USER MOD reduce.3.24.130724 H: found=0, std=0, add=708, rem=0, adj=23 USER MOD reduce.3.24.130724 removed 709 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 4 THR OG1 : rot 83:sc= 1.77 USER MOD Set 1.2: A 14 LYS NZ :NH3+ 179:sc= 0.951 (180deg=0) USER MOD Set 2.1: A 10 GLN : amide:sc= 0.675 K(o=1.4,f=-0.029) USER MOD Set 2.2: B 289 TYR OH : rot -171:sc= 0.72 USER MOD Single : A 1 MET CE :methyl 173:sc= -0.387 (180deg=-0.587) USER MOD Single : A 1 MET N :NH3+ -170:sc= 2.07 (180deg=1.93) USER MOD Single : A 2 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 6 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 7 THR OG1 : rot 180:sc= 0.308 USER MOD Single : A 9 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 11 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 12 THR OG1 : rot 180:sc= 0 USER MOD Single : A 22 THR OG1 : rot 180:sc= 0 USER MOD Single : A 24 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 27 LYS NZ :NH3+ 158:sc= 2.24 (180deg=1.91) USER MOD Single : A 29 LYS NZ :NH3+ -177:sc= 1.23 (180deg=1.2) USER MOD Single : A 32 SER OG : rot 75:sc= 0.897 USER MOD Single : A 34 LYS NZ :NH3+ -117:sc= 0.867 (180deg=0.0553) USER MOD Single : A 36 LYS NZ :NH3+ -173:sc= 1.24 (180deg=1.19) USER MOD Single : A 44 GLN : amide:sc= 1.02 K(o=1,f=-2.7!) USER MOD Single : A 45 LYS NZ :NH3+ -161:sc= 1.27 (180deg=0.937) USER MOD Single : A 48 TYR OH : rot 180:sc= 0 USER MOD Single : A 51 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 54 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 57 THR OG1 : rot -170:sc= 0 USER MOD Single : A 60 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 62 TYR OH : rot 151:sc= 0.353 USER MOD Single : A 63 LYS NZ :NH3+ -156:sc= 1.2 (180deg=0.805) USER MOD Single : A 67 LYS NZ :NH3+ 173:sc= 0.732 (180deg=0.56) USER MOD Single : A 68 ASN : amide:sc= 1.08 K(o=1.1,f=0) USER MOD Single : A 73 MET CE :methyl -167:sc= -0.721 (180deg=-0.775) USER MOD Single : B 286 GLN : amide:sc= 0 X(o=0,f=-0.029) USER MOD Single : B 291 MET CE :methyl 168:sc= 0 (180deg=-0.136) USER MOD Single : B 292 GLN : amide:sc= 0.607 K(o=0.61,f=-0.0048) USER MOD Single : B 293 MET CE :methyl -142:sc= -0.107 (180deg=-0.471) USER MOD Single : B 294 SER OG : rot -35:sc= 1.52 USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 3.481 2.891 6.537 1.00 0.00 N ATOM 2 CA MET A 1 3.501 2.425 5.129 1.00 0.00 C ATOM 3 C MET A 1 3.875 0.955 5.069 1.00 0.00 C ATOM 4 O MET A 1 4.858 0.532 5.671 1.00 0.00 O ATOM 5 CB MET A 1 4.405 3.261 4.202 1.00 0.00 C ATOM 6 CG MET A 1 5.901 3.274 4.524 1.00 0.00 C ATOM 7 SD MET A 1 6.850 4.249 3.323 1.00 0.00 S ATOM 8 CE MET A 1 7.763 2.936 2.481 1.00 0.00 C ATOM 0 H1 MET A 1 3.063 3.842 6.582 1.00 0.00 H new ATOM 0 H2 MET A 1 2.913 2.236 7.111 1.00 0.00 H new ATOM 0 H3 MET A 1 4.453 2.922 6.906 1.00 0.00 H new ATOM 0 HA MET A 1 2.489 2.563 4.748 1.00 0.00 H new ATOM 0 HB2 MET A 1 4.280 2.893 3.184 1.00 0.00 H new ATOM 0 HB3 MET A 1 4.046 4.290 4.215 1.00 0.00 H new ATOM 0 HG2 MET A 1 6.053 3.683 5.523 1.00 0.00 H new ATOM 0 HG3 MET A 1 6.277 2.251 4.538 1.00 0.00 H new ATOM 0 HE1 MET A 1 8.301 3.355 1.630 1.00 0.00 H new ATOM 0 HE2 MET A 1 8.474 2.485 3.174 1.00 0.00 H new ATOM 0 HE3 MET A 1 7.066 2.175 2.131 1.00 0.00 H new ATOM 20 N GLN A 2 3.088 0.156 4.357 1.00 0.00 N ATOM 21 CA GLN A 2 3.237 -1.297 4.292 1.00 0.00 C ATOM 22 C GLN A 2 4.215 -1.704 3.181 1.00 0.00 C ATOM 23 O GLN A 2 3.812 -2.085 2.082 1.00 0.00 