0.00 H new ATOM 0 HG12 ILE B 143 -8.026 -8.059 -6.401 1.00 0.00 H new ATOM 0 HG13 ILE B 143 -7.989 -6.698 -7.504 1.00 0.00 H new ATOM 0 HG21 ILE B 143 -10.952 -8.813 -6.608 1.00 0.00 H new ATOM 0 HG22 ILE B 143 -10.824 -9.864 -8.038 1.00 0.00 H new ATOM 0 HG23 ILE B 143 -9.589 -9.946 -6.760 1.00 0.00 H new ATOM 0 HD11 ILE B 143 -9.058 -6.057 -5.358 1.00 0.00 H new ATOM 0 HD12 ILE B 143 -10.232 -5.961 -6.693 1.00 0.00 H new ATOM 0 HD13 ILE B 143 -10.270 -7.343 -5.572 1.00 0.00 H new ATOM 158 N GLN B 144 -7.676 -11.093 -8.430 1.00 0.00 N ATOM 159 CA GLN B 144 -6.792 -12.052 -7.708 1.00 0.00 C ATOM 160 C GLN B 144 -5.419 -12.100 -8.386 1.00 0.00 C ATOM 161 O GLN B 144 -4.544 -12.840 -7.981 1.00 0.00 O ATOM 162 CB GLN B 144 -7.422 -13.446 -7.737 1.00 0.00 C ATOM 163 CG GLN B 144 -6.744 -14.334 -6.692 1.00 0.00 C ATOM 164 CD GLN B 144 -6.983 -15.804 -7.038 1.00 0.00 C ATOM 165 OE1 GLN B 144 -7.887 -16.425 -6.515 1.00 0.00 O ATOM 166 NE2 GLN B 144 -6.206 -16.393 -7.906 1.00 0.00 N ATOM 0 H GLN B 144 -8.361 -11.519 -9.055 1.00 0.00 H new ATOM 0 HA GLN B 144 -6.673 -11.725 -6.675 1.00 0.00 H new ATOM 0 HB2 GLN B 144 -8.491 -13.378 -7.534 1.00 0.00 H new ATOM 0 HB3 GLN B 144 -7.313 -13.885 -8.729 1.00 0.00 H new ATOM 0 HG2 GLN B 144 -5.674 -14.126 -6.662 1.00 0.00 H new ATOM 0 HG3 GLN B 144 -7.140 -14.114 -5.701 1.00 0.00 H new ATOM 0 HE21 GLN B 144 -5.447 -15.873 -8.346 1.00 0.00 H new ATOM 0 HE22 GLN B 144 -6.358 -17.373 -8.144 1.00 0.00 H new ATOM 175 N ALA B 145 -5.220 -11.319 -9.414 1.00 42.36 N ATOM 176 CA ALA B 145 -3.901 -11.326 -10.110 1.00 39.52 C ATOM 177 C ALA B 145 -3.603 -9.924 -10.645 1.00 36.36 C ATOM 178 O ALA B 145 -3.486 -9.714 -11.836 1.00 36.34 O ATOM 179 CB ALA B 145 -3.944 -12.318 -11.273 1.00 40.62 C ATOM 0 H ALA B 145 -5.912 -10.678 -9.801 1.00 42.36 H new ATOM 0 HA ALA B 145 -3.120 -11.622 -9.410 1.00 39.52 H new ATOM 0 HB1 ALA B 145 -2.980 -12.324 -11.782 1.00 40.62 H new ATOM 0 HB2 ALA B 145 -4.159 -13.316 -10.892 1.00 40.62 H new ATOM 0 HB3 ALA B 145 -4.724 -12.022 -11.975 1.00 40.62 H new ATOM 185 N GLU B 146 -3.484 -8.959 -9.773 1.00 32.22 N ATOM 186 CA GLU B 146 -3.196 -7.571 -10.229 1.00 28.03 C ATOM 187 C GLU B 146 -1.686 -7.387 -10.392 1.00 24.38 C ATOM 188 O GLU B 146 -0.898 -8.161 -9.884 1.00 22.48 O ATOM 189 CB GLU B 146 -3.720 -6.575 -9.193 1.00 27.81 C ATOM 190 CG GLU B 146 -5.099 -7.023 -8.703 1.00 30.44 C ATOM 191 CD GLU B 146 -5.047 -7.274 -7.195 1.00 31.15 C ATOM 192 OE1 GLU B 146 -3.966 -7.529 -6.693 1.00 34.56 O ATOM 193 OE2 GLU B 146 -6.092 -7.206 -6.567 1.00 30.91 O ATOM 0 H GLU B 146 -3.574 -9.073 -8.763 1.00 32.22 H new ATOM 0 HA GLU B 146 -3.688 -7.396 -11.186 1.00 28.03 H new ATOM 0 HB2 GLU B 146 -3.028 -6.510 -8.353 1.00 27.81 H new ATOM 0 HB3 GLU B 146 -3.784 -5.579 -9.631 1.00 27.81 H new ATOM 0 HG2 GLU B 146 -5.843 -6.260 -8.930 1.00 30.44 H new ATOM 0 HG3 GLU B 146 -5.405 -7.931 -9.223 1.00 30.44 H new ATOM 200 N GLU B 147 -1.276 -6.365 -11.093 1.00 21.92 N ATOM 201 CA GLU B 147 0.182 -6.131 -11.286 1.00 21.70 C ATOM 202 C GLU B 147 0.823 -5.782 -9.940 1.00 19.46 C ATOM 203 O GLU B 147 2.024 -5.853 -9.776 1.00 19.28 O ATOM 204 CB GLU B 147 0.389 -4.975 -12.268 1.00 26.72 C ATOM 205 CG GLU B 147 -0.388 -3.749 -11.787 1.00 37.15 C ATOM 206 CD GLU B 147 -1.271 -3.226 -12.921 1.00 41.71 C ATOM 207 OE1 GLU B 147 -0.728 -2.893 -13.962 1.00 45.02 O ATOM 208 OE2 GLU B 147 -2.474 -3.166 -12.729 1.00 46.00 O ATOM 0 H GLU B 147 -1.888 -5.683 -11.540 1.00 21.92 H new ATOM 0 HA GLU B 147 0.646 -7.032 -11.687 1.00 21.70 H new ATOM 0 HB2 GLU B 147 1.450 -4.738 -12.348 1.00 26.72 H new ATOM 0 HB3 GLU B 147 0.052 -5.265 -13.263 1.00 26.72 H new ATOM 0 HG2 GLU B 147 -1.002 -4.010 -10.925 1.00 37.15 H new ATOM 0 HG3 GLU B 147 0.304 -2.972 -11.462 1.00 37.15 H new ATOM 215 N TRP B 148 0.028 -5.408 -8.973 1.00 17.10 N ATOM 216 CA TRP B 148 0.589 -5.058 -7.637 1.00 12.75 C ATOM 217 C TRP B 148 0.142 -6.101 -6.611 1.00 12.19 C ATOM 218 O TRP B 148 -0.090 -5.793 -5.458 1.00 11.66 O ATOM 219 CB TRP B 148 0.090 -3.673 -7.208 1.00 14.42 C ATOM 220 CG TRP B 148 -1.307 -3.461 -7.701 1.00 13.12 C ATOM 221 CD1 TRP B 148 -1.640 -2.777 -8.820 1.00 13.11 C ATOM 222 CD2 TRP B 148 -2.559 -3.920 -7.113 1.00 12.81 C ATOM 223 NE1 TRP B 148 -3.017 -2.787 -8.959 1.00 12.63 N ATOM 224 CE2 TRP B 148 -3.629 -3.477 -7.933 1.00 13.14 C ATOM 225 CE3 TRP B 148 -2.869 -4.671 -5.957 1.00 10.52 C ATOM 226 CZ2 TRP B 148 -4.961 -3.769 -7.619 1.00 13.39 C ATOM 227 CZ3 TRP B 148 -4.210 -4.966 -5.638 1.00 12.83 C ATOM 228 CH2 TRP B 148 -5.252 -4.515 -6.467 1.00 12.53 C ATOM 0 H TRP B 148 -0.986 -5.330 -9.051 1.00 17.10 H new ATOM 0 HA TRP B 148 1.677 -5.043 -7.696 1.00 12.75 H new ATOM 0 HB2 TRP B 148 0.119 -3.587 -6.122 1.00 14.42 H new ATOM 0 HB3 TRP B 148 0.747 -2.900 -7.607 1.00 14.42 H new ATOM 0 HD1 TRP B 148 -0.944 -2.301 -9.495 1.00 13.11 H new ATOM 0 HE1 TRP B 148 -3.518 -2.339 -9.726 1.00 12.63 H new ATOM 0 HE3 TRP B 148 -2.074 -5.021 -5.315 1.00 10.52 H new ATOM 0 HZ2 TRP B 148 -5.759 -3.423 -8.259 1.00 13.39 H new ATOM 0 HZ3 TRP B 148 -4.438 -5.541 -4.753 1.00 12.83 H new ATOM 0 HH2 TRP B 148 -6.278 -4.743 -6.217 1.00 12.53 H new ATOM 239 N TYR B 149 0.016 -7.334 -7.020 1.00 11.66 N ATOM 240 CA TYR B 149 -0.417 -8.397 -6.070 1.00 13.63 C ATOM 241 C TYR B 149 0.777 -9.288 -5.721 1.00 14.73 C ATOM 242 O TYR B 149 1.265 -10.038 -6.544 1.00 16.34 O ATOM 243 CB TYR B 149 -1.513 -9.245 -6.720 1.00 12.52 C ATOM 244 CG TYR B 149 -2.250 -10.020 -5.655 1.00 15.49 C ATOM 245 CD1 TYR B 149 -2.745 -9.359 -4.518 1.00 14.45 C ATOM 246 CD2 TYR B 149 -2.439 -11.405 -5.800 1.00 19.03 C ATOM 247 CE1 TYR B 149 -3.430 -10.082 -3.527 1.00 15.99 C ATOM 248 CE2 TYR B 149 -3.125 -12.129 -4.810 1.00 20.41 C ATOM 249 CZ TYR B 149 -3.621 -11.468 -3.674 1.00 21.15 C ATOM 250 OH TYR B 149 -4.293 -12.178 -2.700 1.00 23.67 O ATOM 0 H TYR B 149 0.195 -7.651 -7.973 1.00 11.66 H new ATOM 0 HA TYR B 149 -0.804 -7.936 -5.161 1.00 13.63 H new ATOM 0 HB2 TYR B 149 -2.207 -8.605 -7.265 1.00 12.52 H new ATOM 0 HB3 TYR B 149 -1.075 -9.930 -7.446 1.00 12.52 H new ATOM 0 HD1 TYR B 149 -2.599 -8.295 -4.406 1.00 14.45 H new ATOM 0 HD2 TYR B 149 -2.057 -11.913 -6.673 1.00 19.03 H new ATOM 0 HE1 TYR B 149 -3.810 -9.574 -2.653 1.00 15.99 H new ATOM 0 HE2 TYR B 149 -3.271 -13.193 -4.922 1.00 20.41 H new ATOM 0 HH TYR B 149 -4.339 -13.123 -2.957 1.00 23.67 H new ATOM 260 N PHE B 150 1.250 -9.215 -4.508 1.00 14.41 N ATOM 261 CA PHE B 150 2.411 -10.059 -4.109 1.00 13.20 C ATOM 262 C PHE B 150 1.903 -11.335 -3.433 1.00 12.95 C ATOM 263 O PHE B 150 2.444 -12.407 -3.623 1.00 12.44 O ATOM 264 CB PHE B 150 3.295 -9.283 -3.130 1.00 13.34 C ATOM 265 CG PHE B 150 4.598 -8.925 -3.804 1.00 10.91 C ATOM 266 CD1 PHE B 150 4.591 -8.360 -5.090 1.00 10.43 C ATOM 267 CD2 PHE B 150 5.816 -9.155 -3.144 1.00 10.09 C ATOM 268 CE1 PHE B 150 5.804 -8.027 -5.718 1.00 9.38 C ATOM 269 CE2 PHE B 150 7.029 -8.822 -3.770 1.00 7.94 C ATOM 270 CZ PHE B 150 7.022 -8.258 -5.057 1.00 8.81 C ATOM 0 H PHE B 150 0.883 -8.607 -3.776 1.00 14.41 H new ATOM 0 HA PHE B 150 2.991 -10.320 -4.994 1.00 13.20 H new ATOM 0 HB2 PHE B 150 2.784 -8.379 -2.800 1.00 13.34 H new ATOM 0 HB3 PHE B 150 3.486 -9.884 -2.241 1.00 13.34 H new ATOM 0 HD1 PHE B 150 3.654 -8.181 -5.596 1.00 10.43 H new ATOM 0 HD2 PHE B 150 5.820 -9.588 -2.155 1.00 10.09 H new ATOM 0 HE1 PHE B 150 5.799 -7.594 -6.707 1.00 9.38 H new ATOM 0 HE2 PHE B 150 7.966 -8.999 -3.263 1.00 7.94 H new ATOM 0 HZ PHE B 150 7.954 -8.002 -5.539 1.00 8.81 H new ATOM 280 N GLY B 151 0.869 -11.229 -2.644 1.00 14.57 N ATOM 281 CA GLY B 151 0.329 -12.433 -1.957 1.00 13.68 C ATOM 282 C GLY B 151 0.616 -12.335 -0.459 1.00 15.95 C ATOM 283 O GLY B 151 0.740 -11.259 0.091 1.00 16.08 O ATOM 0 H GLY B 151 0.375 -10.359 -2.446 1.00 14.57 H new ATOM 0 HA2 GLY B 151 -0.745 -12.512 -2.128 1.00 13.68 H new ATOM 0 HA3 GLY B 151 0.784 -13.334 -2.367 1.00 13.68 H new ATOM 287 N LYS B 152 0.724 -13.452 0.204 1.00 14.92 N ATOM 288 CA LYS B 152 1.004 -13.426 1.668 1.00 16.57 C ATOM 289 C LYS B 152 2.517 -13.422 1.897 1.00 15.79 C ATOM 290 O LYS B 152 3.218 -14.322 1.479 1.00 15.62 O ATOM 291 CB LYS B 152 0.390 -14.663 2.328 1.00 19.39 C ATOM 292 CG LYS B 152 0.665 -14.630 3.832 1.00 26.20 C ATOM 293 CD LYS B 152 -0.241 -15.641 4.540 1.00 32.70 C ATOM 294 CE LYS B 152 0.108 -17.055 4.070 1.00 38.73 C ATOM 295 NZ LYS B 152 -0.822 -17.458 2.977 1.00 43.61 N ATOM 0 H LYS B 152 0.631 -14.382 -0.204 1.00 14.92 H new ATOM 0 HA LYS B 152 0.568 -12.528 2.106 1.00 16.57 H new ATOM 0 HB2 LYS B 152 -0.684 -14.690 2.145 1.00 19.39 H new ATOM 0 HB3 LYS B 152 0.811 -15.568 1.891 1.00 19.39 H new ATOM 0 HG2 LYS B 152 1.711 -14.865 4.026 1.00 26.20 H new ATOM 0 HG3 LYS B 152 0.485 -13.629 4.223 1.00 26.20 H new ATOM 0 HD2 LYS B 152 -0.116 -15.564 5.620 1.00 32.70 H new ATOM 0 HD3 LYS B 152 -1.287 -15.422 4.324 1.00 32.70 H new ATOM 0 HE2 LYS B 152 1.138 -17.088 3.716 1.00 38.73 H new ATOM 0 HE3 LYS B 152 0.034 -17.755 4.902 1.00 38.73 H new ATOM 0 HZ1 LYS B 152 -1.442 -18.222 3.313 1.00 43.61 H new ATOM 0 HZ2 LYS B 152 -1.401 -16.641 2.695 1.00 43.61 H new ATOM 0 HZ3 LYS B 152 -0.273 -17.792 2.159 1.00 43.61 H new ATOM 309 N ILE B 153 3.025 -12.418 2.556 1.00 16.90 N ATOM 310 CA ILE B 153 4.493 -12.360 2.809 1.00 16.60 C ATOM 311 C ILE B 153 4.745 -11.998 4.274 1.00 17.59 C ATOM 312 O ILE B 153 3.843 -11.621 4.994 1.00 21.20 O ATOM 313 CB ILE B 153 5.125 -11.301 1.905 1.00 15.36 C ATOM 314 CG1 ILE B 153 4.545 -9.926 2.247 1.00 14.56 C ATOM 315 CG2 ILE B 153 4.820 -11.630 0.442 1.00 15.80 C ATOM 316 CD1 ILE B 153 5.531 -8.836 1.822 1.00 13.00 C ATOM 0 H ILE B 153 2.488 -11.636 2.930 1.00 16.90 H new ATOM 0 HA ILE B 153 4.937 -13.332 2.594 1.00 16.60 H new ATOM 0 HB ILE B 153 6.204 -11.291 2.059 1.00 15.36 H new ATOM 0 HG12 ILE B 153 3.591 -9.786 1.740 1.00 14.56 H new ATOM 0 HG13 ILE B 153 4.350 -9.858 3.317 1.00 14.56 H new ATOM 0 HG21 ILE B 153 5.271 -10.875 -0.202 1.00 15.80 H new ATOM 0 HG22 ILE B 153 5.231 -12.609 0.196 1.00 15.80 H new ATOM 0 HG23 ILE B 153 3.741 -11.641 0.289 1.00 15.80 H new ATOM 0 HD11 ILE B 153 5.118 -7.857 2.065 1.00 13.00 H new ATOM 0 HD12 ILE B 153 6.475 -8.973 2.350 1.00 13.00 H new ATOM 0 HD13 ILE B 153 5.703 -8.900 0.748 1.00 13.00 H new ATOM 328 N THR B 154 5.966 -12.112 4.722 1.00 16.79 N ATOM 329 CA THR B 154 6.273 -11.776 6.142 1.00 16.02 C ATOM 330 C THR B 154 6.532 -10.273 6.265 1.00 15.06 C ATOM 331 O THR B 154 6.508 -9.547 5.290 1.00 14.17 O ATOM 332 CB THR B 154 7.516 -12.547 6.591 1.00 18.43 C ATOM 333 OG1 THR B 154 8.681 -11.860 6.154 1.00 22.52 O ATOM 334 CG2 THR B 154 7.493 -13.953 5.989 1.00 19.67 C ATOM 0 H THR B 154 6.763 -12.423 4.167 1.00 16.79 H new ATOM 0 HA THR B 154 5.428 -12.052 6.772 1.00 16.02 H new ATOM 0 HB THR B 154 7.524 -12.621 7.678 1.00 18.43 H new ATOM 0 HG1 THR B 154 9.478 -12.352 6.442 1.00 22.52 H new ATOM 0 HG21 THR B 154 8.379 -14.501 6.310 1.00 19.67 H new ATOM 0 HG22 THR B 154 6.600 -14.479 6.326 1.00 19.67 H new ATOM 0 HG23 THR B 154 7.484 -13.883 4.901 1.00 19.67 H new ATOM 342 N ARG B 155 6.781 -9.800 7.456 1.00 15.92 N ATOM 343 CA ARG B 155 7.042 -8.345 7.639 1.00 14.63 C ATOM 344 C ARG B 155 8.515 -8.050 7.354 1.00 15.69 C ATOM 345 O ARG B 155 8.847 -7.107 6.665 1.00 13.45 O ATOM 346 CB ARG B 155 6.710 -7.943 9.078 1.00 13.07 C ATOM 347 CG ARG B 155 6.997 -6.452 9.269 1.00 14.81 C ATOM 348 CD ARG B 155 6.524 -6.013 10.656 1.00 13.27 C ATOM 349 NE ARG B 155 6.945 -7.021 11.667 1.00 16.05 N ATOM 350 CZ ARG B 155 6.215 -7.223 12.730 1.00 8.86 C ATOM 351 NH1 ARG B 155 5.017 -7.724 12.613 1.00 8.73 N ATOM 352 NH2 ARG B 155 6.684 -6.921 13.910 1.00 12.78 N ATOM 0 H ARG B 155 6.815 -10.358 8.309 1.00 15.92 H new ATOM 0 HA ARG B 155 6.418 -7.776 6.950 1.00 14.63 H new ATOM 0 HB2 ARG B 155 5.662 -8.153 9.293 1.00 13.07 H new ATOM 0 HB3 ARG B 155 7.304 -8.531 