O ATOM 24 CB GLN A 2 1.874 -1.999 4.194 1.00 0.00 C ATOM 25 CG GLN A 2 0.824 -1.467 5.182 1.00 0.00 C ATOM 26 CD GLN A 2 -0.431 -2.336 5.194 1.00 0.00 C ATOM 27 OE1 GLN A 2 -0.660 -3.137 6.092 1.00 0.00 O ATOM 28 NE2 GLN A 2 -1.292 -2.224 4.204 1.00 0.00 N ATOM 0 H GLN A 2 2.311 0.506 3.796 1.00 0.00 H new ATOM 0 HA GLN A 2 3.680 -1.639 5.227 1.00 0.00 H new ATOM 0 HB2 GLN A 2 1.492 -1.888 3.179 1.00 0.00 H new ATOM 0 HB3 GLN A 2 2.013 -3.066 4.367 1.00 0.00 H new ATOM 0 HG2 GLN A 2 1.252 -1.432 6.184 1.00 0.00 H new ATOM 0 HG3 GLN A 2 0.556 -0.445 4.914 1.00 0.00 H new ATOM 0 HE21 GLN A 2 -1.117 -1.562 3.448 1.00 0.00 H new ATOM 0 HE22 GLN A 2 -2.134 -2.799 4.193 1.00 0.00 H new ATOM 37 N VAL A 3 5.516 -1.612 3.468 1.00 0.00 N ATOM 38 CA VAL A 3 6.590 -2.093 2.583 1.00 0.00 C ATOM 39 C VAL A 3 6.438 -3.600 2.378 1.00 0.00 C ATOM 40 O VAL A 3 6.425 -4.368 3.345 1.00 0.00 O ATOM 41 CB VAL A 3 7.987 -1.765 3.150 1.00 0.00 C ATOM 42 CG1 VAL A 3 9.116 -2.291 2.253 1.00 0.00 C ATOM 43 CG2 VAL A 3 8.189 -0.252 3.236 1.00 0.00 C ATOM 0 H VAL A 3 5.862 -1.196 4.333 1.00 0.00 H new ATOM 0 HA VAL A 3 6.502 -1.580 1.625 1.00 0.00 H new ATOM 0 HB VAL A 3 8.028 -2.240 4.130 1.00 0.00 H new ATOM 0 HG11 VAL A 3 10.080 -2.036 2.694 1.00 0.00 H new ATOM 0 HG12 VAL A 3 9.034 -3.374 2.162 1.00 0.00 H new ATOM 0 HG13 VAL A 3 9.037 -1.837 1.265 1.00 0.00 H new ATOM 0 HG21 VAL A 3 9.180 -0.039 3.638 1.00 0.00 H new ATOM 0 HG22 VAL A 3 8.100 0.184 2.241 1.00 0.00 H new ATOM 0 HG23 VAL A 3 7.432 0.180 3.890 1.00 0.00 H new ATOM 53 N THR A 4 6.338 -4.033 1.122 1.00 0.00 N ATOM 54 CA THR A 4 6.384 -5.459 0.785 1.00 0.00 C ATOM 55 C THR A 4 7.825 -5.943 0.785 1.00 0.00 C ATOM 56 O THR A 4 8.719 -5.277 0.260 1.00 0.00 O ATOM 57 CB THR A 4 5.824 -5.733 -0.609 1.00 0.00 C ATOM 58 OG1 THR A 4 4.473 -5.339 -0.692 1.00 0.00 O ATOM 59 CG2 THR A 4 5.872 -7.219 -0.956 1.00 0.00 C ATOM 0 H THR A 4 6.224 -3.416 0.317 1.00 0.00 H new ATOM 0 HA THR A 4 5.783 -5.978 1.532 1.00 0.00 H new ATOM 0 HB THR A 4 6.444 -5.164 -1.302 1.00 0.00 H new ATOM 0 HG1 THR A 4 4.423 -4.378 -0.878 1.00 0.00 H new ATOM 0 HG21 THR A 4 5.465 -7.373 -1.955 1.00 0.00 H new ATOM 0 HG22 THR A 4 6.905 -7.566 -0.928 1.00 0.00 H new ATOM 0 HG23 THR A 4 5.281 -7.781 -0.233 1.00 0.00 H new ATOM 67 N LEU A 5 8.035 -7.142 1.317 1.00 0.00 N ATOM 68 CA LEU A 5 9.319 -7.821 1.395 1.00 0.00 C ATOM 69 C LEU A 5 9.316 -9.111 0.582 1.00 0.00 C ATOM 70 O LEU A 5 8.281 -9.765 0.431 1.00 0.00 O ATOM 71 CB LEU A 5 9.627 -8.145 2.866 1.00 0.00 C ATOM 72 CG LEU A 5 9.437 -6.979 3.848 1.00 0.00 C ATOM 73 CD1 LEU A 5 9.932 -7.426 5.215 1.00 0.00 C ATOM 74 CD2 LEU A 5 10.209 -5.738 3.432 1.00 0.00 C ATOM 0 H LEU A 5 7.278 -7.691 1.724 1.00 0.00 H new ATOM 0 HA LEU A 5 10.083 -7.162 0.982 1.00 0.00 H new ATOM 0 HB2 LEU A 5 8.989 -8.971 3.180 1.00 0.00 H new ATOM 0 HB3 LEU A 5 10.657 -8.494 2.936 1.00 0.00 H new ATOM 0 HG LEU A 5 8.379 -6.718 3.864 1.00 0.00 H new ATOM 0 HD11 LEU A 5 9.807 -6.613 5.931 1.00 0.00 H new ATOM 0 HD12 LEU A 5 9.357 -8.292 5.545 1.00 0.00 H new ATOM 0 HD13 LEU A 5 10.987 -7.694 5.150 1.00 0.00 H new ATOM 0 HD21 LEU A 5 10.041 -4.944 4.159 1.00 0.00 H new ATOM 0 HD22 LEU A 5 11.273 -5.969 3.387 1.00 0.00 H new ATOM 0 HD23 LEU A 5 9.868 -5.409 2.450 1.00 0.00 H new ATOM 86 N LYS A 6 10.510 -9.504 0.146 1.00 0.00 N ATOM 87 CA LYS A 6 10.822 -10.799 -0.465 1.00 0.00 C ATOM 88 C LYS A 6 12.097 -11.375 0.153 1.00 0.00 C ATOM 89 O LYS A 6 13.090 -10.661 0.301 1.00 0.00 O ATOM 90 CB LYS A 6 10.887 -10.657 -1.992 1.00 0.00 C ATOM 91 CG LYS A 6 10.988 -12.037 -2.656 1.00 0.00 C ATOM 92 CD LYS A 6 10.446 -12.019 -4.088 1.00 0.00 C ATOM 93 CE LYS A 6 10.339 -13.467 -4.568 1.00 0.00 C ATOM 94 NZ LYS A 6 9.701 -13.562 -5.907 1.00 0.00 N ATOM 0 H LYS A 6 11.329 -8.900 0.211 1.00 0.00 H new ATOM 0 HA LYS A 6 10.028 -11.517 -0.257 1.00 0.00 H new ATOM 0 HB2 LYS A 6 10.000 -10.137 -2.353 1.00 0.00 H new ATOM 0 HB3 LYS A 6 11.748 -10.049 -2.270 1.00 0.00 H new ATOM 0 HG2 LYS A 6 12.029 -12.361 -2.665 1.00 0.00 H new ATOM 0 HG3 LYS A 6 10.432 -12.766 -2.066 1.00 0.00 H new ATOM 0 HD2 LYS A 6 9.471 -11.533 -4.121 1.00 0.00 H new ATOM 0 HD3 LYS A 6 11.108 -11.449 -4.740 1.00 0.00 H new ATOM 0 HE2 LYS A 6 11.334 -13.911 -4.608 1.00 0.00 H new ATOM 0 HE3 LYS A 6 9.760 -14.046 -3.848 1.00 0.00 H new ATOM 0 HZ1 LYS A 6 9.647 -14.560 -6.196 1.00 0.00 H new ATOM 0 HZ2 LYS A 6 8.742 -13.162 -5.864 1.00 0.00 H new ATOM 0 HZ3 LYS A 6 10.267 -13.031 -6.600 1.00 0.00 H new ATOM 108 N THR A 7 12.048 -12.638 0.570 1.00 0.00 N ATOM 109 CA THR A 7 13.164 -13.357 1.208 1.00 0.00 C ATOM 110 C THR A 7 14.080 -14.018 0.169 1.00 0.00 C ATOM 111 O THR A 7 13.721 -14.151 -1.005 1.00 0.00 O ATOM 112 CB THR A 7 12.656 -14.419 2.203 1.00 0.00 C ATOM 113 OG1 THR A 7 12.190 -15.569 1.527 1.00 0.00 O ATOM 114 CG2 THR A 7 11.513 -13.938 3.100 1.00 0.00 C ATOM 0 H THR A 7 11.210 -13.212 0.474 1.00 0.00 H new ATOM 0 HA THR A 7 13.742 -12.613 1.756 1.00 0.00 H new ATOM 0 HB THR A 7 13.522 -14.639 2.827 1.00 0.00 H new ATOM 0 HG1 THR A 7 11.875 -16.228 2.181 1.00 0.00 H new ATOM 0 HG21 THR A 7 11.213 -14.743 3.771 1.00 0.00 H new ATOM 0 HG22 THR A 7 11.847 -13.082 3.687 1.00 0.00 H new ATOM 0 HG23 THR A 7 10.664 -13.645 2.482 1.00 0.00 H new ATOM 122 N LEU A 8 15.250 -14.513 0.594 1.00 0.00 N ATOM 123 CA LEU A 8 16.130 -15.330 -0.259 1.00 0.00 C ATOM 124 C LEU A 8 15.565 -16.733 -0.556 1.00 0.00 C ATOM 125 O LEU A 8 15.943 -17.358 -1.548 1.00 0.00 O ATOM 126 CB LEU A 8 17.546 -15.378 0.337 1.00 0.00 C ATOM 127 CG LEU A 8 18.196 -13.992 0.524 1.00 0.00 C ATOM 128 CD1 LEU A 8 19.672 -14.118 0.883 1.00 0.00 C ATOM 129 CD2 LEU A 8 18.165 -13.133 -0.732 1.00 0.00 C ATOM 0 H LEU A 8 15.614 -14.360 1.535 1.00 0.00 H new ATOM 0 HA LEU A 8 16.184 -14.843 -1.233 1.00 0.00 H new ATOM 0 HB2 LEU A 8 17.506 -15.882 1.303 1.00 0.00 H new ATOM 0 HB3 LEU A 8 18.182 -15.981 -0.311 1.00 0.00 H new ATOM 0 HG LEU A 8 17.609 -13.527 1.316 1.00 0.00 H new ATOM 0 HD11 LEU A 8 20.102 -13.124 1.008 1.00 0.00 H new ATOM 0 HD12 LEU A 8 19.774 -14.677 1.813 1.00 0.00 H new ATOM 0 HD13 LEU A 8 20.197 -14.643 0.085 1.00 0.00 H new ATOM 0 HD21 LEU A 8 18.639 -12.173 -0.528 1.00 0.00 H new ATOM 0 HD22 LEU A 8 18.703 -13.640 -1.533 1.00 0.00 H new ATOM 0 HD23 LEU A 8 17.131 -12.970 -1.036 1.00 0.00 H new ATOM 141 N GLN A 9 14.603 -17.198 0.247 1.00 0.00 N ATOM 142 CA GLN A 9 13.794 -18.400 -0.005 1.00 0.00 C ATOM 143 C GLN A 9 12.616 -18.108 -0.970 1.00 0.00 C ATOM 144 O GLN A 9 11.782 -18.980 -1.221 1.00 0.00 O ATOM 145 CB GLN A 9 13.299 -18.974 1.336 1.00 0.00 C ATOM 146 CG GLN A 9 14.454 -19.475 2.221 1.00 0.00 C ATOM 147 CD GLN A 9 13.951 -20.064 3.537 1.00 0.00 C ATOM 148 OE1 GLN A 9 14.051 -19.465 4.601 1.00 0.00 O ATOM 149 NE2 GLN A 9 13.407 -21.264 3.531 1.00 0.00 N ATOM 0 H GLN A 9 14.356 -16.734 1.121 1.00 0.00 H new ATOM 0 HA GLN A 9 14.419 -19.145 -0.499 1.00 