9.778 1.00 13.07 H new ATOM 0 HG2 ARG B 155 8.064 -6.260 9.160 1.00 14.81 H new ATOM 0 HG3 ARG B 155 6.488 -5.872 8.499 1.00 14.81 H new ATOM 0 HD2 ARG B 155 6.943 -5.038 10.903 1.00 13.27 H new ATOM 0 HD3 ARG B 155 5.439 -5.905 10.665 1.00 13.27 H new ATOM 0 HE ARG B 155 7.804 -7.554 11.529 1.00 16.05 H new ATOM 0 HH11 ARG B 155 4.650 -7.958 11.691 1.00 8.73 H new ATOM 0 HH12 ARG B 155 4.447 -7.882 13.444 1.00 8.73 H new ATOM 0 HH21 ARG B 155 7.621 -6.527 14.001 1.00 12.78 H new ATOM 0 HH22 ARG B 155 6.114 -7.079 14.741 1.00 12.78 H new ATOM 366 N ARG B 156 9.403 -8.849 7.881 1.00 16.92 N ATOM 367 CA ARG B 156 10.854 -8.613 7.640 1.00 18.61 C ATOM 368 C ARG B 156 11.103 -8.453 6.139 1.00 17.01 C ATOM 369 O ARG B 156 11.748 -7.520 5.703 1.00 17.04 O ATOM 370 CB ARG B 156 11.659 -9.802 8.168 1.00 24.11 C ATOM 371 CG ARG B 156 13.147 -9.574 7.896 1.00 33.87 C ATOM 372 CD ARG B 156 13.788 -10.886 7.438 1.00 41.26 C ATOM 373 NE ARG B 156 14.838 -10.597 6.421 1.00 49.98 N ATOM 374 CZ ARG B 156 15.900 -11.350 6.348 1.00 51.87 C ATOM 375 NH1 ARG B 156 16.925 -11.108 7.118 1.00 53.57 N ATOM 376 NH2 ARG B 156 15.936 -12.346 5.506 1.00 52.15 N ATOM 0 H ARG B 156 9.186 -9.655 8.468 1.00 16.92 H new ATOM 0 HA ARG B 156 11.165 -7.706 8.158 1.00 18.61 H new ATOM 0 HB2 ARG B 156 11.489 -9.923 9.238 1.00 24.11 H new ATOM 0 HB3 ARG B 156 11.327 -10.722 7.686 1.00 24.11 H new ATOM 0 HG2 ARG B 156 13.275 -8.808 7.131 1.00 33.87 H new ATOM 0 HG3 ARG B 156 13.641 -9.210 8.797 1.00 33.87 H new ATOM 0 HD2 ARG B 156 14.225 -11.406 8.290 1.00 41.26 H new ATOM 0 HD3 ARG B 156 13.030 -11.546 7.016 1.00 41.26 H new ATOM 0 HE ARG B 156 14.726 -9.810 5.782 1.00 49.98 H new ATOM 0 HH11 ARG B 156 16.895 -10.330 7.777 1.00 53.57 H new ATOM 0 HH12 ARG B 156 17.756 -11.697 7.061 1.00 53.57 H new ATOM 0 HH21 ARG B 156 15.134 -12.535 4.905 1.00 52.15 H new ATOM 0 HH22 ARG B 156 16.766 -12.935 5.448 1.00 52.15 H new ATOM 390 N GLU B 157 10.597 -9.357 5.344 1.00 15.73 N ATOM 391 CA GLU B 157 10.805 -9.255 3.872 1.00 15.26 C ATOM 392 C GLU B 157 10.043 -8.043 3.333 1.00 14.10 C ATOM 393 O GLU B 157 10.482 -7.380 2.415 1.00 15.48 O ATOM 394 CB GLU B 157 10.288 -10.526 3.194 1.00 19.30 C ATOM 395 CG GLU B 157 10.422 -10.387 1.677 1.00 28.11 C ATOM 396 CD GLU B 157 10.937 -11.700 1.086 1.00 29.65 C ATOM 397 OE1 GLU B 157 11.995 -12.140 1.506 1.00 28.63 O ATOM 398 OE2 GLU B 157 10.266 -12.243 0.224 1.00 31.13 O ATOM 0 H GLU B 157 10.049 -10.161 5.651 1.00 15.73 H new ATOM 0 HA GLU B 157 11.868 -9.139 3.662 1.00 15.26 H new ATOM 0 HB2 GLU B 157 10.852 -11.391 3.542 1.00 19.30 H new ATOM 0 HB3 GLU B 157 9.246 -10.696 3.463 1.00 19.30 H new ATOM 0 HG2 GLU B 157 9.457 -10.132 1.238 1.00 28.11 H new ATOM 0 HG3 GLU B 157 11.107 -9.574 1.435 1.00 28.11 H new ATOM 405 N SER B 158 8.904 -7.748 3.896 1.00 11.43 N ATOM 406 CA SER B 158 8.114 -6.580 3.417 1.00 9.58 C ATOM 407 C SER B 158 8.999 -5.332 3.415 1.00 10.15 C ATOM 408 O SER B 158 9.137 -4.658 2.413 1.00 12.31 O ATOM 409 CB SER B 158 6.921 -6.357 4.346 1.00 8.90 C ATOM 410 OG SER B 158 6.378 -5.065 4.113 1.00 11.55 O ATOM 0 H SER B 158 8.486 -8.267 4.668 1.00 11.43 H new ATOM 0 HA SER B 158 7.756 -6.773 2.406 1.00 9.58 H new ATOM 0 HB2 SER B 158 6.162 -7.120 4.171 1.00 8.90 H new ATOM 0 HB3 SER B 158 7.233 -6.450 5.386 1.00 8.90 H new ATOM 0 HG SER B 158 5.458 -5.032 4.448 1.00 11.55 H new ATOM 416 N GLU B 159 9.603 -5.019 4.529 1.00 11.35 N ATOM 417 CA GLU B 159 10.478 -3.817 4.591 1.00 12.85 C ATOM 418 C GLU B 159 11.706 -4.036 3.707 1.00 15.16 C ATOM 419 O GLU B 159 12.258 -3.106 3.152 1.00 13.16 O ATOM 420 CB GLU B 159 10.923 -3.592 6.036 1.00 13.71 C ATOM 421 CG GLU B 159 9.844 -2.807 6.787 1.00 16.00 C ATOM 422 CD GLU B 159 10.396 -2.345 8.137 1.00 19.40 C ATOM 423 OE1 GLU B 159 11.558 -2.606 8.399 1.00 21.73 O ATOM 424 OE2 GLU B 159 9.648 -1.736 8.883 1.00 26.69 O ATOM 0 H GLU B 159 9.527 -5.545 5.399 1.00 11.35 H new ATOM 0 HA GLU B 159 9.928 -2.944 4.238 1.00 12.85 H new ATOM 0 HB2 GLU B 159 11.099 -4.549 6.527 1.00 13.71 H new ATOM 0 HB3 GLU B 159 11.866 -3.045 6.056 1.00 13.71 H new ATOM 0 HG2 GLU B 159 9.529 -1.946 6.197 1.00 16.00 H new ATOM 0 HG3 GLU B 159 8.963 -3.431 6.937 1.00 16.00 H new ATOM 431 N ARG B 160 12.140 -5.259 3.570 1.00 15.73 N ATOM 432 CA ARG B 160 13.332 -5.537 2.721 1.00 17.77 C ATOM 433 C ARG B 160 12.968 -5.334 1.250 1.00 17.96 C ATOM 434 O ARG B 160 13.826 -5.179 0.403 1.00 17.67 O ATOM 435 CB ARG B 160 13.784 -6.981 2.935 1.00 21.81 C ATOM 436 CG ARG B 160 15.295 -7.080 2.735 1.00 30.59 C ATOM 437 CD ARG B 160 15.581 -7.711 1.374 1.00 37.74 C ATOM 438 NE ARG B 160 15.509 -9.195 1.489 1.00 43.93 N ATOM 439 CZ ARG B 160 15.784 -9.942 0.456 1.00 48.64 C ATOM 440 NH1 ARG B 160 16.720 -9.582 -0.378 1.00 51.68 N ATOM 441 NH2 ARG B 160 15.125 -11.051 0.259 1.00 50.79 N ATOM 0 H ARG B 160 11.720 -6.078 4.010 1.00 15.73 H new ATOM 0 HA ARG B 160 14.139 -4.857 2.995 1.00 17.77 H new ATOM 0 HB2 ARG B 160 13.518 -7.311 3.939 1.00 21.81 H new ATOM 0 HB3 ARG B 160 13.270 -7.641 2.236 1.00 21.81 H new ATOM 0 HG2 ARG B 160 15.747 -6.090 2.792 1.00 30.59 H new ATOM 0 HG3 ARG B 160 15.740 -7.680 3.528 1.00 30.59 H new ATOM 0 HD2 ARG B 160 14.859 -7.357 0.638 1.00 37.74 H new ATOM 0 HD3 ARG B 160 16.568 -7.410 1.022 1.00 37.74 H new ATOM 0 HE ARG B 160 15.245 -9.626 2.375 1.00 43.93 H new ATOM 0 HH11 ARG B 160 17.237 -8.716 -0.222 1.00 51.68 H new ATOM 0 HH12 ARG B 160 16.935 -10.166 -1.186 1.00 51.68 H new ATOM 0 HH21 ARG B 160 14.395 -11.333 0.913 1.00 50.79 H new ATOM 0 HH22 ARG B 160 15.340 -11.635 -0.549 1.00 50.79 H new ATOM 455 N LEU B 161 11.701 -5.338 0.938 1.00 16.19 N ATOM 456 CA LEU B 161 11.283 -5.149 -0.480 1.00 12.63 C ATOM 457 C LEU B 161 11.206 -3.654 -0.796 1.00 13.41 C ATOM 458 O LEU B 161 11.797 -3.180 -1.746 1.00 14.12 O ATOM 459 CB LEU B 161 9.907 -5.785 -0.691 1.00 10.23 C ATOM 460 CG LEU B 161 10.070 -7.283 -0.947 1.00 11.74 C ATOM 461 CD1 LEU B 161 8.701 -7.908 -1.216 1.00 10.85 C ATOM 462 CD2 LEU B 161 10.975 -7.497 -2.163 1.00 15.84 C ATOM 0 H LEU B 161 10.938 -5.464 1.603 1.00 16.19 H new ATOM 0 HA LEU B 161 12.010 -5.622 -1.140 1.00 12.63 H new ATOM 0 HB2 LEU B 161 9.281 -5.621 0.186 1.00 10.23 H new ATOM 0 HB3 LEU B 161 9.403 -5.314 -1.535 1.00 10.23 H new ATOM 0 HG LEU B 161 10.518 -7.753 -0.072 1.00 11.74 H new ATOM 0 HD11 LEU B 161 8.818 -8.976 -1.398 1.00 10.85 H new ATOM 0 HD12 LEU B 161 8.055 -7.756 -0.351 1.00 10.85 H new ATOM 0 HD13 LEU B 161 8.252 -7.438 -2.091 1.00 10.85 H new ATOM 0 HD21 LEU B 161 11.092 -8.565 -2.346 1.00 15.84 H new ATOM 0 HD22 LEU B 161 10.527 -7.026 -3.038 1.00 15.84 H new ATOM 0 HD23 LEU B 161 11.952 -7.053 -1.972 1.00 15.84 H new ATOM 474 N LEU B 162 10.478 -2.910 -0.010 1.00 12.10 N ATOM 475 CA LEU B 162 10.360 -1.447 -0.267 1.00 13.70 C ATOM 476 C LEU B 162 11.692 -0.760 0.040 1.00 15.43 C ATOM 477 O LEU B 162 11.962 0.327 -0.430 1.00 15.50 O ATOM 478 CB LEU B 162 9.263 -0.863 0.625 1.00 13.91 C ATOM 479 CG LEU B 162 7.945 -1.589 0.351 1.00 12.97 C ATOM 480 CD1 LEU B 162 7.067 -1.547 1.603 1.00 9.03 C ATOM 481 CD2 LEU B 162 7.216 -0.901 -0.805 1.00 11.59 C ATOM 0 H LEU B 162 9.960 -3.252 0.799 1.00 12.10 H new ATOM 0 HA LEU B 162 10.105 -1.282 -1.314 1.00 13.70 H new ATOM 0 HB2 LEU B 162 9.538 -0.969 1.674 1.00 13.91 H new ATOM 0 HB3 LEU B 162 9.151 0.204 0.431 1.00 13.91 H new ATOM 0 HG LEU B 162 8.151 -2.626 0.087 1.00 12.97 H new ATOM 0 HD11 LEU B 162 6.128 -2.065 1.406 1.00 9.03 H new ATOM 0 HD12 LEU B 162 7.585 -2.036 2.428 1.00 9.03 H new ATOM 0 HD13 LEU B 162 6.861 -0.510 1.868 1.00 9.03 H new ATOM 0 HD21 LEU B 162 6.276 -1.417 -1.001 1.00 11.59 H new ATOM 0 HD22 LEU B 162 7.011 0.136 -0.540 1.00 11.59 H new ATOM 0 HD23 LEU B 162 7.840 -0.931 -1.698 1.00 11.59 H new ATOM 493 N LEU B 163 12.528 -1.384 0.826 1.00 17.97 N ATOM 494 CA LEU B 163 13.838 -0.763 1.160 1.00 23.68 C ATOM 495 C LEU B 163 14.910 -1.285 0.201 1.00 29.76 C ATOM 496 O LEU B 163 15.741 -2.095 0.563 1.00 34.43 O ATOM 497 CB LEU B 163 14.218 -1.125 2.597 1.00 20.30 C ATOM 498 CG LEU B 163 13.276 -0.417 3.572 1.00 19.42 C ATOM 499 CD1 LEU B 163 13.783 -0.609 5.003 1.00 19.86 C ATOM 500 CD2 LEU B 163 13.232 1.079 3.246 1.00 19.28 C ATOM 0 H LEU B 163 12.359 -2.296 1.250 1.00 17.97 H new ATOM 0 HA LEU B 163 13.764 0.320 1.064 1.00 23.68 H new ATOM 0 HB2 LEU B 163 14.159 -2.204 2.738 1.00 20.30 H new ATOM 0 HB3 LEU B 163 15.249 -0.833 2.795 1.00 20.30 H new ATOM 0 HG LEU B 163 12.276 -0.840 3.480 1.00 19.42 H new ATOM 0 HD11 LEU B 163 13.112 -0.104 5.698 1.00 19.86 H new ATOM 0 HD12 LEU B 163 13.815 -1.673 5.238 1.00 19.86 H new ATOM 0 HD13 LEU B 163 14.784 -0.187 5.094 1.00 19.86 H new ATOM 0 HD21 LEU B 163 12.561 1.583 3.941 1.00 19.28 H new ATOM 0 HD22 LEU B 163 14.233 1.501 3.338 1.00 19.28 H new ATOM 0 HD23 LEU B 163 12.871 1.219 2.227 1.00 19.28 H new ATOM 512 N ASN B 164 14.900 -0.827 -1.021 1.00 33.44 N ATOM 513 CA ASN B 164 15.919 -1.295 -2.003 1.00 37.75 C ATOM 514 C ASN B 164 16.607 -0.086 -2.638 1.00 40.49 C ATOM 515 O ASN B 164 15.962 0.840 -3.090 1.00 41.14 O ATOM 516 CB ASN B 164 15.236 -2.124 -3.093 1.00 39.08 C ATOM 517 CG ASN B 164 15.800 -3.546 -3.083 1.00 42.87 C ATOM 518 OD1 ASN B 164 16.183 -4.068 -4.111 1.00 47.61 O ATOM 519 ND2 ASN B 164 15.867 -4.200 -1.955 1.00 46.52 N ATOM 0 H ASN B 164 14.230 -0.148 -1.382 1.00 33.44 H new ATOM 0 HA ASN B 164 16.661 -1.909 -1.492 1.00 37.75 H new ATOM 0 HB2 ASN B 164 14.159 -2.148 -2.925 1.00 39.08 H new ATOM 0 HB3 ASN B 164 15.397 -1.665 -4.068 1.00 39.08 H new ATOM 0 HD21 ASN B 164 16.241 -5.149 -1.937 1.00 46.52 H new ATOM 0 HD22 ASN B 164 15.546 -3.762 -1.092 1.00 46.52 H new ATOM 526 N ALA B 165 17.911 -0.085 -2.678 1.00 41.13 N ATOM 527 CA ALA B 165 18.636 1.066 -3.285 1.00 40.91 C ATOM 528 C ALA B 165 18.001 1.416 -4.633 1.00 39.78 C ATOM 529 O ALA B 165 17.787 2.570 -4.948 1.00 42.37 O ATOM 530 CB ALA B 165 20.104 0.692 -3.494 1.00 43.50 C ATOM 0 H ALA B 165 18.505 -0.831 -2.317 1.00 41.13 H new ATOM 0 HA ALA B 165 18.572 1.927 -2.619 1.00 40.91 H new ATOM 0 HB1 ALA B 165 20.634 1.534 -3.938 1.00 43.50 H new ATOM 0 HB2 ALA B 165 20.556 0.444 -2.534 1.00 43.50 H new ATOM 0 HB3 ALA B 165 20.169 -0.169 -4.159 1.00 43.50 H new ATOM 536 N GLU B 166 17.698 0.429 -5.431 1.00 36.31 N ATOM 537 CA GLU B 166 17.077 0.705 -6.756 1.00 32.86 C ATOM 538 C GLU B 166 15.639 1.190 -6.555 1.00 28.56 C ATOM 539 O GLU B 166 15.146 2.020 -7.291 1.00 27.16 O ATOM 540 CB GLU B 166 17.071 -0.576 -7.592 1.00 35.96 C ATOM 541 CG GLU B 166 18.506 -1.073 -7.778 1.00 44.79 C ATOM 542 CD GLU B 166 18.702 -2.372 -6.995 1.00 50.54 C ATOM 543 OE1 GLU B 166 17.851 -3.240 -7.102 1.00 52.17 O ATOM 544 OE2 GLU B 166 19.701 -2.479 -6.303 1.00 54.06 O ATOM 0 H GLU B 166 17.854 -0.557 -5.222 1.00 36.31 H new ATOM 0 HA GLU B 166 17.650 1.474 -7.273 1.00 32.86 H new ATOM 0 HB2 GLU B 166 16.471 -1.341 -7.099 1.00 35.96 H new ATOM 0 HB3 GLU B 166 16.612 -0.387 -8.562 1.00 35.96 H new ATOM 0 HG2 GLU B 166 18.710 -1.239 -8.836 1.00 44.79 H new ATOM 0 HG3 GLU B 166 19.211 -0.318 -7.432 1.00 44.79 H new ATOM 551 N ASN B 167 14.965 0.677 -5.563 1.00 24.51 N ATOM 552 CA ASN B 167 13.561 1.106 -5.312 1.00 21.82 C ATOM 553 C ASN B 167 13.525 2.623 -5.067 1.00 19.62 C ATOM 554 O ASN B 167 14.016 3.088 -4.057 1.00 20.78 O ATOM 555 CB ASN B 167 13.023 0.383 -4.075 1.00 20.91 C ATOM 556 CG ASN B 167 12.148 -0.794 -4.511 1.00 21.84 C ATOM 557 OD1 ASN B 167 12.119 -1.145 -5.674 1.00 20.75 O ATOM 558 ND2 ASN B 167 11.429 -1.421 -3.621 1.00 24.01 N ATOM 0 H ASN B 167 15.327 -0.022 -4.914 1.00 24.51 H new ATOM 0 HA ASN B 167 12.946 0.861 -6.178 1.00 21.82 H new ATOM 0 HB2 ASN B 167 13.850 0.027 -3.461 1.00 20.91 H new ATOM 0 HB3 ASN B 167 12.444 1.073 -3.461 1.00 20.91 H new ATOM 0 HD21 ASN B 167 10.842 -2.207 -3.901 1.00 24.01 H new ATOM 0 HD22 ASN B 167 11.454 -1.126 -2.645 