0.00 H new ATOM 0 HB2 GLN A 9 12.740 -18.207 1.872 1.00 0.00 H new ATOM 0 HB3 GLN A 9 12.609 -19.796 1.144 1.00 0.00 H new ATOM 0 HG2 GLN A 9 15.024 -20.230 1.680 1.00 0.00 H new ATOM 0 HG3 GLN A 9 15.135 -18.650 2.430 1.00 0.00 H new ATOM 0 HE21 GLN A 9 13.315 -21.778 2.655 1.00 0.00 H new ATOM 0 HE22 GLN A 9 13.078 -21.679 4.403 1.00 0.00 H new ATOM 158 N GLN A 10 12.546 -16.886 -1.519 1.00 0.00 N ATOM 159 CA GLN A 10 11.500 -16.349 -2.401 1.00 0.00 C ATOM 160 C GLN A 10 10.085 -16.349 -1.787 1.00 0.00 C ATOM 161 O GLN A 10 9.083 -16.381 -2.505 1.00 0.00 O ATOM 162 CB GLN A 10 11.582 -16.970 -3.812 1.00 0.00 C ATOM 163 CG GLN A 10 12.934 -16.685 -4.491 1.00 0.00 C ATOM 164 CD GLN A 10 12.979 -17.100 -5.964 1.00 0.00 C ATOM 165 OE1 GLN A 10 11.975 -17.203 -6.660 1.00 0.00 O ATOM 166 NE2 GLN A 10 14.152 -17.335 -6.510 1.00 0.00 N ATOM 0 H GLN A 10 13.275 -16.195 -1.344 1.00 0.00 H new ATOM 0 HA GLN A 10 11.711 -15.286 -2.518 1.00 0.00 H new ATOM 0 HB2 GLN A 10 11.431 -18.047 -3.743 1.00 0.00 H new ATOM 0 HB3 GLN A 10 10.776 -16.574 -4.430 1.00 0.00 H new ATOM 0 HG2 GLN A 10 13.152 -15.620 -4.415 1.00 0.00 H new ATOM 0 HG3 GLN A 10 13.721 -17.210 -3.950 1.00 0.00 H new ATOM 0 HE21 GLN A 10 15.001 -17.255 -5.950 1.00 0.00 H new ATOM 0 HE22 GLN A 10 14.213 -17.597 -7.494 1.00 0.00 H new ATOM 175 N GLN A 11 9.995 -16.241 -0.458 1.00 0.00 N ATOM 176 CA GLN A 11 8.736 -16.007 0.261 1.00 0.00 C ATOM 177 C GLN A 11 8.470 -14.497 0.323 1.00 0.00 C ATOM 178 O GLN A 11 9.412 -13.707 0.271 1.00 0.00 O ATOM 179 CB GLN A 11 8.813 -16.596 1.678 1.00 0.00 C ATOM 180 CG GLN A 11 9.079 -18.108 1.683 1.00 0.00 C ATOM 181 CD GLN A 11 9.128 -18.662 3.105 1.00 0.00 C ATOM 182 OE1 GLN A 11 10.175 -18.744 3.735 1.00 0.00 O ATOM 183 NE2 GLN A 11 8.008 -19.060 3.673 1.00 0.00 N ATOM 0 H GLN A 11 10.805 -16.314 0.158 1.00 0.00 H new ATOM 0 HA GLN A 11 7.918 -16.499 -0.266 1.00 0.00 H new ATOM 0 HB2 GLN A 11 9.604 -16.091 2.233 1.00 0.00 H new ATOM 0 HB3 GLN A 11 7.878 -16.395 2.201 1.00 0.00 H new ATOM 0 HG2 GLN A 11 8.298 -18.618 1.119 1.00 0.00 H new ATOM 0 HG3 GLN A 11 10.023 -18.314 1.178 1.00 0.00 H new ATOM 0 HE21 GLN A 11 7.127 -18.998 3.162 1.00 0.00 H new ATOM 0 HE22 GLN A 11 8.022 -19.430 4.624 1.00 0.00 H new ATOM 192 N THR A 12 7.209 -14.073 0.428 1.00 0.00 N ATOM 193 CA THR A 12 6.833 -12.647 0.409 1.00 0.00 C ATOM 194 C THR A 12 5.845 -12.282 1.518 1.00 0.00 C ATOM 195 O THR A 12 4.927 -13.044 1.834 1.00 0.00 O ATOM 196 CB THR A 12 6.291 -12.205 -0.965 1.00 0.00 C ATOM 197 OG1 THR A 12 5.279 -13.077 -1.437 1.00 0.00 O ATOM 198 CG2 THR A 12 7.384 -12.158 -2.038 1.00 0.00 C ATOM 0 H THR A 12 6.415 -14.705 0.529 1.00 0.00 H new ATOM 0 HA THR A 12 7.755 -12.098 0.599 1.00 0.00 H new ATOM 0 HB THR A 12 5.889 -11.205 -0.802 1.00 0.00 H new ATOM 0 HG1 THR A 12 4.958 -12.765 -2.309 1.00 0.00 H new ATOM 0 HG21 THR A 12 6.950 -11.841 -2.986 1.00 0.00 H new ATOM 0 HG22 THR A 12 8.157 -11.451 -1.739 1.00 0.00 H new ATOM 0 HG23 THR A 12 7.823 -13.149 -2.153 1.00 0.00 H new ATOM 206 N PHE A 13 6.044 -11.102 2.110 1.00 0.00 N ATOM 207 CA PHE A 13 5.334 -10.582 3.290 1.00 0.00 C ATOM 208 C PHE A 13 5.139 -9.058 3.183 1.00 0.00 C ATOM 209 O PHE A 13 5.739 -8.420 2.318 1.00 0.00 O ATOM 210 CB PHE A 13 6.152 -10.916 4.553 1.00 0.00 C ATOM 211 CG PHE A 13 6.453 -12.391 4.767 1.00 0.00 C ATOM 212 CD1 PHE A 13 5.523 -13.211 5.435 1.00 0.00 C ATOM 213 CD2 PHE A 13 7.658 -12.947 4.293 1.00 0.00 C ATOM 