1.00 24.01 H new ATOM 565 N PRO B 168 12.947 3.355 -5.992 1.00 18.42 N ATOM 566 CA PRO B 168 12.841 4.821 -5.882 1.00 16.88 C ATOM 567 C PRO B 168 11.713 5.203 -4.921 1.00 16.36 C ATOM 568 O PRO B 168 10.935 4.371 -4.499 1.00 15.23 O ATOM 569 CB PRO B 168 12.518 5.267 -7.310 1.00 18.00 C ATOM 570 CG PRO B 168 11.903 4.040 -8.023 1.00 17.15 C ATOM 571 CD PRO B 168 12.347 2.800 -7.225 1.00 16.33 C ATOM 0 HA PRO B 168 13.744 5.289 -5.491 1.00 16.88 H new ATOM 0 HB2 PRO B 168 11.820 6.104 -7.307 1.00 18.00 H new ATOM 0 HB3 PRO B 168 13.418 5.604 -7.824 1.00 18.00 H new ATOM 0 HG2 PRO B 168 10.816 4.113 -8.052 1.00 17.15 H new ATOM 0 HG3 PRO B 168 12.246 3.980 -9.056 1.00 17.15 H new ATOM 0 HD2 PRO B 168 11.502 2.149 -6.998 1.00 16.33 H new ATOM 0 HD3 PRO B 168 13.068 2.204 -7.785 1.00 16.33 H new ATOM 579 N ARG B 169 11.617 6.457 -4.571 1.00 16.48 N ATOM 580 CA ARG B 169 10.539 6.889 -3.639 1.00 15.86 C ATOM 581 C ARG B 169 9.190 6.828 -4.357 1.00 13.88 C ATOM 582 O ARG B 169 8.912 7.609 -5.245 1.00 15.48 O ATOM 583 CB ARG B 169 10.809 8.325 -3.180 1.00 15.75 C ATOM 584 CG ARG B 169 9.733 8.751 -2.178 1.00 19.73 C ATOM 585 CD ARG B 169 8.874 9.859 -2.792 1.00 22.87 C ATOM 586 NE ARG B 169 9.749 10.980 -3.236 1.00 21.47 N ATOM 587 CZ ARG B 169 9.970 11.171 -4.508 1.00 20.61 C ATOM 588 NH1 ARG B 169 8.974 11.161 -5.351 1.00 23.69 N ATOM 589 NH2 ARG B 169 11.186 11.373 -4.936 1.00 22.31 N ATOM 0 H ARG B 169 12.239 7.200 -4.890 1.00 16.48 H new ATOM 0 HA ARG B 169 10.519 6.228 -2.773 1.00 15.86 H new ATOM 0 HB2 ARG B 169 11.795 8.392 -2.721 1.00 15.75 H new ATOM 0 HB3 ARG B 169 10.810 8.998 -4.037 1.00 15.75 H new ATOM 0 HG2 ARG B 169 9.109 7.897 -1.913 1.00 19.73 H new ATOM 0 HG3 ARG B 169 10.198 9.104 -1.257 1.00 19.73 H new ATOM 0 HD2 ARG B 169 8.309 9.468 -3.638 1.00 22.87 H new ATOM 0 HD3 ARG B 169 8.148 10.218 -2.062 1.00 22.87 H new ATOM 0 HE ARG B 169 10.175 11.598 -2.546 1.00 21.47 H new ATOM 0 HH11 ARG B 169 8.024 11.004 -5.016 1.00 23.69 H new ATOM 0 HH12 ARG B 169 9.146 11.310 -6.345 1.00 23.69 H new ATOM 0 HH21 ARG B 169 11.964 11.382 -4.276 1.00 22.31 H new ATOM 0 HH22 ARG B 169 11.359 11.522 -5.930 1.00 22.31 H new ATOM 603 N GLY B 170 8.348 5.904 -3.979 1.00 11.61 N ATOM 604 CA GLY B 170 7.017 5.795 -4.642 1.00 10.78 C ATOM 605 C GLY B 170 6.682 4.322 -4.890 1.00 11.90 C ATOM 606 O GLY B 170 5.570 3.981 -5.242 1.00 11.93 O ATOM 0 H GLY B 170 8.524 5.222 -3.242 1.00 11.61 H new ATOM 0 HA2 GLY B 170 6.250 6.252 -4.016 1.00 10.78 H new ATOM 0 HA3 GLY B 170 7.025 6.340 -5.586 1.00 10.78 H new ATOM 610 N THR B 171 7.632 3.444 -4.711 1.00 11.18 N ATOM 611 CA THR B 171 7.360 1.997 -4.939 1.00 10.98 C ATOM 612 C THR B 171 6.391 1.486 -3.870 1.00 10.39 C ATOM 613 O THR B 171 6.531 1.781 -2.700 1.00 11.11 O ATOM 614 CB THR B 171 8.671 1.211 -4.857 1.00 12.81 C ATOM 615 OG1 THR B 171 9.633 1.808 -5.716 1.00 15.73 O ATOM 616 CG2 THR B 171 8.429 -0.236 -5.288 1.00 10.54 C ATOM 0 H THR B 171 8.583 3.666 -4.417 1.00 11.18 H new ATOM 0 HA THR B 171 6.917 1.862 -5.926 1.00 10.98 H new ATOM 0 HB THR B 171 9.040 1.225 -3.831 1.00 12.81 H new ATOM 0 HG1 THR B 171 10.017 2.596 -5.279 1.00 15.73 H new ATOM 0 HG21 THR B 171 9.363 -0.794 -5.229 1.00 10.54 H new ATOM 0 HG22 THR B 171 7.691 -0.693 -4.629 1.00 10.54 H new ATOM 0 HG23 THR B 171 8.060 -0.253 -6.314 1.00 10.54 H new ATOM 624 N PHE B 172 5.409 0.722 -4.264 1.00 9.86 N ATOM 625 CA PHE B 172 4.431 0.193 -3.271 1.00 10.31 C ATOM 626 C PHE B 172 4.140 -1.277 -3.576 1.00 9.74 C ATOM 627 O PHE B 172 4.671 -1.843 -4.511 1.00 10.89 O ATOM 628 CB PHE B 172 3.134 1.000 -3.354 1.00 8.42 C ATOM 629 CG PHE B 172 2.500 0.797 -4.710 1.00 10.33 C ATOM 630 CD1 PHE B 172 1.712 -0.342 -4.953 1.00 10.22 C ATOM 631 CD2 PHE B 172 2.698 1.745 -5.728 1.00 9.32 C ATOM 632 CE1 PHE B 172 1.122 -0.530 -6.215 1.00 9.66 C ATOM 633 CE2 PHE B 172 2.109 1.555 -6.989 1.00 10.82 C ATOM 634 CZ PHE B 172 1.320 0.417 -7.232 1.00 11.64 C ATOM 0 H PHE B 172 5.242 0.441 -5.230 1.00 9.86 H new ATOM 0 HA PHE B 172 4.848 0.279 -2.268 1.00 10.31 H new ATOM 0 HB2 PHE B 172 2.447 0.685 -2.569 1.00 8.42 H new ATOM 0 HB3 PHE B 172 3.340 2.058 -3.192 1.00 8.42 H new ATOM 0 HD1 PHE B 172 1.560 -1.071 -4.171 1.00 10.22 H new ATOM 0 HD2 PHE B 172 3.303 2.620 -5.541 1.00 9.32 H new ATOM 0 HE1 PHE B 172 0.516 -1.404 -6.402 1.00 9.66 H new ATOM 0 HE2 PHE B 172 2.262 2.283 -7.772 1.00 10.82 H new ATOM 0 HZ PHE B 172 0.866 0.271 -8.201 1.00 11.64 H new ATOM 644 N LEU B 173 3.300 -1.900 -2.796 1.00 8.06 N ATOM 645 CA LEU B 173 2.978 -3.333 -3.043 1.00 6.70 C ATOM 646 C LEU B 173 1.773 -3.738 -2.191 1.00 8.22 C ATOM 647 O LEU B 173 1.665 -3.371 -1.038 1.00 8.04 O ATOM 648 CB LEU B 173 4.182 -4.199 -2.669 1.00 7.47 C ATOM 649 CG LEU B 173 4.574 -3.929 -1.216 1.00 8.31 C ATOM 650 CD1 LEU B 173 3.728 -4.802 -0.289 1.00 7.11 C ATOM 651 CD2 LEU B 173 6.054 -4.260 -1.017 1.00 7.67 C ATOM 0 H LEU B 173 2.823 -1.479 -1.999 1.00 8.06 H new ATOM 0 HA LEU B 173 2.742 -3.476 -4.098 1.00 6.70 H new ATOM 0 HB2 LEU B 173 3.940 -5.253 -2.801 1.00 7.47 H new ATOM 0 HB3 LEU B 173 5.021 -3.979 -3.330 1.00 7.47 H new ATOM 0 HG LEU B 173 4.402 -2.878 -0.983 1.00 8.31 H new ATOM 0 HD11 LEU B 173 4.007 -4.610 0.747 1.00 7.11 H new ATOM 0 HD12 LEU B 173 2.673 -4.567 -0.430 1.00 7.11 H new ATOM 0 HD13 LEU B 173 3.900 -5.853 -0.522 1.00 7.11 H new ATOM 0 HD21 LEU B 173 6.334 -4.068 0.019 1.00 7.67 H new ATOM 0 HD22 LEU B 173 6.226 -5.311 -1.250 1.00 7.67 H new ATOM 0 HD23 LEU B 173 6.658 -3.638 -1.678 1.00 7.67 H new ATOM 663 N VAL B 174 0.866 -4.492 -2.749 1.00 9.95 N ATOM 664 CA VAL B 174 -0.329 -4.921 -1.969 1.00 10.61 C ATOM 665 C VAL B 174 -0.158 -6.377 -1.533 1.00 10.97 C ATOM 666 O VAL B 174 0.121 -7.246 -2.336 1.00 13.68 O ATOM 667 CB VAL B 174 -1.580 -4.793 -2.840 1.00 8.85 C ATOM 668 CG1 VAL B 174 -2.829 -4.883 -1.960 1.00 7.48 C ATOM 669 CG2 VAL B 174 -1.562 -3.444 -3.563 1.00 7.46 C ATOM 0 H VAL B 174 0.901 -4.829 -3.711 1.00 9.95 H new ATOM 0 HA VAL B 174 -0.434 -4.288 -1.088 1.00 10.61 H new ATOM 0 HB VAL B 174 -1.595 -5.599 -3.573 1.00 8.85 H new ATOM 0 HG11 VAL B 174 -3.720 -4.792 -2.582 1.00 7.48 H new ATOM 0 HG12 VAL B 174 -2.843 -5.844 -1.445 1.00 7.48 H new ATOM 0 HG13 VAL B 174 -2.815 -4.078 -1.225 1.00 7.48 H new ATOM 0 HG21 VAL B 174 -2.453 -3.352 -4.184 1.00 7.46 H new ATOM 0 HG22 VAL B 174 -1.546 -2.638 -2.829 1.00 7.46 H new ATOM 0 HG23 VAL B 174 -0.674 -3.380 -4.191 1.00 7.46 H new ATOM 679 N ARG B 175 -0.321 -6.652 -0.268 1.00 12.04 N ATOM 680 CA ARG B 175 -0.167 -8.053 0.215 1.00 13.07 C ATOM 681 C ARG B 175 -1.345 -8.414 1.123 1.00 15.49 C ATOM 682 O ARG B 175 -2.040 -7.554 1.627 1.00 11.34 O ATOM 683 CB ARG B 175 1.139 -8.180 1.001 1.00 10.24 C ATOM 684 CG ARG B 175 1.305 -6.963 1.914 1.00 10.97 C ATOM 685 CD ARG B 175 2.725 -6.943 2.485 1.00 8.81 C ATOM 686 NE ARG B 175 2.676 -7.247 3.943 1.00 7.82 N ATOM 687 CZ ARG B 175 2.431 -6.294 4.801 1.00 8.03 C ATOM 688 NH1 ARG B 175 1.771 -5.233 4.426 1.00 7.60 N ATOM 689 NH2 ARG B 175 2.848 -6.403 6.033 1.00 11.06 N ATOM 0 H ARG B 175 -0.554 -5.968 0.451 1.00 12.04 H new ATOM 0 HA ARG B 175 -0.146 -8.731 -0.639 1.00 13.07 H new ATOM 0 HB2 ARG B 175 1.132 -9.095 1.594 1.00 10.24 H new ATOM 0 HB3 ARG B 175 1.983 -8.251 0.315 1.00 10.24 H new ATOM 0 HG2 ARG B 175 1.113 -6.047 1.355 1.00 10.97 H new ATOM 0 HG3 ARG B 175 0.576 -7.001 2.724 1.00 10.97 H new ATOM 0 HD2 ARG B 175 3.346 -7.676 1.970 1.00 8.81 H new ATOM 0 HD3 ARG B 175 3.181 -5.967 2.321 1.00 8.81 H new ATOM 0 HE ARG B 175 2.834 -8.200 4.271 1.00 7.82 H new ATOM 0 HH11 ARG B 175 1.447 -5.148 3.463 1.00 7.60 H new ATOM 0 HH12 ARG B 175 1.579 -4.488 5.096 1.00 7.60 H new ATOM 0 HH21 ARG B 175 3.365 -7.232 6.325 1.00 11.06 H new ATOM 0 HH22 ARG B 175 2.657 -5.659 6.704 1.00 11.06 H new ATOM 703 N GLU B 176 -1.575 -9.680 1.336 1.00 20.91 N ATOM 704 CA GLU B 176 -2.707 -10.096 2.210 1.00 26.31 C ATOM 705 C GLU B 176 -2.432 -9.644 3.646 1.00 29.76 C ATOM 706 O GLU B 176 -1.300 -9.587 4.084 1.00 30.61 O ATOM 707 CB GLU B 176 -2.849 -11.619 2.173 1.00 25.39 C ATOM 708 CG GLU B 176 -4.186 -11.992 1.529 1.00 29.84 C ATOM 709 CD GLU B 176 -4.466 -13.478 1.757 1.00 32.50 C ATOM 710 OE1 GLU B 176 -5.018 -13.805 2.794 1.00 36.79 O ATOM 711 OE2 GLU B 176 -4.124 -14.264 0.889 1.00 34.32 O ATOM 0 H GLU B 176 -1.027 -10.445 0.942 1.00 20.91 H new ATOM 0 HA GLU B 176 -3.629 -9.638 1.853 1.00 26.31 H new ATOM 0 HB2 GLU B 176 -2.026 -12.058 1.608 1.00 25.39 H new ATOM 0 HB3 GLU B 176 -2.794 -12.025 3.183 1.00 25.39 H new ATOM 0 HG2 GLU B 176 -4.988 -11.390 1.957 1.00 29.84 H new ATOM 0 HG3 GLU B 176 -4.160 -11.776 0.461 1.00 29.84 H new ATOM 718 N SER B 177 -3.459 -9.321 4.382 1.00 36.14 N ATOM 719 CA SER B 177 -3.258 -8.872 5.789 1.00 41.98 C ATOM 720 C SER B 177 -2.882 -10.074 6.658 1.00 43.00 C ATOM 721 O SER B 177 -3.615 -11.038 6.753 1.00 43.66 O ATOM 722 CB SER B 177 -4.549 -8.245 6.314 1.00 45.78 C ATOM 723 OG SER B 177 -5.529 -9.262 6.481 1.00 51.84 O ATOM 0 H SER B 177 -4.430 -9.348 4.070 1.00 36.14 H new ATOM 0 HA SER B 177 -2.457 -8.134 5.824 1.00 41.98 H new ATOM 0 HB2 SER B 177 -4.363 -7.743 7.263 1.00 45.78 H new ATOM 0 HB3 SER B 177 -4.909 -7.488 5.618 1.00 45.78 H new ATOM 0 HG SER B 177 -5.966 -9.439 5.622 1.00 51.84 H new ATOM 729 N GLU B 178 -1.743 -10.024 7.294 1.00 23.97 N ATOM 730 CA GLU B 178 -1.321 -11.163 8.156 1.00 25.52 C ATOM 731 C GLU B 178 -1.860 -10.958 9.573 1.00 30.02 C ATOM 732 O GLU B 178 -2.362 -11.873 10.196 1.00 31.55 O ATOM 733 CB GLU B 178 0.208 -11.231 8.199 1.00 23.29 C ATOM 734 CG GLU B 178 0.722 -11.980 6.967 1.00 29.79 C ATOM 735 CD GLU B 178 0.572 -13.487 7.187 1.00 33.17 C ATOM 736 OE1 GLU B 178 -0.494 -13.900 7.612 1.00 39.84 O ATOM 737 OE2 GLU B 178 1.525 -14.201 6.926 1.00 21.15 O ATOM 0 H GLU B 178 -1.087 -9.244 7.253 1.00 23.97 H new ATOM 0 HA GLU B 178 -1.716 -12.093 7.747 1.00 25.52 H new ATOM 0 HB2 GLU B 178 0.626 -10.225 8.227 1.00 23.29 H new ATOM 0 HB3 GLU B 178 0.534 -11.737 9.108 1.00 23.29 H new ATOM 0 HG2 GLU B 178 0.164 -11.673 6.083 1.00 29.79 H new ATOM 0 HG3 GLU B 178 1.768 -11.730 6.786 1.00 29.79 H new ATOM 744 N THR B 179 -1.758 -9.763 10.090 1.00 26.98 N ATOM 745 CA THR B 179 -2.260 -9.499 11.465 1.00 31.67 C ATOM 746 C THR B 179 -3.751 -9.158 11.412 1.00 34.54 C ATOM 747 O THR B 179 -4.449 -9.232 12.403 1.00 34.85 O ATOM 748 CB THR B 179 -1.489 -8.323 12.064 1.00 26.17 C ATOM 749 OG1 THR B 179 -1.987 -7.107 11.523 1.00 28.58 O ATOM 750 CG2 THR B 179 -0.003 -8.461 11.733 1.00 35.55 C ATOM 0 H THR B 179 -1.348 -8.958 9.617 1.00 26.98 H new ATOM 0 HA THR B 179 -2.116 -10.386 12.082 1.00 31.67 H new ATOM 0 HB THR B 179 -1.617 -8.319 13.146 1.00 26.17 H new ATOM 0 HG1 THR B 179 -1.883 -6.389 12.182 1.00 28.58 H new ATOM 0 HG21 THR B 179 0.545 -7.621 12.161 1.00 35.55 H new ATOM 0 HG22 THR B 179 0.378 -9.393 12.150 1.00 35.55 H new ATOM 0 HG23 THR B 179 0.130 -8.467 10.651 1.00 35.55 H new ATOM 758 N THR B 180 -4.246 -8.783 10.264 1.00 27.03 N ATOM 759 CA THR B 180 -5.691 -8.437 10.154 1.00 25.08 C ATOM 760 C THR B 180 -6.489 -9.690 9.789 1.00 30.09 C ATOM 761 O THR B 180 -5.988 -10.795 9.846 1.00 30.04 O ATOM 762 CB THR B 180 -5.880 -7.374 9.069 1.00 29.37 C ATOM 763 OG1 THR B 180 -4.713 -6.569 8.989 1.00 38.10 O ATOM 764 CG2 THR B 180 -7.084 -6.497 9.417 1.00 40.88 C ATOM 0 H THR B 180 -3.713 -8.701 9.398 1.00 27.03 H new ATOM 0 HA THR B 180 -6.046 -8.047 11.108 1.00 25.08 H new ATOM 0 HB THR B 180 -6.053 -7.860 8.109 1.00 29.37 H new ATOM 0 HG1 THR B 180 -4.779 -5.974 8.213 1.00 38.10 H new ATOM 0 HG21 THR B 180 -7.218 -5.740 8.644 1.00 40.88 H new ATOM 0 HG22 THR B 180 -7.979 -7.116 9.478 1.00 40.88 H new ATOM 0 HG23 THR B 180 -6.914 -6.009 10.377 1.00 40.88 H new ATOM 772 N LYS B 181 -7.729 -9.528 9.413 1.00 32.42 N ATOM 773 CA LYS B 181 -8.556 -10.712 9.046 1.00 38.97 C ATOM 774 C LYS B 181 -9.380 -10.392 7.796 1.00 35.28 C ATOM 775 O LYS B 181 -10.092 -9.409 7.745 1.00 34.92 O ATOM 776 CB LYS B 181 -9.497 -11.054 10.203 1.00 51.02 C ATOM 777 CG LYS B 181 -10.194 -9.781 10.687 1.00 72.35 C ATOM 778 CD LYS B 181 -11.001 -10.087 11.950 1.00 84.05 C ATOM 779 CE LYS B 181 -11.532 -8.782 12.545 1.00 88.20 C ATOM 780 NZ LYS B 181 -12.595 -8.228 11.660 1.00 87.98 N ATOM 0 H LYS B 181 -8.204 -8.628 9.344 1.00 32.42 H new ATOM 0 HA LYS B 181 -7.904 -11.562 8.843 1.00 38.97 H new ATOM 0 HB2 LYS B 181 -10.237 -11.786 9.880 1.00 51.02 H new ATOM 0 HB3 LYS B 181 -8.936 -11.507 11.020 1.00 51.02 H new ATOM 0 HG2 LYS B 181 -9.456 -9.006 10.894 1.00 72.35 H new ATOM 0 HG3 LYS B 181 -10.851 -9.395 9.908 1.00 72.35 H new ATOM 0 HD2 LYS B 181 -11.829 -10.754 11.712 1.00 84.05 H new ATOM 0 HD3 LYS B 181 -10.375 -10.603 12.678 1.00 84.05 H new ATOM 0 HE2 LYS B 181 -11.932 -8.961 13.543 1.00 88.20 H new ATOM 0 HE3 LYS B 181 -10.721 -8.062 12.651 1.00 88.20 H new ATOM 0 HZ1 LYS B 181 -13.049 -7.418 12.128 1.00 87.98 H new ATOM 0 HZ2 LYS B 181 -12.172 -7.917 10.762 1.00 87.98 H new ATOM 0 HZ3 LYS B 181 -13.307 -8.962 11.471 1.00 87.98 H new ATOM 794 N GLY B 182 -9.291 -11.217 6.788 1.00 38.03 N ATOM 795 CA GLY B 182 -10.070 -10.962 5.544 1.00 30.70 C ATOM 796 C GLY B 182 -9.856 -9.516 5.091 1.00 29.58 C ATOM 797 O GLY B 182 -10.766 -8.862 4.622 1.00 31.67 O ATOM 0 H GLY B 182 -8.712 -12.057 6.773 1.00 38.03 H new ATOM 0 HA2 GLY B 182 -9.756 -11.650 4.759 1.00 30.70 H new ATOM 0 HA3 GLY B 182 -11.130 -11.145 5.723 1.00 30.70 H new ATOM 801 N ALA B 183 -8.659 -9.013 5.225 1.00 35.86 N ATOM 802 CA ALA B 183 -8.390 -7.610 4.801 1.00 32.70 C ATOM 803 C ALA B 183 -7.054 -7.550 4.058 1.00 28.65 C ATOM 804 O ALA B 183 -6.310 -8.510 4.021 1.00 29.39 O ATOM 805 CB ALA B 183 -8.329 -6.706 6.034 1.00 31.44 C ATOM 0 H ALA B 183 -7.857 -9.512 5.609 1.00 35.86 H new ATOM 0 HA ALA B 183 -9.189 -7.270 4.142 1.00 32.70 H new ATOM 0 HB1 ALA B 183 -8.132 -5.680 5.723 1.00 31.44 H new ATOM 0 HB2 ALA B 183 -9.281 -6.749 6.564 1.00 31.44 H new ATOM 0 HB3 ALA B 183 -7.531 -7.045 6.694 1.00 31.44 H new ATOM 811 N TYR B 184 -6.743 -6.430 3.466 1.00 24.43 N ATOM 812 CA TYR B 184 -5.453 -6.312 2.727 1.00 19.69 C ATOM 813 C TYR B 184 -4.635 -5.159 3.312 1.00 15.67 C ATOM 814 O TYR B 184 -5.146 -4.326 4.033 1.00 11.54 O ATOM 815 CB TYR B 184 -5.735 -6.040 1.248 1.00 20.89 C ATOM 816 CG TYR B 184 -6.459 -7.222 0.649 1.00 21.46 C ATOM 817 CD1 TYR B 184 -7.754 -7.547 1.086 1.00 21.81 C ATOM 818 CD2 TYR B 184 -5.837 -7.996 -0.345 1.00 23.38 C ATOM 819 CE1 TYR B 184 -8.427 -8.647 0.529 1.00 21.77 C ATOM 820 CE2 TYR B 184 -6.511 -9.097 -0.901 1.00 24.77 C ATOM 821 CZ TYR B 184 -7.806 -9.422 -0.465 1.00 25.72 C ATOM 822 OH TYR B 184 -8.467 -10.502 -1.012 1.00 27.17 O ATOM 0 H TYR B 184 -7.325 -5.592 3.462 1.00 24.43 H new ATOM 0 HA TYR B 184 -4.892 -7.241 2.824 1.00 19.69 H new ATOM 0 HB2 TYR B 184 -6.338 -5.138 1.141 1.00 20.89 H new ATOM 0 HB3 TYR B 184 -4.801 -5.864 0.715 1.00 20.89 H new ATOM 0 HD1 TYR B 184 -8.232 -6.951 1.850 1.00 21.81 H new ATOM 0 HD2 TYR B 184 -4.842 -7.745 -0.682 1.00 23.38 H new ATOM 0 HE1 TYR B 184 -9.422 -8.897 0.865 1.00 21.77 H new ATOM 0 HE2 TYR B 184 -6.033 -9.693 -1.664 1.00 24.77 H new ATOM 0 HH TYR B 184 -7.897 -10.928 -1.686 1.00 27.17 H new ATOM 832 N CYS B 185 -3.367 -5.105 3.008 1.00 12.49 N ATOM 833 CA CYS B 185 -2.519 -4.006 3.548 1.00 13.07 C ATOM 834 C CYS B 185 -1.641 -3.441 2.430 1.00 11.90 C ATOM 835 O CYS B 185 -0.907 -4.159 1.782 1.00 11.52 O ATOM 836 CB CYS B 185 -1.630 -4.551 4.667 1.00 13.05 C ATOM 837 SG CYS B 185 -2.634 -4.861 6.141 1.00 27.90 S ATOM 0 H CYS B 185 -2.882 -5.774 2.410 1.00 12.49 H new ATOM 0 HA CYS B 185 -3.158 -3.216 3.942 1.00 13.07 H new ATOM 0 HB2 CYS B 185 -1.145 -5.472 4.344 1.00 13.05 H new ATOM 0 HB3 CYS B 185 -0.838 -3.838 4.897 1.00 13.05 H new ATOM 0 HG CYS B 185 -1.907 -4.690 7.205 1.00 27.90 H new ATOM 843 N LEU B 186 -1.712 -2.158 2.200 1.00 10.41 N ATOM 844 CA LEU B 186 -0.880 -1.549 1.124 1.00 10.82 C ATOM 845 C LEU B 186 0.430 -1.037 1.725 1.00 10.91 C ATOM 846 O LEU B 186 0.487 -0.645 2.872 1.00 11.30 O ATOM 847 CB LEU B 186 -1.642 -0.382 0.493 1.00 8.57 C ATOM 848 CG LEU B 186 -0.757 0.307 -0.547 1.00 8.23 C ATOM 849 CD1 LEU B 186 -0.675 -0.559 -1.804 1.00 10.17 C ATOM 850 CD2 LEU B 186 -1.360 1.668 -0.904 1.00 8.76 C ATOM 0 H LEU B 186 -2.309 -1.507 2.710 1.00 10.41 H new ATOM 0 HA LEU B 186 -0.663 -2.297 0.361 1.00 10.82 H new ATOM 0 HB2 LEU B 186 -2.557 -0.743 0.024 1.00 8.57 H new ATOM 0 HB3 LEU B 186 -1.938 0.331 1.263 1.00 8.57 H new ATOM 0 HG LEU B 186 0.244 0.446 -0.138 1.00 8.23 H new ATOM 0 HD11 LEU B 186 -0.044 -0.067 -2.544 1.00 10.17 H new ATOM 0 HD12 LEU B 186 -0.248 -1.529 -1.550 1.00 10.17 H new ATOM 0 HD13 LEU B 186 -1.675 -0.699 -2.215 1.00 10.17 H new ATOM 0 HD21 LEU B 186 -0.731 2.161 -1.645 1.00 8.76 H new ATOM 0 HD22 LEU B 186 -2.360 1.527 -1.313 1.00 8.76 H new ATOM 0 HD23 LEU B 186 -1.418 2.286 -0.008 1.00 8.76 H new ATOM 862 N SER B 187 1.486 -1.040 0.959 1.00 10.50 N ATOM 863 CA SER B 187 2.792 -0.554 1.488 1.00 9.18 C ATOM 864 C SER B 187 3.433 0.390 0.469 1.00 8.50 C ATOM 865 O SER B 187 3.368 0.168 -0.723 1.00 9.53 O ATOM 866 CB SER B 187 3.716 -1.746 1.736 1.00 7.49 C ATOM 867 OG SER B 187 2.933 -2.885 2.069 1.00 5.18 O ATOM 0 H SER B 187 1.501 -1.358 -0.010 1.00 10.50 H new ATOM 0 HA SER B 187 2.631 -0.021 2.425 1.00 9.18 H new ATOM 0 HB2 SER B 187 4.314 -1.948 0.847 1.00 7.49 H new ATOM 0 HB3 SER B 187 4.412 -1.520 2.544 1.00 7.49 H new ATOM 0 HG SER B 187 3.446 -3.472 2.663 1.00 5.18 H new ATOM 873 N VAL B 188 4.050 1.444 0.927 1.00 11.78 N ATOM 874 CA VAL B 188 4.691 2.398 -0.021 1.00 12.79 C ATOM 875 C VAL B 188 6.047 2.839 0.533 1.00 14.65 C ATOM 876 O VAL B 188 6.310 2.733 1.715 1.00 14.43 O ATOM 877 CB VAL B 188 3.790 3.622 -0.197 1.00 12.22 C ATOM 878 CG1 VAL B 188 4.158 4.348 -1.491 1.00 11.34 C ATOM 879 CG2 VAL B 188 2.328 3.169 -0.265 1.00 12.23 C ATOM 0 H VAL B 188 4.138 1.686 1.914 1.00 11.78 H new ATOM 0 HA VAL B 188 4.836 1.909 -0.985 1.00 12.79 H new ATOM 0 HB VAL B 188 3.926 4.298 0.647 1.00 12.22 H new ATOM 0 HG11 VAL B 188 3.515 5.220 -1.615 1.00 11.34 H new ATOM 0 HG12 VAL B 188 5.199 4.668 -1.445 1.00 11.34 H new ATOM 0 HG13 VAL B 188 4.023 3.674 -2.337 1.00 11.34 H new ATOM 0 HG21 VAL B 188 1.683 4.039 -0.390 1.00 12.23 H new ATOM 0 HG22 VAL B 188 2.195 2.494 -1.110 1.00 12.23 H new ATOM 0 HG23 VAL B 188 2.064 2.652 0.657 1.00 12.23 H new ATOM 889 N SER B 189 6.910 3.334 -0.311 1.00 14.39 N ATOM 890 CA SER B 189 8.248 3.782 0.165 1.00 13.97 C ATOM 891 C SER B 189 8.310 5.311 0.149 1.00 14.32 C ATOM 892 O SER B 189 7.589 5.963 -0.580 1.00 13.16 O ATOM 893 CB SER B 189 9.333 3.218 -0.754 1.00 12.52 C ATOM 894 OG SER B 189 9.022 3.544 -2.102 1.00 13.11 O ATOM 0 H SER B 189 6.745 3.447 -1.311 1.00 14.39 H new ATOM 0 HA SER B 189 8.410 3.422 1.181 1.00 13.97 H new ATOM 0 HB2 SER B 189 10.305 3.630 -0.483 1.00 12.52 H new ATOM 0 HB3 SER B 189 9.400 2.137 -0.635 1.00 12.52 H new ATOM 0 HG SER B 189 9.847 3.757 -2.586 1.00 13.11 H new ATOM 900 N ASP B 190 9.166 5.888 0.947 1.00 17.22 N ATOM 901 CA ASP B 190 9.272 7.373 0.976 1.00 20.71 C ATOM 902 C ASP B 190 10.669 7.775 1.452 1.00 19.82 C ATOM 903 O ASP B 190 11.402 6.977 2.002 1.00 20.14 O ATOM 904 CB ASP B 190 8.224 7.939 1.936 1.00 25.05 C ATOM 905 CG ASP B 190 7.942 9.401 1.580 1.00 26.93 C ATOM 906 OD1 ASP B 190 7.875 9.700 0.399 1.00 30.74 O ATOM 907 OD2 ASP B 190 7.798 10.195 2.495 1.00 31.13 O ATOM 0 H ASP B 190 9.796 5.395 1.580 1.00 17.22 H new ATOM 0 HA ASP B 190 9.101 7.770 -0.025 1.00 20.71 H new ATOM 0 HB2 ASP B 190 7.306 7.355 1.874 1.00 25.05 H new ATOM 0 HB3 ASP B 190 8.580 7.866 2.964 1.00 25.05 H new ATOM 912 N PHE B 191 11.044 9.008 1.244 1.00 21.67 N ATOM 913 CA PHE B 191 12.395 9.460 1.684 1.00 24.27 C ATOM 914 C PHE B 191 12.250 10.674 2.603 1.00 28.02 C ATOM 915 O PHE B 191 11.480 11.577 2.339 1.00 25.66 O ATOM 916 CB PHE B 191 13.228 9.844 0.460 1.00 23.13 C ATOM 917 CG PHE B 191 14.549 10.420 0.911 1.00 21.13 C ATOM 918 CD1 PHE B 191 15.585 9.565 1.320 1.00 20.50 C ATOM 919 CD2 PHE B 191 14.740 11.813 0.922 1.00 18.20 C ATOM 920 CE1 PHE B 191 16.814 10.102 1.740 1.00 19.46 C ATOM 921 CE2 PHE B 191 15.970 12.349 1.342 1.00 16.51 C ATOM 922 CZ PHE B 191 17.006 11.494 1.751 1.00 17.79 C ATOM 0 H PHE B 191 10.474 9.721 0.789 1.00 21.67 H new ATOM 0 HA PHE B 191 12.892 8.653 2.222 1.00 24.27 H new ATOM 0 HB2 PHE B 191 13.396 8.969 -0.168 1.00 23.13 H new ATOM 0 HB3 PHE B 191 12.689 10.573 -0.146 1.00 23.13 H new ATOM 0 HD1 PHE B 191 15.437 8.495 1.312 1.00 20.50 H new ATOM 0 HD2 PHE B 191 13.943 12.470 0.608 1.00 18.20 H new ATOM 0 HE1 PHE B 191 17.611 9.445 2.054 1.00 19.46 H new ATOM 0 HE2 PHE B 191 16.118 13.419 1.350 1.00 16.51 H new ATOM 0 HZ PHE B 191 17.950 11.906 2.074 1.00 17.79 H new ATOM 932 N ASP B 192 12.982 10.705 3.682 1.00 32.66 N ATOM 933 CA ASP B 192 12.885 11.862 4.617 1.00 38.82 C ATOM 934 C ASP B 192 14.272 12.476 4.815 1.00 41.14 C ATOM 935 O ASP B 192 15.277 11.797 4.749 1.00 38.49 O ATOM 936 CB ASP B 192 12.341 11.384 5.965 1.00 42.78 C ATOM 937 CG ASP B 192 13.370 10.477 6.640 1.00 45.03 C ATOM 938 OD1 ASP B 192 14.270 10.021 5.953 1.00 46.40 O ATOM 939 OD2 ASP B 192 13.244 10.253 7.833 1.00 49.15 O ATOM 0 H ASP B 192 13.644 9.979 3.957 1.00 32.66 H new ATOM 0 HA ASP B 192 12.213 12.611 4.199 1.00 38.82 H new ATOM 0 HB2 ASP B 192 12.121 12.239 6.604 1.00 42.78 H new ATOM 0 HB3 ASP B 192 11.405 10.845 5.820 1.00 42.78 H new ATOM 944 N ASN B 193 14.334 13.757 5.056 1.00 45.91 N ATOM 945 CA ASN B 193 15.655 14.412 5.258 1.00 50.53 C ATOM 946 C ASN B 193 16.020 14.384 6.744 1.00 51.37 C ATOM 947 O ASN B 193 16.613 15.308 7.265 1.00 52.38 O ATOM 948 CB ASN B 193 15.582 15.865 4.779 1.00 54.84 C ATOM 949 CG ASN B 193 15.336 15.893 3.270 1.00 60.46 C ATOM 950 OD1 ASN B 193 14.592 15.087 2.748 1.00 63.78 O ATOM 951 ND2 ASN B 193 15.935 16.795 2.540 1.00 62.09 N ATOM 0 H ASN B 193 13.527 14.377 5.122 1.00 45.91 H new ATOM 0 HA ASN B 193 16.415 13.877 4.688 1.00 50.53 H new ATOM 0 HB2 ASN B 193 14.781 16.391 5.299 1.00 54.84 H new ATOM 0 HB3 ASN B 193 16.510 16.384 5.017 1.00 54.84 H new ATOM 0 HD21 ASN B 193 15.778 16.822 1.533 1.00 62.09 H new ATOM 0 HD22 ASN B 193 16.560 17.472 2.977 1.00 62.09 H new ATOM 958 N ALA B 194 15.669 13.333 7.431 1.00 51.03 N ATOM 959 CA ALA B 194 15.995 13.248 8.882 1.00 49.87 C ATOM 960 C ALA B 194 16.938 12.068 9.125 1.00 48.78 C ATOM 961 O ALA B 194 17.891 12.166 9.874 1.00 50.16 O ATOM 962 CB ALA B 194 14.708 13.043 9.683 1.00 50.70 C ATOM 0 H ALA B 194 15.170 12.529 7.050 1.00 51.03 H new ATOM 0 HA ALA B 194 16.478 14.172 9.200 1.00 49.87 H new ATOM 0 HB1 ALA B 194 14.946 12.981 10.745 1.00 50.70 H new ATOM 0 HB2 ALA B 194 14.035 13.883 9.511 1.00 50.70 H new ATOM 0 HB3 ALA B 194 14.225 12.119 9.365 1.00 50.70 H new ATOM 968 N LYS B 195 16.682 10.953 8.498 1.00 45.35 N ATOM 969 CA LYS B 195 17.563 9.769 8.694 1.00 41.76 C ATOM 970 C LYS B 195 17.935 9.179 7.331 1.00 38.59 C ATOM 971 O LYS B 195 19.095 9.078 6.985 1.00 39.85 O ATOM 972 CB LYS B 195 16.824 8.715 9.521 1.00 42.95 C ATOM 973 CG LYS B 195 17.080 8.961 11.009 1.00 45.27 C ATOM 974 CD LYS B 195 17.273 7.622 11.722 1.00 47.56 C ATOM 975 CE LYS B 195 15.936 7.154 12.299 1.00 50.16 C ATOM 976 NZ LYS B 195 15.942 7.337 13.777 1.00 50.69 N ATOM 0 H LYS B 195 15.900 10.811 7.858 1.00 45.35 H new ATOM 0 HA LYS B 195 18.469 10.073 9.218 1.00 41.76 H new ATOM 0 HB2 LYS B 195 15.755 8.759 9.313 1.00 42.95 H new ATOM 0 HB3 LYS B 195 17.162 7.717 9.243 1.00 42.95 H new ATOM 0 HG2 LYS B 195 17.965 9.585 11.138 1.00 45.27 H new ATOM 0 HG3 LYS B 195 16.242 9.502 11.449 1.00 45.27 H new ATOM 0 HD2 LYS B 195 17.660 6.879 11.025 1.00 47.56 H new ATOM 0 HD3 LYS B 195 18.009 7.725 12.519 1.00 47.56 H new