214 CE1 PHE A 13 5.792 -14.579 5.621 1.00 0.00 C ATOM 215 CE2 PHE A 13 7.923 -14.316 4.474 1.00 0.00 C ATOM 216 CZ PHE A 13 6.990 -15.134 5.136 1.00 0.00 C ATOM 0 H PHE A 13 6.742 -10.445 1.763 1.00 0.00 H new ATOM 0 HA PHE A 13 4.350 -11.048 3.347 1.00 0.00 H new ATOM 0 HB2 PHE A 13 7.096 -10.373 4.507 1.00 0.00 H new ATOM 0 HB3 PHE A 13 5.612 -10.543 5.423 1.00 0.00 H new ATOM 0 HD1 PHE A 13 4.601 -12.788 5.805 1.00 0.00 H new ATOM 0 HD2 PHE A 13 8.379 -12.320 3.790 1.00 0.00 H new ATOM 0 HE1 PHE A 13 5.078 -15.204 6.137 1.00 0.00 H new ATOM 0 HE2 PHE A 13 8.845 -14.740 4.104 1.00 0.00 H new ATOM 0 HZ PHE A 13 7.193 -16.186 5.272 1.00 0.00 H new ATOM 226 N LYS A 14 4.363 -8.445 4.086 1.00 0.00 N ATOM 227 CA LYS A 14 4.256 -6.980 4.242 1.00 0.00 C ATOM 228 C LYS A 14 4.546 -6.549 5.681 1.00 0.00 C ATOM 229 O LYS A 14 4.156 -7.231 6.630 1.00 0.00 O ATOM 230 CB LYS A 14 2.867 -6.490 3.799 1.00 0.00 C ATOM 231 CG LYS A 14 2.642 -6.668 2.291 1.00 0.00 C ATOM 232 CD LYS A 14 1.240 -6.196 1.890 1.00 0.00 C ATOM 233 CE LYS A 14 0.938 -6.546 0.428 1.00 0.00 C ATOM 234 NZ LYS A 14 1.658 -5.664 -0.528 1.00 0.00 N ATOM 0 H LYS A 14 3.778 -8.960 4.744 1.00 0.00 H new ATOM 0 HA LYS A 14 5.008 -6.521 3.600 1.00 0.00 H new ATOM 0 HB2 LYS A 14 2.099 -7.037 4.346 1.00 0.00 H new ATOM 0 HB3 LYS A 14 2.755 -5.438 4.059 1.00 0.00 H new ATOM 0 HG2 LYS A 14 3.393 -6.104 1.738 1.00 0.00 H new ATOM 0 HG3 LYS A 14 2.769 -7.716 2.021 1.00 0.00 H new ATOM 0 HD2 LYS A 14 0.497 -6.659 2.539 1.00 0.00 H new ATOM 0 HD3 LYS A 14 1.161 -5.118 2.033 1.00 0.00 H new ATOM 0 HE2 LYS A 14 1.216 -7.583 0.241 1.00 0.00 H new ATOM 0 HE3 LYS A 14 -0.135 -6.467 0.253 1.00 0.00 H new ATOM 0 HZ1 LYS A 14 1.434 -5.952 -1.502 1.00 0.00 H new ATOM 0 HZ2 LYS A 14 1.362 -4.678 -0.381 1.00 0.00 H new ATOM 0 HZ3 LYS A 14 2.683 -5.745 -0.370 1.00 0.00 H new ATOM 248 N ILE A 15 5.204 -5.400 5.833 1.00 0.00 N ATOM 249 CA ILE A 15 5.600 -4.780 7.105 1.00 0.00 C ATOM 250 C ILE A 15 5.174 -3.311 7.104 1.00 0.00 C ATOM 251 O ILE A 15 5.687 -2.505 6.328 1.00 0.00 O ATOM 252 CB ILE A 15 7.118 -4.984 7.341 1.00 0.00 C ATOM 253 CG1 ILE A 15 7.398 -6.406 7.874 1.00 0.00 C ATOM 254 CG2 ILE A 15 7.757 -3.943 8.272 1.00 0.00 C ATOM 255 CD1 ILE A 15 7.019 -6.675 9.338 1.00 0.00 C ATOM 0 H ILE A 15 5.493 -4.843 5.029 1.00 0.00 H new ATOM 0 HA ILE A 15 5.093 -5.258 7.943 1.00 0.00 H new ATOM 0 HB ILE A 15 7.585 -4.848 6.365 1.00 0.00 H new ATOM 0 HG12 ILE A 15 6.862 -7.118 7.246 1.00 0.00 H new ATOM 0 HG13 ILE A 15 8.461 -6.613 7.753 1.00 0.00 H new ATOM 0 HG21 ILE A 15 8.820 -4.158 8.384 1.00 0.00 H new ATOM 0 HG22 ILE A 15 7.631 -2.948 7.846 1.00 0.00 H new ATOM 0 HG23 ILE A 15 7.274 -3.983 9.248 1.00 0.00 H new ATOM 0 HD11 ILE A 15 7.263 -7.706 9.594 1.00 0.00 H new ATOM 0 HD12 ILE A 15 7.574 -5.999 9.988 1.00 0.00 H new ATOM 0 HD13 ILE A 15 5.950 -6.511 9.473 1.00 0.00 H new ATOM 267 N ASP A 16 4.198 -2.969 7.949 1.00 0.00 N ATOM 268 CA ASP A 16 3.773 -1.582 8.170 1.00 0.00 C ATOM 269 C ASP A 16 4.815 -0.811 9.004 1.00 0.00 C ATOM 270 O ASP A 16 4.854 -0.912 10.233 1.00 0.00 O ATOM 271 CB ASP A 16 2.391 -1.509 8.829 1.00 0.00 C ATOM 272 CG ASP A 16 1.867 -0.058 8.891 1.00 0.00 C ATOM 273 OD1 ASP A 16 2.222 0.766 8.010 1.00 0.00 O ATOM 274 OD2 ASP A 16 1.084 0.258 9.818 1.00 0.00 O ATOM 0 H ASP A 16 3.677 -3.649 8.502 1.00 0.00 H new ATOM 0 HA ASP A 16 3.697 -1.108 7.191 1.00 0.00 H new ATOM 0 HB2 ASP A 16 1.688 -2.127 8.270 1.00 