ATOM 0 HE2 LYS B 195 15.118 7.721 11.855 1.00 50.16 H new ATOM 0 HE3 LYS B 195 15.768 6.106 12.052 1.00 50.16 H new ATOM 0 HZ1 LYS B 195 15.033 7.019 14.170 1.00 50.69 H new ATOM 0 HZ2 LYS B 195 16.714 6.778 14.193 1.00 50.69 H new ATOM 0 HZ3 LYS B 195 16.083 8.343 14.002 1.00 50.69 H new ATOM 990 N GLY B 196 16.960 8.790 6.555 1.00 34.40 N ATOM 991 CA GLY B 196 17.260 8.209 5.217 1.00 29.38 C ATOM 992 C GLY B 196 15.989 7.601 4.622 1.00 25.82 C ATOM 993 O GLY B 196 14.956 8.237 4.560 1.00 25.14 O ATOM 0 H GLY B 196 15.969 8.850 6.790 1.00 34.40 H new ATOM 0 HA2 GLY B 196 17.650 8.981 4.554 1.00 29.38 H new ATOM 0 HA3 GLY B 196 18.033 7.445 5.306 1.00 29.38 H new ATOM 997 N LEU B 197 16.057 6.375 4.182 1.00 25.09 N ATOM 998 CA LEU B 197 14.853 5.729 3.589 1.00 24.92 C ATOM 999 C LEU B 197 13.854 5.387 4.697 1.00 23.75 C ATOM 1000 O LEU B 197 14.228 5.097 5.816 1.00 23.93 O ATOM 1001 CB LEU B 197 15.268 4.446 2.866 1.00 25.84 C ATOM 1002 CG LEU B 197 15.053 4.615 1.362 1.00 30.07 C ATOM 1003 CD1 LEU B 197 15.427 3.317 0.643 1.00 29.71 C ATOM 1004 CD2 LEU B 197 13.582 4.940 1.092 1.00 30.59 C ATOM 0 H LEU B 197 16.894 5.793 4.208 1.00 25.09 H new ATOM 0 HA LEU B 197 14.387 6.414 2.881 1.00 24.92 H new ATOM 0 HB2 LEU B 197 16.315 4.223 3.071 1.00 25.84 H new ATOM 0 HB3 LEU B 197 14.684 3.603 3.235 1.00 25.84 H new ATOM 0 HG LEU B 197 15.680 5.427 0.995 1.00 30.07 H new ATOM 0 HD11 LEU B 197 15.274 3.438 -0.429 1.00 29.71 H new ATOM 0 HD12 LEU B 197 16.474 3.083 0.836 1.00 29.71 H new ATOM 0 HD13 LEU B 197 14.800 2.504 1.010 1.00 29.71 H new ATOM 0 HD21 LEU B 197 13.427 5.061 0.020 1.00 30.59 H new ATOM 0 HD22 LEU B 197 12.956 4.127 1.460 1.00 30.59 H new ATOM 0 HD23 LEU B 197 13.314 5.864 1.604 1.00 30.59 H new ATOM 1016 N ASN B 198 12.586 5.420 4.393 1.00 21.78 N ATOM 1017 CA ASN B 198 11.561 5.096 5.425 1.00 19.17 C ATOM 1018 C ASN B 198 10.391 4.366 4.763 1.00 16.90 C ATOM 1019 O ASN B 198 9.915 4.759 3.717 1.00 15.60 O ATOM 1020 CB ASN B 198 11.059 6.389 6.071 1.00 18.45 C ATOM 1021 CG ASN B 198 10.314 7.224 5.029 1.00 20.04 C ATOM 1022 OD1 ASN B 198 9.124 7.064 4.845 1.00 23.65 O ATOM 1023 ND2 ASN B 198 10.967 8.117 4.335 1.00 21.55 N ATOM 0 H ASN B 198 12.215 5.658 3.473 1.00 21.78 H new ATOM 0 HA ASN B 198 12.002 4.458 6.191 1.00 19.17 H new ATOM 0 HB2 ASN B 198 10.399 6.158 6.907 1.00 18.45 H new ATOM 0 HB3 ASN B 198 11.898 6.956 6.475 1.00 18.45 H new ATOM 0 HD21 ASN B 198 10.478 8.680 3.639 1.00 21.55 H new ATOM 0 HD22 ASN B 198 11.966 8.252 4.489 1.00 21.55 H new ATOM 1030 N VAL B 199 9.924 3.305 5.362 1.00 14.62 N ATOM 1031 CA VAL B 199 8.786 2.552 4.762 1.00 11.82 C ATOM 1032 C VAL B 199 7.501 2.861 5.532 1.00 10.68 C ATOM 1033 O VAL B 199 7.462 2.803 6.746 1.00 13.24 O ATOM 1034 CB VAL B 199 9.073 1.050 4.838 1.00 9.61 C ATOM 1035 CG1 VAL B 199 7.896 0.276 4.244 1.00 11.94 C ATOM 1036 CG2 VAL B 199 10.343 0.734 4.045 1.00 10.00 C ATOM 0 H VAL B 199 10.281 2.927 6.240 1.00 14.62 H new ATOM 0 HA VAL B 199 8.665 2.850 3.721 1.00 11.82 H new ATOM 0 HB VAL B 199 9.212 0.758 5.879 1.00 9.61 H new ATOM 0 HG11 VAL B 199 8.100 -0.793 4.298 1.00 11.94 H new ATOM 0 HG12 VAL B 199 6.991 0.502 4.807 1.00 11.94 H new ATOM 0 HG13 VAL B 199 7.757 0.567 3.203 1.00 11.94 H new ATOM 0 HG21 VAL B 199 10.549 -0.335 4.098 1.00 10.00 H new ATOM 0 HG22 VAL B 199 10.204 1.025 3.004 1.00 10.00 H new ATOM 0 HG23 VAL B 199 11.182 1.286 4.467 1.00 10.00 H new ATOM 1046 N LYS B 200 6.445 3.186 4.835 1.00 11.30 N ATOM 1047 CA LYS B 200 5.161 3.493 5.525 1.00 11.14 C ATOM 1048 C LYS B 200 4.155 2.377 5.236 1.00 8.78 C ATOM 1049 O LYS B 200 4.003 1.943 4.112 1.00 9.63 O ATOM 1050 CB LYS B 200 4.609 4.825 5.011 1.00 11.27 C ATOM 1051 CG LYS B 200 5.153 5.968 5.870 1.00 16.97 C ATOM 1052 CD LYS B 200 6.172 6.775 5.063 1.00 21.04 C ATOM 1053 CE LYS B 200 5.722 8.235 4.984 1.00 28.12 C ATOM 1054 NZ LYS B 200 6.682 9.092 5.735 1.00 32.40 N ATOM 0 H LYS B 200 6.417 3.252 3.818 1.00 11.30 H new ATOM 0 HA LYS B 200 5.331 3.564 6.599 1.00 11.14 H new ATOM 0 HB2 LYS B 200 4.894 4.971 3.969 1.00 11.27 H new ATOM 0 HB3 LYS B 200 3.520 4.817 5.045 1.00 11.27 H new ATOM 0 HG2 LYS B 200 4.337 6.614 6.194 1.00 16.97 H new ATOM 0 HG3 LYS B 200 5.620 5.569 6.770 1.00 16.97 H new ATOM 0 HD2 LYS B 200 7.154 6.711 5.531 1.00 21.04 H new ATOM 0 HD3 LYS B 200 6.269 6.359 4.060 1.00 21.04 H new ATOM 0 HE2 LYS B 200 5.670 8.555 3.943 1.00 28.12 H new ATOM 0 HE3 LYS B 200 4.720 8.341 5.401 1.00 28.12 H new ATOM 0 HZ1 LYS B 200 6.626 10.068 5.381 1.00 32.40 H new ATOM 0 HZ2 LYS B 200 6.443 9.076 6.747 1.00 32.40 H new ATOM 0 HZ3 LYS B 200 7.648 8.730 5.602 1.00 32.40 H new ATOM 1068 N HIS B 201 3.472 1.905 6.241 1.00 7.82 N ATOM 1069 CA HIS B 201 2.482 0.813 6.019 1.00 7.41 C ATOM 1070 C HIS B 201 1.062 1.374 6.122 1.00 9.79 C ATOM 1071 O HIS B 201 0.632 1.816 7.169 1.00 10.36 O ATOM 1072 CB HIS B 201 2.679 -0.275 7.077 1.00 6.15 C ATOM 1073 CG HIS B 201 3.989 -0.975 6.837 1.00 5.80 C ATOM 1074 ND1 HIS B 201 4.121 -1.998 5.912 1.00 7.97 N ATOM 1075 CD2 HIS B 201 5.233 -0.811 7.394 1.00 7.69 C ATOM 1076 CE1 HIS B 201 5.403 -2.406 5.938 1.00 7.75 C ATOM 1077 NE2 HIS B 201 6.124 -1.715 6.824 1.00 6.51 N ATOM 0 H HIS B 201 3.556 2.227 7.205 1.00 7.82 H new ATOM 0 HA HIS B 201 2.630 0.388 5.026 1.00 7.41 H new ATOM 0 HB2 HIS B 201 2.667 0.166 8.074 1.00 6.15 H new ATOM 0 HB3 HIS B 201 1.858 -0.991 7.035 1.00 6.15 H new ATOM 0 HD2 HIS B 201 5.482 -0.090 8.158 1.00 7.69 H new ATOM 0 HE1 HIS B 201 5.800 -3.196 5.318 1.00 7.75 H new ATOM 0 HE2 HIS B 201 7.115 -1.826 7.037 1.00 6.51 H new ATOM 1085 N TYR B 202 0.330 1.357 5.041 1.00 10.61 N ATOM 1086 CA TYR B 202 -1.063 1.885 5.072 1.00 10.61 C ATOM 1087 C TYR B 202 -2.050 0.717 5.014 1.00 10.67 C ATOM 1088 O TYR B 202 -2.371 0.216 3.955 1.00 11.97 O ATOM 1089 CB TYR B 202 -1.287 2.797 3.865 1.00 10.02 C ATOM 1090 CG TYR B 202 -0.658 4.144 4.128 1.00 10.20 C ATOM 1091 CD1 TYR B 202 0.691 4.363 3.807 1.00 9.08 C ATOM 1092 CD2 TYR B 202 -1.424 5.179 4.693 1.00 10.92 C ATOM 1093 CE1 TYR B 202 1.278 5.616 4.051 1.00 11.32 C ATOM 1094 CE2 TYR B 202 -0.836 6.433 4.936 1.00 11.72 C ATOM 1095 CZ TYR B 202 0.514 6.651 4.615 1.00 12.88 C ATOM 1096 OH TYR B 202 1.090 7.882 4.854 1.00 13.22 O ATOM 0 H TYR B 202 0.638 1.000 4.137 1.00 10.61 H new ATOM 0 HA TYR B 202 -1.218 2.450 5.991 1.00 10.61 H new ATOM 0 HB2 TYR B 202 -0.852 2.349 2.972 1.00 10.02 H new ATOM 0 HB3 TYR B 202 -2.354 2.913 3.676 1.00 10.02 H new ATOM 0 HD1 TYR B 202 1.278 3.568 3.372 1.00 9.08 H new ATOM 0 HD2 TYR B 202 -2.462 5.011 4.940 1.00 10.92 H new ATOM 0 HE1 TYR B 202 2.316 5.783 3.805 1.00 11.32 H new ATOM 0 HE2 TYR B 202 -1.423 7.229 5.370 1.00 11.72 H new ATOM 0 HH TYR B 202 0.424 8.484 5.246 1.00 13.22 H new ATOM 1106 N LYS B 203 -2.532 0.278 6.144 1.00 11.16 N ATOM 1107 CA LYS B 203 -3.496 -0.858 6.148 1.00 13.85 C ATOM 1108 C LYS B 203 -4.751 -0.470 5.364 1.00 13.44 C ATOM 1109 O LYS B 203 -5.350 0.560 5.603 1.00 12.80 O ATOM 1110 CB LYS B 203 -3.880 -1.194 7.591 1.00 19.04 C ATOM 1111 CG LYS B 203 -4.256 0.091 8.332 1.00 23.92 C ATOM 1112 CD LYS B 203 -5.141 -0.253 9.533 1.00 29.39 C ATOM 1113 CE LYS B 203 -4.487 0.269 10.814 1.00 31.37 C ATOM 1114 NZ LYS B 203 -4.773 1.724 10.960 1.00 36.57 N ATOM 0 H LYS B 203 -2.301 0.656 7.063 1.00 11.16 H new ATOM 0 HA LYS B 203 -3.033 -1.727 5.681 1.00 13.85 H new ATOM 0 HB2 LYS B 203 -4.718 -1.891 7.603 1.00 19.04 H new ATOM 0 HB3 LYS B 203 -3.048 -1.687 8.095 1.00 19.04 H new ATOM 0 HG2 LYS B 203 -3.356 0.608 8.666 1.00 23.92 H new ATOM 0 HG3 LYS B 203 -4.783 0.770 7.661 1.00 23.92 H new ATOM 0 HD2 LYS B 203 -6.129 0.191 9.409 1.00 29.39 H new ATOM 0 HD3 LYS B 203 -5.282 -1.332 9.597 1.00 29.39 H new ATOM 0 HE2 LYS B 203 -4.868 -0.276 11.678 1.00 31.37 H new ATOM 0 HE3 LYS B 203 -3.411 0.101 10.780 1.00 31.37 H new ATOM 0 HZ1 LYS B 203 -4.329 2.079 11.831 1.00 36.57 H new ATOM 0 HZ2 LYS B 203 -4.389 2.237 10.141 1.00 36.57 H new ATOM 0 HZ3 LYS B 203 -5.801 1.872 11.011 1.00 36.57 H new ATOM 1128 N ILE B 204 -5.157 -1.289 4.431 1.00 14.05 N ATOM 1129 CA ILE B 204 -6.375 -0.969 3.636 1.00 13.51 C ATOM 1130 C ILE B 204 -7.599 -1.556 4.341 1.00 14.04 C ATOM 1131 O ILE B 204 -7.673 -2.742 4.591 1.00 15.82 O ATOM 1132 CB ILE B 204 -6.245 -1.572 2.236 1.00 12.30 C ATOM 1133 CG1 ILE B 204 -5.176 -0.808 1.451 1.00 11.29 C ATOM 1134 CG2 ILE B 204 -7.585 -1.465 1.502 1.00 14.21 C ATOM 1135 CD1 ILE B 204 -4.829 -1.579 0.175 1.00 13.89 C ATOM 0 H ILE B 204 -4.697 -2.166 4.186 1.00 14.05 H new ATOM 0 HA ILE B 204 -6.487 0.112 3.549 1.00 13.51 H new ATOM 0 HB ILE B 204 -5.960 -2.621 2.320 1.00 12.30 H new ATOM 0 HG12 ILE B 204 -5.538 0.189 1.199 1.00 11.29 H new ATOM 0 HG13 ILE B 204 -4.284 -0.678 2.064 1.00 11.29 H new ATOM 0 HG21 ILE B 204 -7.489 -1.895 0.505 1.00 14.21 H new ATOM 0 HG22 ILE B 204 -8.349 -2.007 2.059 1.00 14.21 H new ATOM 0 HG23 ILE B 204 -7.871 -0.417 1.419 1.00 14.21 H new ATOM 0 HD11 ILE B 204 -4.068 -1.034 -0.384 1.00 13.89 H new ATOM 0 HD12 ILE B 204 -4.449 -2.566 0.438 1.00 13.89 H new ATOM 0 HD13 ILE B 204 -5.723 -1.686 -0.440 1.00 13.89 H new ATOM 1147 N ARG B 205 -8.556 -0.733 4.672 1.00 15.56 N ATOM 1148 CA ARG B 205 -9.766 -1.246 5.370 1.00 13.76 C ATOM 1149 C ARG B 205 -10.687 -1.944 4.375 1.00 13.72 C ATOM 1150 O ARG B 205 -10.577 -1.770 3.176 1.00 13.25 O ATOM 1151 CB ARG B 205 -10.511 -0.086 6.026 1.00 15.23 C ATOM 1152 CG ARG B 205 -9.532 0.709 6.882 1.00 20.69 C ATOM 1153 CD ARG B 205 -10.260 1.280 8.101 1.00 28.70 C ATOM 1154 NE ARG B 205 -9.417 1.091 9.315 1.00 38.45 N ATOM 1155 CZ ARG B 205 -9.964 1.128 10.500 1.00 41.91 C ATOM 1156 NH1 ARG B 205 -10.477 0.044 11.017 1.00 44.96 N ATOM 1157 NH2 ARG B 205 -9.996 2.247 11.170 1.00 41.78 N ATOM 0 H ARG B 205 -8.551 0.270 4.489 1.00 15.56 H new ATOM 0 HA ARG B 205 -9.458 -1.960 6.134 1.00 13.76 H new ATOM 0 HB2 ARG B 205 -10.954 0.556 5.265 1.00 15.23 H new ATOM 0 HB3 ARG B 205 -11.329 -0.463 6.640 1.00 15.23 H new ATOM 0 HG2 ARG B 205 -8.711 0.068 7.204 1.00 20.69 H new ATOM 0 HG3 ARG B 205 -9.094 1.517 6.296 1.00 20.69 H new ATOM 0 HD2 ARG B 205 -10.468 2.339 7.951 1.00 28.70 H new ATOM 0 HD3 ARG B 205 -11.221 0.782 8.231 1.00 28.70 H new ATOM 0 HE ARG B 205 -8.414 0.933 9.220 1.00 38.45 H new ATOM 0 HH11 ARG B 205 -10.450 -0.832 10.495 1.00 44.96 H new ATOM 0 HH12 ARG B 205 -10.904 0.073 11.943 1.00 44.96 H new ATOM 0 HH21 ARG B 205 -9.594 3.094 10.768 1.00 41.78 H new ATOM 0 HH22 ARG B 205 -10.424 2.275 12.096 1.00 41.78 H new ATOM 1171 N LYS B 206 -11.593 -2.732 4.874 1.00 14.89 N ATOM 1172 CA LYS B 206 -12.536 -3.461 3.977 1.00 18.13 C ATOM 1173 C LYS B 206 -13.958 -3.355 4.533 1.00 17.74 C ATOM 1174 O LYS B 206 -14.162 -3.153 5.714 1.00 18.39 O ATOM 1175 CB LYS B 206 -12.117 -4.937 3.901 1.00 21.97 C ATOM 1176 CG LYS B 206 -13.255 -5.782 3.312 1.00 27.97 C ATOM 1177 CD LYS B 206 -12.689 -7.099 2.778 1.00 32.27 C ATOM 1178 CE LYS B 206 -13.756 -8.191 2.877 1.00 33.99 C ATOM 1179 NZ LYS B 206 -13.493 -9.237 1.848 1.00 35.74 N ATOM 0 H LYS B 206 -11.724 -2.906 5.870 1.00 14.89 H new ATOM 0 HA LYS B 206 -12.510 -3.022 2.980 1.00 18.13 H new ATOM 0 HB2 LYS B 206 -11.223 -5.038 3.285 1.00 21.97 H new ATOM 0 HB3 LYS B 206 -11.861 -5.302 4.896 1.00 21.97 H new ATOM 0 HG2 LYS B 206 -14.008 -5.980 4.075 1.00 27.97 H new ATOM 0 HG3 LYS B 206 -13.751 -5.235 2.510 1.00 27.97 H new ATOM 0 HD2 LYS B 206 -12.373 -6.978 1.742 1.00 32.27 H new ATOM 0 HD3 LYS B 206 -11.806 -7.386 3.349 1.00 32.27 H new ATOM 0 HE2 LYS B 206 -13.746 -8.635 3.873 1.00 33.99 H new ATOM 0 HE3 LYS B 206 -14.747 -7.761 2.729 1.00 33.99 H new ATOM 0 HZ1 LYS B 206 -14.218 -9.980 1.915 1.00 35.74 H new ATOM 0 HZ2 LYS B 206 -13.523 -8.808 0.901 1.00 35.74 H new ATOM 0 HZ3 LYS B 206 -12.554 -9.654 2.009 1.00 35.74 H new ATOM 1193 N LEU B 207 -14.941 -3.501 3.690 1.00 17.31 N ATOM 1194 CA LEU B 207 -16.348 -3.423 4.159 1.00 19.33 C ATOM 1195 C LEU B 207 -17.034 -4.762 3.891 1.00 21.64 C ATOM 1196 O LEU B 207 -16.950 -5.305 2.808 1.00 21.80 O ATOM 1197 CB LEU B 207 -17.082 -2.316 3.401 1.00 19.68 C ATOM 1198 CG LEU B 207 -16.875 -0.982 4.118 1.00 19.58 C ATOM 1199 CD1 LEU B 207 -17.328 0.162 3.209 1.00 16.81 C ATOM 1200 CD2 LEU B 207 -17.698 -0.965 5.407 1.00 16.39 C ATOM 0 H LEU B 207 -14.828 -3.672 2.691 1.00 17.31 H new ATOM 0 HA LEU B 207 -16.368 -3.201 5.226 1.00 19.33 H new ATOM 0 HB2 LEU B 207 -16.710 -2.253 2.378 1.00 19.68 H new ATOM 0 HB3 LEU B 207 -18.146 -2.547 3.340 1.00 19.68 H new ATOM 0 HG LEU B 207 -15.819 -0.858 4.358 1.00 19.58 H new ATOM 0 HD11 LEU B 207 -17.180 1.113 3.720 1.00 16.81 H new ATOM 0 HD12 LEU B 207 -16.743 0.150 2.289 1.00 16.81 H new ATOM 0 HD13 LEU B 207 -18.384 0.039 2.969 1.00 16.81 H new ATOM 0 HD21 LEU B 207 -17.552 -0.014 5.920 1.00 16.39 H new ATOM 0 HD22 LEU B 207 -18.754 -1.089 5.166 1.00 16.39 H new ATOM 0 HD23 LEU B 207 -17.376 -1.780 6.055 1.00 16.39 H new ATOM 1212 N ASP B 208 -17.707 -5.302 4.866 1.00 24.31 N ATOM 1213 CA ASP B 208 -18.388 -6.608 4.657 1.00 27.33 C ATOM 1214 C ASP B 208 -19.301 -6.514 3.434 1.00 28.23 C ATOM 1215 O ASP B 208 -19.640 -7.506 2.822 1.00 28.17 O ATOM 1216 CB ASP B 208 -19.222 -6.954 5.894 1.00 32.44 C ATOM 1217 CG ASP B 208 -20.356 -5.939 6.045 1.00 36.84 C ATOM 1218 OD1 ASP B 208 -21.277 -5.987 5.246 1.00 40.11 O ATOM 1219 OD2 ASP B 208 -20.284 -5.132 6.956 1.00 41.58 O ATOM 0 H ASP B 208 -17.815 -4.897 5.796 1.00 24.31 H new ATOM 0 HA ASP B 208 -17.642 -7.386 4.495 1.00 27.33 H new ATOM 0 HB2 ASP B 208 -19.630 -7.960 5.800 1.00 32.44 H new ATOM 0 HB3 ASP B 208 -18.592 -6.947 6.784 1.00 32.44 H new ATOM 1224 N SER B 209 -19.702 -5.325 3.073 1.00 30.57 N ATOM 1225 CA SER B 209 -20.587 -5.160 1.897 1.00 30.81 C ATOM 1226 C SER B 209 -19.774 -5.342 0.613 1.00 31.86 C ATOM 1227 O SER B 209 -20.201 -5.996 -0.317 1.00 34.96 O ATOM 1228 CB SER B 209 -21.185 -3.760 1.930 1.00 29.35 C ATOM 1229 OG SER B 209 -20.276 -2.874 2.569 1.00 27.77 O ATOM 0 H SER B 209 -19.450 -4.459 3.549 1.00 30.57 H new ATOM 0 HA SER B 209 -21.382 -5.905 1.922 1.00 30.81 H new ATOM 0 HB2 SER B 209 -21.392 -3.417 0.916 1.00 29.35 H new ATOM 0 HB3 SER B 209 -22.135 -3.771 2.464 1.00 29.35 H new ATOM 0 HG SER B 209 -20.658 -1.972 2.590 1.00 27.77 H new ATOM 1235 N GLY B 210 -18.603 -4.768 0.556 1.00 31.91 N ATOM 1236 CA GLY B 210 -17.764 -4.908 -0.667 1.00 30.37 C ATOM 1237 C GLY B 210 -17.105 -3.568 -0.995 1.00 29.39 C ATOM 1238 O GLY B 210 -17.230 -3.056 -2.090 1.00 32.51 O ATOM 0 H GLY B 210 -18.192 -4.209 1.303 1.00 31.91 H new ATOM 0 HA2 GLY B 210 -17.001 -5.671 -0.511 1.00 30.37 H new ATOM 0 HA3 GLY B 210 -18.378 -5.237 -1.505 1.00 30.37 H new ATOM 1242 N GLY B 211 -16.404 -2.995 -0.056 1.00 27.09 N ATOM 1243 CA GLY B 211 -15.737 -1.688 -0.316 1.00 22.75 C ATOM 1244 C GLY B 211 -14.367 -1.668 0.363 1.00 20.54 C ATOM 1245 O GLY B 211 -14.010 -2.573 1.090 1.00 21.66 O ATOM 0 H GLY B 211 -16.264 -3.375 0.880 1.00 27.09 H new ATOM 0 HA2 GLY B 211 -15.625 -1.533 -1.389 1.00 22.75 H new ATOM 0 HA3 GLY B 211 -16.353 -0.872 0.062 1.00 22.75 H new ATOM 1249 N PHE B 212 -13.595 -0.641 0.134 1.00 18.17 N ATOM 1250 CA PHE B 212 -12.250 -0.564 0.769 1.00 17.54 C ATOM 1251 C PHE B 212 -11.875 0.903 0.975 1.00 15.84 C ATOM 1252 O PHE B 212 -12.291 1.767 0.229 1.00 18.26 O ATOM 1253 CB PHE B 212 -11.217 -1.234 -0.140 1.00 16.88 C ATOM 1254 CG PHE B 212 -11.723 -2.593 -0.560 1.00 18.16 C ATOM 1255 CD1 PHE B 212 -12.593 -2.709 -1.658 1.00 18.64 C ATOM 1256 CD2 PHE B 212 -11.325 -3.741 0.146 1.00 18.25 C ATOM 1257 CE1 PHE B 212 -13.065 -3.973 -2.049 1.00 19.59 C ATOM 1258 CE2 PHE B 212 -11.798 -5.005 -0.246 1.00 18.17 C ATOM 1259 CZ PHE B 212 -12.668 -5.122 -1.343 1.00 18.19 C ATOM 0 H PHE B 212 -13.838 0.148 -0.465 1.00 18.17 H new ATOM 0 HA PHE B 212 -12.269 -1.075 1.731 1.00 17.54 H new ATOM 0 HB2 PHE B 212 -11.034 -0.615 -1.018 1.00 16.88 H new ATOM 0 HB3 PHE B 212 -10.266 -1.334 0.384 1.00 16.88 H new ATOM 0 HD1 PHE B 212 -12.898 -1.827 -2.201 1.00 18.64 H new ATOM 0 HD2 PHE B 212 -10.656 -3.652 0.989 1.00 18.25 H new ATOM 0 HE1 PHE B 212 -13.733 -4.062 -2.893 1.00 19.59 H new ATOM 0 HE2 PHE B 212 -11.492 -5.887 0.297 1.00 18.17 H new ATOM 0 HZ PHE B 212 -13.031 -6.094 -1.644 1.00 18.19 H new ATOM 1269 N TYR B 213 -11.095 1.197 1.978 1.00 14.56 N ATOM 1270 CA TYR B 213 -10.707 2.616 2.213 1.00 12.35 C ATOM 1271 C TYR B 213 -9.641 2.690 3.309 1.00 12.92 C ATOM 1272 O TYR B 213 -9.733 2.031 4.325 1.00 12.14 O ATOM 1273 CB TYR B 213 -11.944 3.423 2.636 1.00 12.55 C ATOM 1274 CG TYR B 213 -12.299 3.117 4.075 1.00 14.01 C ATOM 1275 CD1 TYR B 213 -11.585 3.731 5.119 1.00 13.49 C ATOM 1276 CD2 TYR B 213 -13.339 2.221 4.368 1.00 13.18 C ATOM 1277 CE1 TYR B 213 -11.913 3.448 6.455 1.00 13.06 C ATOM 1278 CE2 TYR B 213 -13.667 1.938 5.705 1.00 14.46 C ATOM 1279 CZ TYR B 213 -12.954 2.552 6.748 1.00 15.80 C ATOM 1280 OH TYR B 213 -13.276 2.274 8.061 1.00 18.90 O ATOM 0 H TYR B 213 -10.712 0.522 2.640 1.00 14.56 H new ATOM 0 HA TYR B 213 -10.299 3.034 1.293 1.00 12.35 H new ATOM 0 HB2 TYR B 213 -11.749 4.489 2.520 1.00 12.55 H new ATOM 0 HB3 TYR B 213 -12.785 3.181 1.987 1.00 12.55 H new ATOM 0 HD1 TYR B 213 -10.785 4.420 4.894 1.00 13.49 H new ATOM 0 HD2 TYR B 213 -13.887 1.749 3.566 1.00 13.18 H new ATOM 0 HE1 TYR B 213 -11.365 3.919 7.257 1.00 13.06 H new ATOM 0 HE2 TYR B 213 -14.467 1.249 5.930 1.00 14.46 H new ATOM 0 HH TYR B 213 -14.019 1.636 8.087 1.00 18.90 H new ATOM 1290 N ILE B 214 -8.638 3.498 3.115 1.00 13.74 N ATOM 1291 CA ILE B 214 -7.576 3.625 4.149 1.00 13.80 C ATOM 1292 C ILE B 214 -7.826 4.895 4.972 1.00 14.16 C ATOM 1293 O ILE B 214 -7.134 5.168 5.933 1.00 12.50 O ATOM 1294 CB ILE B 214 -6.208 3.698 3.462 1.00 10.15 C ATOM 1295 CG1 ILE B 214 -5.810 2.295 3.002 1.00 9.57 C ATOM 1296 CG2 ILE B 214 -5.152 4.224 4.439 1.00 8.37 C ATOM 1297 CD1 ILE B 214 -4.780 2.397 1.876 1.00 7.18 C ATOM 0 H ILE B 214 -8.508 4.076 2.285 1.00 13.74 H new ATOM 0 HA ILE B 214 -7.593 2.761 4.813 1.00 13.80 H new ATOM 0 HB ILE B 214 -6.270 4.374 2.609 1.00 10.15 H new ATOM 0 HG12 ILE B 214 -5.395 1.731 3.838 1.00 9.57 H new ATOM 0 HG13 ILE B 214 -6.689 1.752 2.656 1.00 9.57 H new ATOM 0 HG21 ILE B 214 -4.185 4.271 3.939 1.00 8.37 H new ATOM 0 HG22 ILE B 214 -5.434 5.221 4.778 1.00 8.37 H new ATOM 0 HG23 ILE B 214 -5.085 3.555 5.297 1.00 8.37 H new ATOM 0 HD11 ILE B 214 -4.498 1.396 1.549 1.00 7.18 H new ATOM 0 HD12 ILE B 214 -5.211 2.944 1.037 1.00 7.18 H new ATOM 0 HD13 ILE B 214 -3.897 2.923 2.237 1.00 7.18 H new ATOM 1309 N THR B 215 -8.814 5.669 4.608 1.00 15.77 N ATOM 1310 CA THR B 215 -9.106 6.910 5.375 1.00 18.20 C ATOM 1311 C THR B 215 -10.611 7.009 5.623 1.00 17.81 C ATOM 1312 O THR B 215 -11.410 6.472 4.881 1.00 15.56 O ATOM 1313 CB THR B 215 -8.637 8.129 4.576 1.00 20.21 C ATOM 1314 OG1 THR B 215 -8.821 9.302 5.357 1.00 26.81 O ATOM 1315 CG2 THR B 215 -9.449 8.240 3.285 1.00 22.31 C ATOM 0 H THR B 215 -9.429 5.494 3.814 1.00 15.77 H new ATOM 0 HA THR B 215 -8.580 6.881 6.329 1.00 18.20 H new ATOM 0 HB THR B 215 -7.581 8.018 4.328 1.00 20.21 H new ATOM 0 HG1 THR B 215 -8.520 10.084 4.849 1.00 26.81 H new ATOM 0 HG21 THR B 215 -9.114 9.108 2.718 1.00 22.31 H new ATOM 0 HG22 THR B 215 -9.307 7.339 2.688 1.00 22.31 H new ATOM 0 HG23 THR B 215 -10.506 8.352 3.528 1.00 22.31 H new ATOM 1323 N SER B 216 -11.006 7.690 6.663 1.00 18.97 N ATOM 1324 CA SER B 216 -12.461 7.819 6.959 1.00 18.71 C ATOM 1325 C SER B 216 -13.033 9.014 6.196 1.00 18.69 C ATOM 1326 O SER B 216 -13.427 10.005 6.780 1.00 20.53 O ATOM 1327 CB SER B 216 -12.658 8.028 8.461 1.00 20.19 C ATOM 1328 OG SER B 216 -14.048 8.077 8.751 1.00 22.41 O ATOM 0 H SER B 216 -10.385 8.162 7.320 1.00 18.97 H new ATOM 0 HA SER B 216 -12.978 6.911 6.648 1.00 18.71 H new ATOM 0 HB2 SER B 216 -12.187 7.217 9.017 1.00 20.19 H new ATOM 0 HB3 SER B 216 -12.176 8.953 8.777 1.00 20.19 H new ATOM 0 HG SER B 216 -14.177 8.209 9.713 1.00 22.41 H new ATOM 1334 N ARG B 217 -13.081 8.931 4.896 1.00 0.00 N ATOM 1335 CA ARG B 217 -13.624 10.060 4.096 1.00 0.00 C ATOM 1336 C ARG B 217 -13.963 9.568 2.685 1.00 0.00 C ATOM 1337 O ARG B 217 -14.943 9.975 2.095 1.00 0.00 O ATOM 1338 CB ARG B 217 -12.575 11.170 4.017 1.00 0.00 C ATOM 1339 CG ARG B 217 -13.020 12.230 3.008 1.00 0.00 C ATOM 1340 CD ARG B 217 -14.221 12.996 3.567 1.00 0.00 C ATOM 1341 NE ARG B 217 -14.305 14.334 2.916 1.00 0.00 N ATOM 1342 CZ ARG B 217 -15.456 14.788 2.502 1.00 0.00 C ATOM 1343 NH1 ARG B 217 -16.427 14.976 3.353 1.00 0.00 N ATOM 1344 NH2 ARG B 217 -15.636 15.054 1.238 1.00 0.00 N ATOM 0 H ARG B 217 -12.766 8.127 4.353 1.00 0.00 H new ATOM 0 HA ARG B 217 -14.527 10.446 4.569 1.00 0.00 H new ATOM 0 HB2 ARG B 217 -12.437 11.624 4.998 1.00 0.00 H new ATOM 0 HB3 ARG B 217 -11.612 10.753 3.720 1.00 0.00 H new ATOM 0 HG2 ARG B 217 -12.200 12.918 2.802 1.00 0.00 H new ATOM 0 HG3 ARG B 217 -13.285 11.758 2.062 1.00 0.00 H new ATOM 0 HD2 ARG B 217 -15.138 12.435 3.389 1.00 0.00 H new ATOM 0 HD3 ARG B 217 -14.122 13.111 4.646 1.00 0.00 H new ATOM 0 HE ARG B 217 -13.462 14.895 2.794 1.00 0.00 H new ATOM 0 HH11 ARG B 217 -16.286 14.768 4.342 1.00 0.00 H new ATOM 0 HH12 ARG B 217 -17.327 15.331 3.030 1.00 0.00 H new ATOM 0 HH21 ARG B 217 -14.877 14.907 0.573 1.00 0.00 H new ATOM 0 HH22 ARG B 217 -16.536 15.409 0.915 1.00 0.00 H new ATOM 1358 N THR B 218 -13.159 8.697 2.139 1.00 23.45 N ATOM 1359 CA THR B 218 -13.437 8.185 0.767 1.00 23.59 C ATOM 1360 C THR B 218 -13.525 6.658 0.797 1.00 19.84 C ATOM 1361 O THR B 218 -12.824 6.001 1.539 1.00 20.24 O ATOM 1362 CB THR B 218 -12.308 8.610 -0.174 1.00 26.45 C ATOM 1363 OG1 THR B 218 -11.922 9.944 0.124 1.00 30.31 O ATOM 1364 CG2 THR B 218 -12.789 8.528 -1.623 1.00 27.38 C ATOM 0 H THR B 218 -12.323 8.318 2.583 1.00 23.45 H new ATOM 0 HA THR B 218 -14.382 8.596 0.413 1.00 23.59 H new ATOM 0 HB THR B 218 -11.454 7.946 -0.040 1.00 26.45 H new ATOM 0 HG1 THR B 218 -11.198 10.217 -0.477 1.00 30.31 H new ATOM 0 HG21 THR B 218 -11.983 8.831 -2.292 1.00 27.38 H new ATOM 0 HG22 THR B 218 -13.084 7.504 -1.851 1.00 27.38 H new ATOM 0 HG23 THR B 218 -13.643 9.191 -1.761 1.00 27.38 H new ATOM 1372 N GLN B 219 -14.383 6.088 -0.005 1.00 18.30 N ATOM 1373 CA GLN B 219 -14.516 4.605 -0.026 1.00 20.11 C ATOM 1374 C GLN B 219 -14.304 4.097 -1.452 1.00 19.45 C ATOM 1375 O GLN B 219 -14.294 4.859 -2.399 1.00 20.30 O ATOM 1376 CB GLN B 219 -15.917 4.218 0.451 1.00 20.56 C ATOM 1377 CG GLN B 219 -16.280 5.039 1.688 1.00 23.60 C ATOM 1378 CD GLN B 219 -17.494 4.414 2.377 1.00 19.08 C ATOM 1379 OE1 GLN B 219 -17.731 3.228 2.258 1.00 17.99 O ATOM 1380 NE2 GLN B 219 -18.279 5.167 3.100 1.00 17.08 N ATOM 0 H GLN B 219 -14.998 6.587 -0.647 1.00 18.30 H new ATOM 0 HA GLN B 219 -13.770 4.160 0.632 1.00 20.11 H new ATOM 0 HB2 GLN B 219 -16.644 4.394 -0.342 1.00 20.56 H new ATOM 0 HB3 GLN B 219 -15.952 3.154 0.685 1.00 20.56 H new ATOM 0 HG2 GLN B 219 -15.435 5.072 2.376 1.00 23.60 H new ATOM 0 HG3 GLN B 219 -16.500 6.068 1.403 1.00 23.60 H new ATOM 0 HE21 GLN B 219 -18.080 6.162 3.200 1.00 17.08 H new ATOM 0 HE22 GLN B 219 -19.091 4.760 3.564 1.00 17.08 H new ATOM 1389 N PHE B 220 -14.131 2.815 -1.614 1.00 18.96 N ATOM 1390 CA PHE B 220 -13.918 2.259 -2.980 1.00 17.73 C ATOM 1391 C PHE B 220 -14.700 0.955 -3.129 1.00 17.76 C ATOM 1392 O PHE B 220 -15.140 0.370 -2.160 1.00 19.11 O ATOM 1393 CB PHE B 220 -12.427 1.988 -3.192 1.00 14.17 C ATOM 1394 CG PHE B 220 -11.687 3.301 -3.288 1.00 14.07 C ATOM 1395 CD1 PHE B 220 -11.885 4.140 -4.398 1.00 14.01 C ATOM 1396 CD2 PHE B 220 -10.800 3.683 -2.267 1.00 12.87 C ATOM 1397 CE1 PHE B 220 -11.196 5.361 -4.487 1.00 11.11 C ATOM 1398 CE2 PHE B 220 -10.112 4.905 -2.357 1.00 13.31 C ATOM 1399 CZ PHE B 220 -10.310 5.744 -3.466 1.00 13.09 C ATOM 0 H PHE B 220 -14.128 2.128 -0.860 1.00 