0.00 H new ATOM 0 HB3 ASP A 16 2.446 -1.920 9.837 1.00 0.00 H new ATOM 279 N ILE A 17 5.681 -0.060 8.329 1.00 0.00 N ATOM 280 CA ILE A 17 6.807 0.693 8.895 1.00 0.00 C ATOM 281 C ILE A 17 6.573 2.212 8.842 1.00 0.00 C ATOM 282 O ILE A 17 5.939 2.739 7.928 1.00 0.00 O ATOM 283 CB ILE A 17 8.122 0.254 8.210 1.00 0.00 C ATOM 284 CG1 ILE A 17 9.363 1.018 8.718 1.00 0.00 C ATOM 285 CG2 ILE A 17 8.042 0.351 6.671 1.00 0.00 C ATOM 286 CD1 ILE A 17 9.639 0.890 10.224 1.00 0.00 C ATOM 0 H ILE A 17 5.616 0.048 7.317 1.00 0.00 H new ATOM 0 HA ILE A 17 6.892 0.458 9.956 1.00 0.00 H new ATOM 0 HB ILE A 17 8.244 -0.793 8.489 1.00 0.00 H new ATOM 0 HG12 ILE A 17 10.237 0.662 8.173 1.00 0.00 H new ATOM 0 HG13 ILE A 17 9.244 2.074 8.475 1.00 0.00 H new ATOM 0 HG21 ILE A 17 8.989 0.032 6.237 1.00 0.00 H new ATOM 0 HG22 ILE A 17 7.241 -0.293 6.307 1.00 0.00 H new ATOM 0 HG23 ILE A 17 7.839 1.382 6.381 1.00 0.00 H new ATOM 0 HD11 ILE A 17 10.531 1.462 10.480 1.00 0.00 H new ATOM 0 HD12 ILE A 17 8.787 1.275 10.784 1.00 0.00 H new ATOM 0 HD13 ILE A 17 9.795 -0.159 10.477 1.00 0.00 H new ATOM 298 N ASP A 18 7.095 2.925 9.837 1.00 0.00 N ATOM 299 CA ASP A 18 7.078 4.384 9.956 1.00 0.00 C ATOM 300 C ASP A 18 8.154 5.034 9.044 1.00 0.00 C ATOM 301 O ASP A 18 9.347 4.873 9.317 1.00 0.00 O ATOM 302 CB ASP A 18 7.319 4.733 11.433 1.00 0.00 C ATOM 303 CG ASP A 18 6.265 4.109 12.365 1.00 0.00 C ATOM 304 OD1 ASP A 18 5.199 4.734 12.579 1.00 0.00 O ATOM 305 OD2 ASP A 18 6.506 2.989 12.883 1.00 0.00 O ATOM 0 H ASP A 18 7.566 2.479 10.624 1.00 0.00 H new ATOM 0 HA ASP A 18 6.115 4.776 9.629 1.00 0.00 H new ATOM 0 HB2 ASP A 18 8.310 4.388 11.728 1.00 0.00 H new ATOM 0 HB3 ASP A 18 7.310 5.816 11.553 1.00 0.00 H new ATOM 310 N PRO A 19 7.800 5.767 7.965 1.00 0.00 N ATOM 311 CA PRO A 19 8.777 6.302 6.998 1.00 0.00 C ATOM 312 C PRO A 19 9.663 7.425 7.560 1.00 0.00 C ATOM 313 O PRO A 19 10.742 7.686 7.028 1.00 0.00 O ATOM 314 CB PRO A 19 7.938 6.831 5.833 1.00 0.00 C ATOM 315 CG PRO A 19 6.597 7.184 6.472 1.00 0.00 C ATOM 316 CD PRO A 19 6.446 6.134 7.572 1.00 0.00 C ATOM 0 HA PRO A 19 9.476 5.516 6.712 1.00 0.00 H new ATOM 0 HB2 PRO A 19 8.402 7.703 5.371 1.00 0.00 H new ATOM 0 HB3 PRO A 19 7.822 6.080 5.052 1.00 0.00 H new ATOM 0 HG2 PRO A 19 6.599 8.195 6.878 1.00 0.00 H new ATOM 0 HG3 PRO A 19 5.781 7.132 5.751 1.00 0.00 H new ATOM 0 HD2 PRO A 19 5.889 6.534 8.419 1.00 0.00 H new ATOM 0 HD3 PRO A 19 5.896 5.266 7.210 1.00 0.00 H new ATOM 324 N GLU A 20 9.221 8.100 8.626 1.00 0.00 N ATOM 325 CA GLU A 20 9.995 9.108 9.359 1.00 0.00 C ATOM 326 C GLU A 20 11.124 8.494 10.212 1.00 0.00 C ATOM 327 O GLU A 20 12.052 9.199 10.615 1.00 0.00 O ATOM 328 CB GLU A 20 9.045 9.914 10.258 1.00 0.00 C ATOM 329 CG GLU A 20 7.986 10.685 9.457 1.00 0.00 C ATOM 330 CD GLU A 20 7.191 11.646 10.362 1.00 0.00 C ATOM 331 OE1 GLU A 20 6.302 11.185 11.120 1.00 0.00 O ATOM 332 OE2 GLU A 20 7.438 12.876 10.309 1.00 0.00 O ATOM 0 H GLU A 20 8.289 7.956 9.014 1.00 0.00 H new ATOM 0 HA GLU A 20 10.472 9.754 8.623 1.00 0.00 H new ATOM 0 HB2 GLU A 20 8.548 9.238 10.954 1.00 0.00 H new ATOM 0 HB3 GLU A 20 9.625 10.616 10.856 1.00 0.00 H new ATOM 0 HG2 GLU A 20 8.469 11.249 8.659 1.00 0.00 H new ATOM 0 HG3 GLU A 20 7.303 9.981 8.981 1.00 0.00 H new ATOM 339 N GLU A 21 11.073 7.183 10.472 1.00 0.00 N ATOM 340 CA GLU A 21 12.154 6.409 11.090 1.00 0.00 C ATOM 341 C GLU A 21 13.168 5.905 10.040 1.00 0.00 C ATOM 342 O GLU A 21 13.048 6.157 