18.96 H new ATOM 0 HA PHE B 220 -14.267 2.976 -3.723 1.00 17.73 H new ATOM 0 HB2 PHE B 220 -12.033 1.395 -2.366 1.00 14.17 H new ATOM 0 HB3 PHE B 220 -12.278 1.406 -4.102 1.00 14.17 H new ATOM 0 HD1 PHE B 220 -12.567 3.846 -5.182 1.00 14.01 H new ATOM 0 HD2 PHE B 220 -10.647 3.038 -1.414 1.00 12.87 H new ATOM 0 HE1 PHE B 220 -11.347 6.005 -5.340 1.00 11.11 H new ATOM 0 HE2 PHE B 220 -9.430 5.199 -1.573 1.00 13.31 H new ATOM 0 HZ PHE B 220 -9.781 6.683 -3.534 1.00 13.09 H new ATOM 1409 N ASN B 221 -14.874 0.498 -4.336 1.00 20.00 N ATOM 1410 CA ASN B 221 -15.629 -0.769 -4.550 1.00 21.48 C ATOM 1411 C ASN B 221 -14.644 -1.930 -4.709 1.00 22.18 C ATOM 1412 O ASN B 221 -15.019 -3.084 -4.649 1.00 24.56 O ATOM 1413 CB ASN B 221 -16.484 -0.646 -5.812 1.00 26.12 C ATOM 1414 CG ASN B 221 -17.801 0.051 -5.470 1.00 28.62 C ATOM 1415 OD1 ASN B 221 -17.801 1.036 -4.613 1.00 32.09 O flip ATOM 1416 ND2 ASN B 221 -18.842 -0.303 -5.988 1.00 31.44 N flip ATOM 0 H ASN B 221 -14.527 0.946 -5.184 1.00 20.00 H new ATOM 0 HA ASN B 221 -16.274 -0.957 -3.692 1.00 21.48 H new ATOM 0 HB2 ASN B 221 -15.948 -0.080 -6.574 1.00 26.12 H new ATOM 0 HB3 ASN B 221 -16.681 -1.634 -6.229 1.00 26.12 H new ATOM 0 HD21 ASN B 221 -18.843 -1.072 -6.658 1.00 31.44 H new ATOM 0 HD22 ASN B 221 -19.715 0.169 -5.753 1.00 31.44 H new ATOM 1423 N SER B 222 -13.388 -1.635 -4.913 1.00 20.04 N ATOM 1424 CA SER B 222 -12.386 -2.726 -5.074 1.00 17.84 C ATOM 1425 C SER B 222 -11.000 -2.209 -4.683 1.00 17.08 C ATOM 1426 O SER B 222 -10.672 -1.059 -4.900 1.00 17.94 O ATOM 1427 CB SER B 222 -12.365 -3.187 -6.531 1.00 15.42 C ATOM 1428 OG SER B 222 -12.317 -2.049 -7.383 1.00 19.15 O ATOM 0 H SER B 222 -13.014 -0.688 -4.975 1.00 20.04 H new ATOM 0 HA SER B 222 -12.655 -3.564 -4.431 1.00 17.84 H new ATOM 0 HB2 SER B 222 -11.500 -3.826 -6.710 1.00 15.42 H new ATOM 0 HB3 SER B 222 -13.252 -3.782 -6.749 1.00 15.42 H new ATOM 0 HG SER B 222 -12.302 -2.341 -8.318 1.00 19.15 H new ATOM 1434 N LEU B 223 -10.184 -3.049 -4.109 1.00 17.11 N ATOM 1435 CA LEU B 223 -8.820 -2.607 -3.708 1.00 16.96 C ATOM 1436 C LEU B 223 -8.146 -1.909 -4.889 1.00 17.05 C ATOM 1437 O LEU B 223 -7.377 -0.983 -4.721 1.00 18.74 O ATOM 1438 CB LEU B 223 -7.993 -3.825 -3.294 1.00 15.68 C ATOM 1439 CG LEU B 223 -8.628 -4.484 -2.068 1.00 18.50 C ATOM 1440 CD1 LEU B 223 -8.265 -5.969 -2.040 1.00 17.89 C ATOM 1441 CD2 LEU B 223 -8.104 -3.808 -0.799 1.00 17.50 C ATOM 0 H LEU B 223 -10.403 -4.023 -3.900 1.00 17.11 H new ATOM 0 HA LEU B 223 -8.891 -1.915 -2.869 1.00 16.96 H new ATOM 0 HB2 LEU B 223 -7.941 -4.538 -4.117 1.00 15.68 H new ATOM 0 HB3 LEU B 223 -6.970 -3.523 -3.068 1.00 15.68 H new ATOM 0 HG LEU B 223 -9.712 -4.376 -2.118 1.00 18.50 H new ATOM 0 HD11 LEU B 223 -8.718 -6.438 -1.166 1.00 17.89 H new ATOM 0 HD12 LEU B 223 -8.636 -6.451 -2.944 1.00 17.89 H new ATOM 0 HD13 LEU B 223 -7.182 -6.078 -1.990 1.00 17.89 H new ATOM 0 HD21 LEU B 223 -8.555 -4.276 0.076 1.00 17.50 H new ATOM 0 HD22 LEU B 223 -7.021 -3.916 -0.750 1.00 17.50 H new ATOM 0 HD23 LEU B 223 -8.362 -2.749 -0.818 1.00 17.50 H new ATOM 1453 N GLN B 224 -8.430 -2.347 -6.087 1.00 17.04 N ATOM 1454 CA GLN B 224 -7.806 -1.709 -7.280 1.00 17.80 C ATOM 1455 C GLN B 224 -8.255 -0.251 -7.373 1.00 17.42 C ATOM 1456 O GLN B 224 -7.467 0.634 -7.638 1.00 17.16 O ATOM 1457 CB GLN B 224 -8.239 -2.460 -8.542 1.00 21.63 C ATOM 1458 CG GLN B 224 -7.279 -2.130 -9.686 1.00 27.99 C ATOM 1459 CD GLN B 224 -8.008 -1.294 -10.740 1.00 31.34 C ATOM 1460 OE1 GLN B 224 -8.607 -0.285 -10.424 1.00 31.30 O ATOM 1461 NE2 GLN B 224 -7.984 -1.674 -11.988 1.00 33.99 N ATOM 0 H GLN B 224 -9.066 -3.118 -6.290 1.00 17.04 H new ATOM 0 HA GLN B 224 -6.721 -1.747 -7.188 1.00 17.80 H new ATOM 0 HB2 GLN B 224 -8.244 -3.534 -8.355 1.00 21.63 H new ATOM 0 HB3 GLN B 224 -9.256 -2.179 -8.814 1.00 21.63 H new ATOM 0 HG2 GLN B 224 -6.417 -1.582 -9.305 1.00 27.99 H new ATOM 0 HG3 GLN B 224 -6.900 -3.049 -10.134 1.00 27.99 H new ATOM 0 HE21 GLN B 224 -7.481 -2.521 -12.254 1.00 33.99 H new ATOM 0 HE22 GLN B 224 -8.468 -1.124 -12.698 1.00 33.99 H new ATOM 1470 N GLN B 225 -9.516 0.008 -7.155 1.00 17.93 N ATOM 1471 CA GLN B 225 -10.008 1.413 -7.228 1.00 17.77 C ATOM 1472 C GLN B 225 -9.247 2.269 -6.213 1.00 14.93 C ATOM 1473 O GLN B 225 -8.815 3.365 -6.510 1.00 15.44 O ATOM 1474 CB GLN B 225 -11.504 1.446 -6.907 1.00 23.54 C ATOM 1475 CG GLN B 225 -12.186 2.528 -7.748 1.00 32.83 C ATOM 1476 CD GLN B 225 -13.695 2.493 -7.498 1.00 37.70 C ATOM 1477 OE1 GLN B 225 -14.249 1.454 -7.199 1.00 41.31 O ATOM 1478 NE2 GLN B 225 -14.388 3.594 -7.606 1.00 38.92 N ATOM 0 H GLN B 225 -10.225 -0.690 -6.930 1.00 17.93 H new ATOM 0 HA GLN B 225 -9.845 1.807 -8.231 1.00 17.77 H new ATOM 0 HB2 GLN B 225 -11.952 0.474 -7.114 1.00 23.54 H new ATOM 0 HB3 GLN B 225 -11.654 1.647 -5.846 1.00 23.54 H new ATOM 0 HG2 GLN B 225 -11.787 3.509 -7.491 1.00 32.83 H new ATOM 0 HG3 GLN B 225 -11.978 2.366 -8.806 1.00 32.83 H new ATOM 0 HE21 GLN B 225 -13.923 4.467 -7.857 1.00 38.92 H new ATOM 0 HE22 GLN B 225 -15.394 3.582 -7.439 1.00 38.92 H new ATOM 1487 N LEU B 226 -9.076 1.773 -5.018 1.00 13.83 N ATOM 1488 CA LEU B 226 -8.340 2.555 -3.984 1.00 13.09 C ATOM 1489 C LEU B 226 -6.906 2.795 -4.460 1.00 11.87 C ATOM 1490 O LEU B 226 -6.280 3.776 -4.107 1.00 12.13 O ATOM 1491 CB LEU B 226 -8.319 1.769 -2.670 1.00 12.56 C ATOM 1492 CG LEU B 226 -7.499 2.530 -1.625 1.00 13.63 C ATOM 1493 CD1 LEU B 226 -7.929 2.093 -0.223 1.00 13.34 C ATOM 1494 CD2 LEU B 226 -6.011 2.221 -1.819 1.00 14.36 C ATOM 0 H LEU B 226 -9.414 0.860 -4.713 1.00 13.83 H new ATOM 0 HA LEU B 226 -8.837 3.512 -3.825 1.00 13.09 H new ATOM 0 HB2 LEU B 226 -9.336 1.619 -2.309 1.00 12.56 H new ATOM 0 HB3 LEU B 226 -7.890 0.781 -2.833 1.00 12.56 H new ATOM 0 HG LEU B 226 -7.667 3.601 -1.741 1.00 13.63 H new ATOM 0 HD11 LEU B 226 -7.346 2.634 0.522 1.00 13.34 H new ATOM 0 HD12 LEU B 226 -8.988 2.311 -0.083 1.00 13.34 H new ATOM 0 HD13 LEU B 226 -7.760 1.022 -0.108 1.00 13.34 H new ATOM 0 HD21 LEU B 226 -5.427 2.763 -1.075 1.00 14.36 H new ATOM 0 HD22 LEU B 226 -5.844 1.150 -1.702 1.00 14.36 H new ATOM 0 HD23 LEU B 226 -5.702 2.530 -2.818 1.00 14.36 H new ATOM 1506 N VAL B 227 -6.379 1.906 -5.258 1.00 11.28 N ATOM 1507 CA VAL B 227 -4.984 2.083 -5.754 1.00 13.23 C ATOM 1508 C VAL B 227 -4.959 3.160 -6.842 1.00 13.64 C ATOM 1509 O VAL B 227 -4.011 3.909 -6.964 1.00 15.96 O ATOM 1510 CB VAL B 227 -4.480 0.762 -6.335 1.00 9.89 C ATOM 1511 CG1 VAL B 227 -3.063 0.949 -6.878 1.00 9.85 C ATOM 1512 CG2 VAL B 227 -4.467 -0.307 -5.239 1.00 9.58 C ATOM 0 H VAL B 227 -6.854 1.066 -5.588 1.00 11.28 H new ATOM 0 HA VAL B 227 -4.342 2.388 -4.928 1.00 13.23 H new ATOM 0 HB VAL B 227 -5.141 0.448 -7.143 1.00 9.89 H new ATOM 0 HG11 VAL B 227 -2.705 0.006 -7.292 1.00 9.85 H new ATOM 0 HG12 VAL B 227 -3.070 1.709 -7.659 1.00 9.85 H new ATOM 0 HG13 VAL B 227 -2.403 1.265 -6.070 1.00 9.85 H new ATOM 0 HG21 VAL B 227 -4.108 -1.249 -5.654 1.00 9.58 H new ATOM 0 HG22 VAL B 227 -3.808 0.009 -4.431 1.00 9.58 H new ATOM 0 HG23 VAL B 227 -5.477 -0.443 -4.851 1.00 9.58 H new ATOM 1522 N ALA B 228 -5.991 3.239 -7.638 1.00 16.21 N ATOM 1523 CA ALA B 228 -6.023 4.262 -8.721 1.00 16.05 C ATOM 1524 C ALA B 228 -6.089 5.662 -8.107 1.00 16.38 C ATOM 1525 O ALA B 228 -5.274 6.516 -8.396 1.00 17.42 O ATOM 1526 CB ALA B 228 -7.254 4.033 -9.600 1.00 17.50 C ATOM 0 H ALA B 228 -6.814 2.638 -7.585 1.00 16.21 H new ATOM 0 HA ALA B 228 -5.120 4.176 -9.326 1.00 16.05 H new ATOM 0 HB1 ALA B 228 -7.279 4.781 -10.393 1.00 17.50 H new ATOM 0 HB2 ALA B 228 -7.206 3.037 -10.041 1.00 17.50 H new ATOM 0 HB3 ALA B 228 -8.155 4.118 -8.993 1.00 17.50 H new ATOM 1532 N TYR B 229 -7.052 5.908 -7.263 1.00 17.24 N ATOM 1533 CA TYR B 229 -7.163 7.254 -6.637 1.00 15.90 C ATOM 1534 C TYR B 229 -5.861 7.580 -5.903 1.00 15.53 C ATOM 1535 O TYR B 229 -5.282 8.631 -6.086 1.00 15.40 O ATOM 1536 CB TYR B 229 -8.326 7.263 -5.645 1.00 17.41 C ATOM 1537 CG TYR B 229 -8.649 8.687 -5.260 1.00 19.62 C ATOM 1538 CD1 TYR B 229 -7.875 9.345 -4.291 1.00 20.00 C ATOM 1539 CD2 TYR B 229 -9.724 9.353 -5.873 1.00 19.06 C ATOM 1540 CE1 TYR B 229 -8.175 10.670 -3.933 1.00 22.03 C ATOM 1541 CE2 TYR B 229 -10.024 10.678 -5.515 1.00 20.67 C ATOM 1542 CZ TYR B 229 -9.249 11.337 -4.545 1.00 22.97 C ATOM 1543 OH TYR B 229 -9.545 12.639 -4.193 1.00 24.81 O ATOM 0 H TYR B 229 -7.766 5.236 -6.980 1.00 17.24 H new ATOM 0 HA TYR B 229 -7.343 8.002 -7.410 1.00 15.90 H new ATOM 0 HB2 TYR B 229 -9.201 6.788 -6.089 1.00 17.41 H new ATOM 0 HB3 TYR B 229 -8.066 6.685 -4.758 1.00 17.41 H new ATOM 0 HD1 TYR B 229 -7.049 8.833 -3.821 1.00 20.00 H new ATOM 0 HD2 TYR B 229 -10.319 8.847 -6.619 1.00 19.06 H new ATOM 0 HE1 TYR B 229 -7.580 11.176 -3.187 1.00 22.03 H new ATOM 0 HE2 TYR B 229 -10.850 11.190 -5.985 1.00 20.67 H new ATOM 0 HH TYR B 229 -8.776 13.214 -4.389 1.00 24.81 H new ATOM 1553 N TYR B 230 -5.399 6.689 -5.071 1.00 15.18 N ATOM 1554 CA TYR B 230 -4.136 6.950 -4.324 1.00 16.33 C ATOM 1555 C TYR B 230 -2.947 6.883 -5.288 1.00 16.83 C ATOM 1556 O TYR B 230 -1.845 7.288 -4.964 1.00 16.71 O ATOM 1557 CB TYR B 230 -3.965 5.891 -3.229 1.00 14.52 C ATOM 1558 CG TYR B 230 -4.797 6.265 -2.024 1.00 16.10 C ATOM 1559 CD1 TYR B 230 -6.113 6.735 -2.191 1.00 17.17 C ATOM 1560 CD2 TYR B 230 -4.257 6.139 -0.734 1.00 15.88 C ATOM 1561 CE1 TYR B 230 -6.884 7.078 -1.069 1.00 17.84 C ATOM 1562 CE2 TYR B 230 -5.029 6.483 0.389 1.00 17.12 C ATOM 1563 CZ TYR B 230 -6.343 6.953 0.222 1.00 17.32 C ATOM 1564 OH TYR B 230 -7.100 7.289 1.325 1.00 19.89 O ATOM 0 H TYR B 230 -5.841 5.791 -4.876 1.00 15.18 H new ATOM 0 HA TYR B 230 -4.180 7.940 -3.871 1.00 16.33 H new ATOM 0 HB2 TYR B 230 -4.269 4.914 -3.604 1.00 14.52 H new ATOM 0 HB3 TYR B 230 -2.915 5.811 -2.947 1.00 14.52 H new ATOM 0 HD1 TYR B 230 -6.530 6.832 -3.183 1.00 17.17 H new ATOM 0 HD2 TYR B 230 -3.248 5.777 -0.605 1.00 15.88 H new ATOM 0 HE1 TYR B 230 -7.894 7.438 -1.198 1.00 17.84 H new ATOM 0 HE2 TYR B 230 -4.612 6.386 1.381 1.00 17.12 H new ATOM 0 HH TYR B 230 -6.827 6.739 2.089 1.00 19.89 H new ATOM 1574 N SER B 231 -3.158 6.373 -6.471 1.00 17.92 N ATOM 1575 CA SER B 231 -2.042 6.279 -7.451 1.00 22.15 C ATOM 1576 C SER B 231 -1.726 7.669 -8.009 1.00 22.66 C ATOM 1577 O SER B 231 -0.641 7.921 -8.493 1.00 24.35 O ATOM 1578 CB SER B 231 -2.442 5.347 -8.594 1.00 21.66 C ATOM 1579 OG SER B 231 -2.052 4.018 -8.276 1.00 28.41 O ATOM 0 H SER B 231 -4.056 6.018 -6.800 1.00 17.92 H new ATOM 0 HA SER B 231 -1.158 5.882 -6.952 1.00 22.15 H new ATOM 0 HB2 SER B 231 -3.519 5.393 -8.756 1.00 21.66 H new ATOM 0 HB3 SER B 231 -1.966 5.666 -9.522 1.00 21.66 H new ATOM 0 HG SER B 231 -2.730 3.607 -7.700 1.00 28.41 H new ATOM 1585 N LYS B 232 -2.664 8.574 -7.947 1.00 24.70 N ATOM 1586 CA LYS B 232 -2.409 9.943 -8.477 1.00 27.78 C ATOM 1587 C LYS B 232 -2.869 10.992 -7.459 1.00 29.48 C ATOM 1588 O LYS B 232 -2.787 12.180 -7.702 1.00 31.78 O ATOM 1589 CB LYS B 232 -3.181 10.135 -9.778 1.00 28.95 C ATOM 1590 CG LYS B 232 -2.274 9.815 -10.969 1.00 35.04 C ATOM 1591 CD LYS B 232 -2.852 10.450 -12.236 1.00 42.20 C ATOM 1592 CE LYS B 232 -2.804 9.439 -13.383 1.00 46.43 C ATOM 1593 NZ LYS B 232 -4.162 8.863 -13.594 1.00 50.42 N ATOM 0 H LYS B 232 -3.593 8.425 -7.553 1.00 24.70 H new ATOM 0 HA LYS B 232 -1.341 10.061 -8.659 1.00 27.78 H new ATOM 0 HB2 LYS B 232 -4.057 9.486 -9.791 1.00 28.95 H new ATOM 0 HB3 LYS B 232 -3.543 11.161 -9.849 1.00 28.95 H new ATOM 0 HG2 LYS B 232 -1.268 10.194 -10.786 1.00 35.04 H new ATOM 0 HG3 LYS B 232 -2.190 8.736 -11.096 1.00 35.04 H new ATOM 0 HD2 LYS B 232 -3.880 10.767 -12.060 1.00 42.20 H new ATOM 0 HD3 LYS B 232 -2.284 11.342 -12.500 1.00 42.20 H new ATOM 0 HE2 LYS B 232 -2.457 9.924 -14.295 1.00 46.43 H new ATOM 0 HE3 LYS B 232 -2.092 8.646 -13.153 1.00 46.43 H new ATOM 0 HZ1 LYS B 232 -4.130 8.176 -14.374 1.00 50.42 H new ATOM 0 HZ2 LYS B 232 -4.476 8.386 -12.725 1.00 50.42 H new ATOM 0 HZ3 LYS B 232 -4.829 9.625 -13.831 1.00 50.42 H new ATOM 1607 N HIS B 233 -3.347 10.567 -6.322 1.00 31.24 N ATOM 1608 CA HIS B 233 -3.805 11.544 -5.295 1.00 31.51 C ATOM 1609 C HIS B 233 -3.217 11.165 -3.936 1.00 28.20 C ATOM 1610 O HIS B 233 -3.741 10.322 -3.237 1.00 29.72 O ATOM 1611 CB HIS B 233 -5.331 11.522 -5.206 1.00 33.74 C ATOM 1612 CG HIS B 233 -5.892 12.793 -5.783 1.00 39.30 C ATOM 1613 ND1 HIS B 233 -6.728 13.627 -5.058 1.00 40.06 N ATOM 1614 CD2 HIS B 233 -5.750 13.382 -7.015 1.00 39.81 C ATOM 1615 CE1 HIS B 233 -7.055 14.662 -5.852 1.00 41.81 C ATOM 1616 NE2 HIS B 233 -6.486 14.563 -7.056 1.00 42.50 N ATOM 0 H HIS B 233 -3.440 9.586 -6.060 1.00 31.24 H new ATOM 0 HA HIS B 233 -3.472 12.543 -5.576 1.00 31.51 H new ATOM 0 HB2 HIS B 233 -5.724 10.661 -5.747 1.00 33.74 H new ATOM 0 HB3 HIS B 233 -5.643 11.415 -4.167 1.00 33.74 H new ATOM 0 HD2 HIS B 233 -5.158 12.989 -7.828 1.00 39.81 H new ATOM 0 HE1 HIS B 233 -7.700 15.475 -5.552 1.00 41.81 H new ATOM 0 HE2 HIS B 233 -6.572 15.213 -7.838 1.00 42.50 H new ATOM 1624 N ALA B 234 -2.135 11.782 -3.555 1.00 24.22 N ATOM 1625 CA ALA B 234 -1.520 11.456 -2.239 1.00 22.83 C ATOM 1626 C ALA B 234 -2.370 12.067 -1.124 1.00 24.43 C ATOM 1627 O ALA B 234 -2.638 11.441 -0.117 1.00 23.70 O ATOM 1628 CB ALA B 234 -0.104 12.032 -2.177 1.00 19.43 C ATOM 0 H ALA B 234 -1.650 12.497 -4.097 1.00 24.22 H new ATOM 0 HA ALA B 234 -1.473 10.374 -2.115 1.00 22.83 H new ATOM 0 HB1 ALA B 234 0.344 11.792 -1.213 1.00 19.43 H new ATOM 0 HB2 ALA B 234 0.500 11.600 -2.975 1.00 19.43 H new ATOM 0 HB3 ALA B 234 -0.146 13.114 -2.299 1.00 19.43 H new ATOM 1634 N ASP B 235 -2.802 13.286 -1.299 1.00 27.21 N ATOM 1635 CA ASP B 235 -3.640 13.939 -0.256 1.00 29.29 C ATOM 1636 C ASP B 235 -2.942 13.839 1.101 1.00 28.86 C ATOM 1637 O ASP B 235 -3.568 13.914 2.139 1.00 29.80 O ATOM 1638 CB ASP B 235 -5.000 13.243 -0.185 1.00 35.17 C ATOM 1639 CG ASP B 235 -6.111 14.262 -0.443 1.00 40.61 C ATOM 1640 OD1 ASP B 235 -6.225 14.712 -1.571 1.00 46.14 O ATOM 1641 OD2 ASP B 235 -6.827 14.578 0.493 1.00 45.11 O ATOM 0 H ASP B 235 -2.610 13.858 -2.121 1.00 27.21 H new ATOM 0 HA ASP B 235 -3.782 14.989 -0.511 1.00 29.29 H new ATOM 0 HB2 ASP B 235 -5.049 12.442 -0.922 1.00 35.17 H new ATOM 0 HB3 ASP B 235 -5.134 12.783 0.794 1.00 35.17 H new ATOM 1646 N GLY B 236 -1.647 13.673 1.103 1.00 27.14 N ATOM 1647 CA GLY B 236 -0.911 13.573 2.395 1.00 25.64 C ATOM 1648 C GLY B 236 -0.293 12.180 2.533 1.00 24.14 C ATOM 1649 O GLY B 236 0.177 11.803 3.588 1.00 24.47 O ATOM 0 H GLY B 236 -1.068 13.602 0.266 1.00 27.14 H new ATOM 0 HA2 GLY B 236 -0.131 14.333 2.439 1.00 25.64 H new ATOM 0 HA3 GLY B 236 -1.590 13.764 3.226 1.00 25.64 H new ATOM 1653 N LEU B 237 -0.285 11.411 1.477 1.00 20.92 N ATOM 1654 CA LEU B 237 0.308 10.046 1.560 1.00 19.13 C ATOM 1655 C LEU B 237 1.830 10.152 1.525 1.00 18.42 C ATOM 1656 O LEU B 237 2.385 11.225 1.397 1.00 19.85 O ATOM 1657 CB LEU B 237 -0.167 9.201 0.377 1.00 19.72 C ATOM 1658 CG LEU B 237 -1.372 8.365 0.808 1.00 21.67 C ATOM 1659 CD1 LEU B 237 -2.407 8.332 -0.316 1.00 17.09 C ATOM 1660 CD2 LEU B 237 -0.914 6.939 1.121 1.00 22.76 C ATOM 0 H LEU B 237 -0.662 11.668 0.565 1.00 20.92 H new ATOM 0 HA LEU B 237 -0.007 9.574 2.490 1.00 19.13 H new ATOM 0 HB2 LEU B 237 -0.437 9.845 -0.460 1.00 19.72 H new ATOM 0 HB3 LEU B 237 0.637 8.551 0.033 1.00 19.72 H new ATOM 0 HG LEU B 237 -1.821 8.809 1.696 1.00 21.67 H new ATOM 0 HD11 LEU B 237 -3.264 7.735 -0.004 1.00 17.09 H new ATOM 0 HD12 LEU B 237 -2.734 9.347 -0.539 1.00 17.09 H new ATOM 0 HD13 LEU B 237 -1.962 7.890 -1.207 1.00 17.09 H new ATOM 0 HD21 LEU B 237 -1.772 6.341 1.429 1.00 22.76 H new ATOM 0 HD22 LEU B 237 -0.464 6.498 0.232 1.00 22.76 H new ATOM 0 HD23 LEU B 237 -0.180 6.961 1.926 1.00 22.76 H new ATOM 1672 N CYS B 238 2.508 9.045 1.635 1.00 18.29 N ATOM 1673 CA CYS B 238 3.992 9.080 1.606 1.00 17.21 C ATOM 1674 C CYS B 238 4.452 9.961 0.445 1.00 18.80 C ATOM 1675 O CYS B 238 5.340 10.778 0.593 1.00 19.09 O ATOM 1676 CB CYS B 238 4.532 7.661 1.415 1.00 17.49 C ATOM 1677 SG CYS B 238 3.549 6.805 0.159 1.00 18.25 S ATOM 0 H CYS B 238 2.097 8.118 1.744 1.00 18.29 H new ATOM 0 HA CYS B 238 4.367 9.487 2.545 1.00 17.21 H new ATOM 0 HB2 CYS B 238 5.578 7.696 1.111 1.00 17.49 H new ATOM 0 HB3 CYS B 238 4.492 7.115 2.358 1.00 17.49 H new ATOM 0 HG CYS B 238 2.761 5.947 0.735 1.00 18.25 H new ATOM 1683 N HIS B 239 3.846 9.809 -0.706 1.00 17.96 N ATOM 1684 CA HIS B 239 4.247 10.644 -1.879 1.00 18.41 C ATOM 1685 C HIS B 239 3.512 10.159 -3.133 1.00 18.79 C ATOM 1686 O HIS B 239 4.071 10.127 -4.210 1.00 19.28 O ATOM 1687 CB HIS B 239 5.757 10.514 -2.116 1.00 18.77 C ATOM 1688 CG HIS B 239 6.290 11.797 -2.694 1.00 18.40 C ATOM 1689 ND1 HIS B 239 5.925 12.255 -3.950 1.00 18.53 N ATOM 1690 CD2 HIS B 239 7.164 12.732 -2.194 1.00 19.51 C ATOM 1691 CE1 HIS B 239 6.571 13.416 -4.163 1.00 19.04 C ATOM 1692 NE2 HIS B 239 7.340 13.752 -3.124 1.00 20.02 N ATOM 0 H HIS B 239 3.093 9.144 -0.884 1.00 17.96 H new ATOM 0 HA HIS B 239 3.991 11.684 -1.675 1.00 18.41 H new ATOM 0 HB2 HIS B 239 6.264 10.288 -1.178 1.00 18.77 H new ATOM 0 HB3 HIS B 239 5.959 9.686 -2.795 1.00 18.77 H new ATOM 0 HD1 HIS B 239 5.283 11.795 -4.596 1.00 18.53 H new ATOM 0 HD2 HIS B 239 7.642 12.683 -1.227 1.00 19.51 H new ATOM 0 HE1 HIS B 239 6.479 14.004 -5.064 1.00 19.04 H new ATOM 1700 N ARG B 240 2.269 9.776 -3.008 1.00 19.17 N ATOM 1701 CA ARG B 240 1.523 9.292 -4.207 1.00 20.76 C ATOM 1702 C ARG B 240 2.208 8.039 -4.757 1.00 18.50 C ATOM 1703 O ARG B 240 3.418 7.925 -4.735 1.00 17.06 O ATOM 1704 CB ARG B 240 1.529 10.379 -5.279 1.00 25.30 C ATOM 1705 CG ARG B 240 0.668 9.935 -6.462 1.00 30.23 C ATOM 1706 CD ARG B 240 0.467 11.121 -7.400 1.00 37.22 C ATOM 1707 NE ARG B 240 0.800 10.718 -8.795 1.00 43.41 N ATOM 1708 CZ ARG B 240 1.357 11.576 -9.607 1.00 45.15 C ATOM 1709 NH1 ARG B 240 1.060 12.844 -9.520 1.00 46.15 N ATOM 1710 NH2 ARG B 240 2.209 11.165 -10.506 1.00 46.50 N ATOM 0 H ARG B 240 1.741 9.777 -2.135 1.00 19.17 H new ATOM 0 HA ARG B 240 0.496 9.057 -3.928 1.00 20.76 H new ATOM 0 HB2 ARG B 240 1.146 11.313 -4.867 1.00 25.30 H new ATOM 0 HB3 ARG B 240 2.549 10.572 -5.610 1.00 25.30 H new ATOM 0 HG2 ARG B 240 1.150 9.113 -6.992 1.00 30.23 H new ATOM 0 HG3 ARG B 240 -0.295 9.566 -6.110 1.00 30.23 H new ATOM 0 HD2 ARG B 240 -0.565 11.468 -7.348 1.00 37.22 H new ATOM 0 HD3 ARG B 240 1.099 11.953 -7.091 1.00 37.22 H new ATOM 0 HE ARG B 240 0.593 9.772 -9.116 1.00 43.41 H new ATOM 0 HH11 ARG B 240 0.393 13.165 -8.818 1.00 46.15 H new ATOM 0 HH12 ARG B 240 1.495 13.514 -10.154 1.00 46.15 H new ATOM 0 HH21 ARG B 240 2.440 10.174 -10.574 1.00 46.50 H new ATOM 0 HH22 ARG B 240 2.644 11.835 -11.140 1.00 46.50 H new ATOM 1724 N LEU B 241 1.456 7.096 -5.255 1.00 16.42 N ATOM 1725 CA LEU B 241 2.094 5.865 -5.805 1.00 16.95 C ATOM 1726 C LEU B 241 2.807 6.212 -7.113 1.00 18.53 C ATOM 1727 O LEU B 241 2.340 7.023 -7.888 1.00 19.32 O ATOM 1728 CB LEU B 241 1.028 4.802 -6.073 1.00 12.02 C ATOM 1729 CG LEU B 241 0.062 4.733 -4.889 1.00 10.93 C ATOM 1730 CD1 LEU B 241 -0.883 3.542 -5.067 1.00 7.07 C ATOM 1731 CD2 LEU B 241 0.857 4.561 -3.592 1.00 9.30 C ATOM 0 H LEU B 241 0.438 7.123 -5.305 1.00 16.42 H new ATOM 0 HA LEU B 241 2.812 5.476 -5.083 1.00 16.95 H new ATOM 0 HB2 LEU B 241 0.483 5.041 -6.986 1.00 12.02 H new ATOM 0 HB3 LEU B 241 1.499 3.831 -6.228 1.00 12.02 H new ATOM 0 HG LEU B 241 -0.519 5.654 -4.842 1.00 10.93 H new ATOM 0 HD11 LEU B 241 -1.571 3.494 -4.223 1.00 7.07 H new ATOM 0 HD12 LEU B 241 -1.450 3.662 -5.990 1.00 7.07 H new ATOM 0 HD13 LEU B 241 -0.302 2.621 -5.115 1.00 7.07 H new ATOM 0 HD21 LEU B 241 0.169 4.512 -2.748 1.00 9.30 H new ATOM 0 HD22 LEU B 241 1.438 3.640 -3.641 1.00 9.30 H new ATOM 0 HD23 LEU B 241 1.530 5.408 -3.463 1.00 9.30 H new ATOM 1743 N THR B 242 3.934 5.606 -7.366 1.00 20.81 N ATOM 1744 CA THR B 242 4.673 5.909 -8.625 1.00 20.89 C ATOM 1745 C THR B 242 5.053 4.602 -9.325 1.00 21.74 C ATOM 1746 O THR B 242 5.008 4.499 -10.535 1.00 24.76 O ATOM 1747 CB THR B 242 5.943 6.697 -8.293 1.00 20.18 C ATOM 1748 OG1 THR B 242 6.883 5.834 -7.670 1.00 22.88 O ATOM 1749 CG2 THR B 242 5.600 7.848 -7.347 1.00 19.22 C ATOM 0 H THR B 242 4.375 4.916 -6.758 1.00 20.81 H new ATOM 0 HA THR B 242 4.038 6.501 -9.284 1.00 20.89 H new ATOM 0 HB THR B 242 6.371 7.100 -9.211 1.00 20.18 H new ATOM 0 HG1 THR B 242 7.736 6.304 -7.559 1.00 22.88 H new ATOM 0 HG21 THR B 242 6.505 8.408 -7.112 1.00 19.22 H new ATOM 0 HG22 THR B 242 4.878 8.510 -7.826 1.00 19.22 H new ATOM 0 HG23 THR B 242 5.172 7.448 -6.428 1.00 19.22 H new ATOM 1757 N THR B 243 5.429 3.602 -8.575 1.00 20.71 N ATOM 1758 CA THR B 243 5.812 2.306 -9.204 1.00 18.86 C ATOM 1759 C THR B 243 5.389 1.150 -8.295 1.00 18.56 C ATOM 1760 O THR B 243 5.050 1.344 -7.144 1.00 18.28 O ATOM 1761 CB THR B 243 7.328 2.266 -9.405 1.00 20.42 C ATOM 1762 OG1 THR B 243 7.747 3.451 -10.067 1.00 20.70 O ATOM 1763 CG2 THR B 243 7.701 1.048 -10.251 1.00 16.38 C ATOM 0 H THR B 243 5.487 3.626 -7.557 1.00 20.71 H new ATOM 0 HA THR B 243 5.313 2.210 -10.168 1.00 18.86 H new ATOM 0 HB THR B 243 7.822 2.196 -8.436 1.00 20.42 H new ATOM 0 HG1 THR B 243 8.718 3.428 -10.195 1.00 20.70 H new ATOM 0 HG21 THR B 243 8.781 1.021 -10.393 1.00 16.38 H new ATOM 0 HG22 THR B 243 7.379 0.139 -9.742 1.00 16.38 H new ATOM 0 HG23 THR B 243 7.209 1.114 -11.221 1.00 16.38 H new ATOM 1771 N VAL B 244 5.410 -0.052 -8.802 1.00 16.29 N ATOM 1772 CA VAL B 244 5.014 -1.221 -7.968 1.00 16.81 C ATOM 1773 C VAL B 244 6.267 -1.999 -7.559 1.00 16.74 C ATOM 1774 O VAL B 244 7.350 -1.750 -8.053 1.00 17.40 O ATOM 1775 CB VAL B 244 4.089 -2.133 -8.776 1.00 17.29 C ATOM 1776 CG1 VAL B 244 3.307 -3.041 -7.825 1.00 17.99 C ATOM 1777 CG2 VAL B 244 3.109 -1.277 -9.583 1.00 17.19 C ATOM 0 H VAL B 244 5.685 -0.275 -9.759 1.00 16.29 H new ATOM 0 HA VAL B 244 4.493 -0.874 -7.076 1.00 16.81 H new ATOM 0 HB VAL B 244 4.684 -2.745 -9.454 1.00 17.29 H new ATOM 0 HG11 VAL B 244 2.648 -3.690 -8.401 1.00 17.99 H new ATOM 0 HG12 VAL B 244 4.003 -3.650 -7.249 1.00 17.99 H new ATOM 0 HG13 VAL B 244 2.711 -2.430 -7.146 1.00 17.99 H new ATOM 0 HG21 VAL B 244 2.449 -1.925 -10.159 1.00 17.19 H new ATOM 0 HG22 VAL B 244 2.515 -0.666 -8.904 1.00 17.19 H new ATOM 0 HG23 VAL B 244 3.665 -0.629 -10.261 1.00 17.19 H new ATOM 1787 N CYS B 245 6.132 -2.937 -6.663 1.00 15.40 N ATOM 1788 CA CYS B 245 7.320 -3.724 -6.229 1.00 16.70 C ATOM 1789 C CYS B 245 7.675 -4.750 -7.312 1.00 16.64 C ATOM 1790 O CYS B 245 6.803 -5.253 -7.992 1.00 17.47 O ATOM 1791 CB CYS B 245 6.999 -4.453 -4.922 1.00 15.93 C ATOM 1792 SG CYS B 245 7.541 -3.446 -3.520 1.00 18.24 S ATOM 0 H CYS B 245 5.253 -3.192 -6.213 1.00 15.40 H new ATOM 0 HA CYS B 245 8.164 -3.052 -6.073 1.00 16.70 H new ATOM 0 HB2 CYS B 245 5.928 -4.644 -4.853 1.00 15.93 H new ATOM 0 HB3 CYS B 245 7.498 -5.422 -4.902 1.00 15.93 H new ATOM 0 HG CYS B 245 6.631 -2.559 -3.245 1.00 18.24 H new ATOM 1798 N PRO B 246 8.950 -5.031 -7.443 1.00 18.63 N ATOM 1799 CA PRO B 246 9.449 -5.996 -8.439 1.00 19.52 C ATOM 1800 C PRO B 246 9.222 -7.430 -7.952 1.00 19.33 C ATOM 1801 O PRO B 246 10.167 -8.025 -7.461 1.00 19.97 O ATOM 1802 CB PRO B 246 10.945 -5.680 -8.529 1.00 18.97 C ATOM 1803 CG PRO B 246 11.321 -4.969 -7.207 1.00 18.88 C ATOM 1804 CD PRO B 246 10.011 -4.417 -6.614 1.00 17.74 C ATOM 1805 OXT PRO B 246 8.107 -7.907 -8.079 1.00 0.00 O ATOM 0 HA PRO B 246 8.944 -5.918 -9.402 1.00 19.52 H new ATOM 0 HB2 PRO B 246 11.528 -6.592 -8.659 1.00 18.97 H new ATOM 0 HB3 PRO B 246 11.156 -5.042 -9.387 1.00 18.97 H new ATOM 0 HG2 PRO B 246 11.796 -5.664 -6.515 1.00 18.88 H new ATOM 0 HG3 PRO B 246 12.033 -4.164 -7.389 1.00 18.88 H new ATOM 0 HD2 PRO B 246 9.903 -4.689 -5.564 1.00 17.74 H new ATOM 0 HD3 PRO B 246 9.978 -3.329 -6.666 1.00 17.74 H new TER 1813 PRO B 246