8.834 1.00 0.00 O ATOM 343 CB GLU A 21 11.577 5.230 11.892 1.00 0.00 C ATOM 344 CG GLU A 21 10.541 5.605 12.960 1.00 0.00 C ATOM 345 CD GLU A 21 11.102 6.551 14.043 1.00 0.00 C ATOM 346 OE1 GLU A 21 12.193 6.277 14.600 1.00 0.00 O ATOM 347 OE2 GLU A 21 10.444 7.572 14.363 1.00 0.00 O ATOM 0 H GLU A 21 10.255 6.615 10.252 1.00 0.00 H new ATOM 0 HA GLU A 21 12.689 7.072 11.770 1.00 0.00 H new ATOM 0 HB2 GLU A 21 11.118 4.529 11.195 1.00 0.00 H new ATOM 0 HB3 GLU A 21 12.400 4.705 12.377 1.00 0.00 H new ATOM 0 HG2 GLU A 21 9.687 6.081 12.478 1.00 0.00 H new ATOM 0 HG3 GLU A 21 10.173 4.696 13.436 1.00 0.00 H new ATOM 354 N THR A 22 14.206 5.205 10.499 1.00 0.00 N ATOM 355 CA THR A 22 15.321 4.753 9.657 1.00 0.00 C ATOM 356 C THR A 22 15.152 3.329 9.123 1.00 0.00 C ATOM 357 O THR A 22 14.212 2.607 9.462 1.00 0.00 O ATOM 358 CB THR A 22 16.657 4.895 10.393 1.00 0.00 C ATOM 359 OG1 THR A 22 16.688 4.008 11.491 1.00 0.00 O ATOM 360 CG2 THR A 22 16.903 6.311 10.909 1.00 0.00 C ATOM 0 H THR A 22 14.300 4.931 11.477 1.00 0.00 H new ATOM 0 HA THR A 22 15.318 5.408 8.786 1.00 0.00 H new ATOM 0 HB THR A 22 17.440 4.661 9.672 1.00 0.00 H new ATOM 0 HG1 THR A 22 17.544 4.098 11.960 1.00 0.00 H new ATOM 0 HG21 THR A 22 17.864 6.350 11.421 1.00 0.00 H new ATOM 0 HG22 THR A 22 16.910 7.008 10.071 1.00 0.00 H new ATOM 0 HG23 THR A 22 16.110 6.588 11.604 1.00 0.00 H new ATOM 368 N VAL A 23 16.094 2.886 8.290 1.00 0.00 N ATOM 369 CA VAL A 23 16.194 1.492 7.822 1.00 0.00 C ATOM 370 C VAL A 23 16.376 0.515 8.996 1.00 0.00 C ATOM 371 O VAL A 23 15.830 -0.589 8.973 1.00 0.00 O ATOM 372 CB VAL A 23 17.358 1.377 6.824 1.00 0.00 C ATOM 373 CG1 VAL A 23 17.650 -0.064 6.388 1.00 0.00 C ATOM 374 CG2 VAL A 23 17.080 2.211 5.564 1.00 0.00 C ATOM 0 H VAL A 23 16.823 3.491 7.912 1.00 0.00 H new ATOM 0 HA VAL A 23 15.263 1.220 7.324 1.00 0.00 H new ATOM 0 HB VAL A 23 18.232 1.753 7.356 1.00 0.00 H new ATOM 0 HG11 VAL A 23 18.482 -0.070 5.684 1.00 0.00 H new ATOM 0 HG12 VAL A 23 17.909 -0.663 7.261 1.00 0.00 H new ATOM 0 HG13 VAL A 23 16.766 -0.485 5.908 1.00 0.00 H new ATOM 0 HG21 VAL A 23 17.917 2.115 4.872 1.00 0.00 H new ATOM 0 HG22 VAL A 23 16.169 1.853 5.084 1.00 0.00 H new ATOM 0 HG23 VAL A 23 16.957 3.258 5.841 1.00 0.00 H new ATOM 384 N LYS A 24 17.070 0.923 10.067 1.00 0.00 N ATOM 385 CA LYS A 24 17.151 0.156 11.321 1.00 0.00 C ATOM 386 C LYS A 24 15.772 -0.070 11.959 1.00 0.00 C ATOM 387 O LYS A 24 15.548 -1.126 12.544 1.00 0.00 O ATOM 388 CB LYS A 24 18.131 0.846 12.284 1.00 0.00 C ATOM 389 CG LYS A 24 18.527 -0.059 13.461 1.00 0.00 C ATOM 390 CD LYS A 24 19.584 0.623 14.339 1.00 0.00 C ATOM 391 CE LYS A 24 19.990 -0.302 15.493 1.00 0.00 C ATOM 392 NZ LYS A 24 21.013 0.333 16.365 1.00 0.00 N ATOM 0 H LYS A 24 17.594 1.798 10.090 1.00 0.00 H new ATOM 0 HA LYS A 24 17.532 -0.839 11.091 1.00 0.00 H new ATOM 0 HB2 LYS A 24 19.027 1.140 11.738 1.00 0.00 H new ATOM 0 HB3 LYS A 24 17.677 1.760 12.668 1.00 0.00 H new ATOM 0 HG2 LYS A 24 17.646 -0.292 14.059 1.00 0.00 H new ATOM 0 HG3 LYS A 24 18.916 -1.005 13.084 1.00 0.00 H new ATOM 0 HD2 LYS A 24 20.459 0.874 13.739 1.00 0.00 H new ATOM 0 HD3 LYS A 24 19.190 1.559 14.735 1.00 0.00 H new ATOM 0 HE2 LYS A 24 19.111 -0.554 16.086 1.00 0.00 H new ATOM 0 HE3 LYS A 24 20.382 -1.236 15.091 1.00 0.00 H new ATOM 0 HZ1 LYS A 24 21.266 -0.319 17.135 1.00 0.00 H new ATOM 0 HZ2 LYS A 24 21.861 0.551 15.804 1.00 0.00 H new ATOM 0 HZ3 LYS A 24 20.629 1.212 16.767 1.00 0.00 H new ATOM 406 N ALA A 25 14.824 0.858 11.802 1.00 0.00 N ATOM 407 CA ALA A 25 13.438 0.664 12.236 1.00 0.00 C ATOM 408 C ALA A 25 12.644 -0.300 11.331 1.00 0.00 C ATOM 409 O ALA A 25 11.841 -1.079 11.840 1.00 0.00 O ATOM 410 CB ALA A 25 12.743 2.018 12.370 1.00 0.00 C ATOM 0 H ALA A 25 14.996 1.766 11.370 1.00 0.00 H new ATOM 0 HA ALA A 25 13.467 0.181 13.213 1.00 0.00 H new ATOM 0 HB1 ALA A 25 11.713 1.868 12.693 1.00 0.00 H new ATOM 0 HB2 ALA A 25 13.269 2.626 13.106 1.00 0.00 H new ATOM 0 HB3 ALA A 25 12.751 2.528 11.407 1.00 0.00 H new ATOM 416 N LEU A 26 12.872 -0.319 10.010 1.00 0.00 N ATOM 417 CA LEU A 26 12.321 -1.356 9.124 1.00 0.00 C ATOM 418 C LEU A 26 12.733 -2.745 9.641 1.00 0.00 C ATOM 419 O LEU A 26 11.891 -3.586 9.962 1.00 0.00 O ATOM 420 CB LEU A 26 12.753 -1.068 7.668 1.00 0.00 C ATOM 421 CG LEU A 26 12.397 -2.148 6.631 1.00 0.00 C ATOM 422 CD1 LEU A 26 10.951 -2.602 6.774 1.00 0.00 C ATOM 423 CD2 LEU A 26 12.595 -1.595 5.219 1.00 0.00 C ATOM 0 H LEU A 26 13.439 0.378 9.528 1.00 0.00 H new ATOM 0 HA LEU A 26 11.231 -1.342 9.128 1.00 0.00 H new ATOM 0 HB2 LEU A 26 12.299 -0.128 7.355 1.00 0.00 H new ATOM 0 HB3 LEU A 26 13.833 -0.920 7.653 1.00 0.00 H new ATOM 0 HG LEU A 26 13.053 -3.001 6.804 1.00 0.00 H new ATOM 0 HD11 LEU A 26 10.734 -3.365 6.026 1.00 0.00 H new ATOM 0 HD12 LEU A 26 10.796 -3.016 7.770 1.00 0.00 H new ATOM 0 HD13 LEU A 26 10.286 -1.751 6.628 1.00 0.00 H new ATOM 0 HD21 LEU A 26 12.342 -2.363 4.489 1.00 0.00 H new ATOM 0 HD22 LEU A 26 11.949 -0.729 5.074 1.00 0.00 H new ATOM 0 HD23 LEU A 26 13.635 -1.298 5.087 1.00 0.00 H new ATOM 435 N LYS A 27 14.040 -2.929 9.826 1.00 0.00 N ATOM 436 CA LYS A 27 14.649 -4.084 10.503 1.00 0.00 C ATOM 437 C LYS A 27 14.034 -4.390 11.879 1.00 0.00 C ATOM 438 O LYS A 27 13.744 -5.555 12.146 1.00 0.00 O ATOM 439 CB LYS A 27 16.176 -3.907 10.574 1.00 0.00 C ATOM 440 CG LYS A 27 16.837 -4.042 9.189 1.00 0.00 C ATOM 441 CD LYS A 27 18.332 -3.684 9.159 1.00 0.00 C ATOM 442 CE LYS A 27 19.109 -4.384 10.280 1.00 0.00 C ATOM 443 NZ LYS A 27 20.568 -4.416 10.032 1.00 0.00 N ATOM 0 H LYS A 27 14.733 -2.256 9.498 1.00 0.00 H new ATOM 0 HA LYS A 27 14.425 -4.964 9.900 1.00 0.00 H new ATOM 0 HB2 LYS A 27 16.408 -2.928 10.993 1.00 0.00 H new ATOM 0 HB3 LYS A 27 16.596 -4.651 11.251 1.00 0.00 H new ATOM 0 HG2 LYS A 27 16.715 -5.067 8.840 1.00 0.00 H new ATOM 0 HG3 LYS A 27 16.308 -3.400 8.484 1.00 0.00 H new ATOM 0 HD2 LYS A 27 18.754 -3.966 8.194 1.00 0.00 H new ATOM 0 HD3 LYS A 27 18.449 -2.605 9.255 1.00 0.00 H new ATOM 0 HE2 LYS A 27 18.916 -3.873 11.223 1.00 0.00 H new ATOM 0 HE3 LYS A 27 18.741 -5.404 10.389 1.00 0.00 H new ATOM 0 HZ1 LYS A 27 21.071 -4.545 10.933 1.00 0.00 H new ATOM 0 HZ2 LYS A 27 20.794 -5.205 9.394 1.00 0.00 H new ATOM 0 HZ3 LYS A 27 20.865 -3.521 9.594 1.00 0.00 H new ATOM 457 N GLU A 28 13.797 -3.395 12.742 1.00 0.00 N ATOM 458 CA GLU A 28 13.158 -3.605 14.058 1.00 0.00 C ATOM 459 C GLU A 28 11.719 -4.130 13.954 1.00 0.00 C ATOM 460 O GLU A 28 11.338 -5.035 14.695 1.00 0.00 O ATOM 461 CB GLU A 28 13.270 -2.369 14.983 1.00 0.00 C ATOM 462 CG GLU A 28 12.040 -1.451 15.164 1.00 0.00 C ATOM 463 CD GLU A 28 12.326 -0.381 16.235 1.00 0.00 C ATOM 464 OE1 GLU A 28 12.905 0.681 15.904 1.00 0.00 O ATOM 465 OE2 GLU A 28 11.969 -0.592 17.421 1.00 0.00 O ATOM 0 H GLU A 28 14.040 -2.422 12.554 1.00 0.00 H new ATOM 0 HA GLU A 28 13.732 -4.399 14.536 1.00 0.00 H new ATOM 0 HB2 GLU A 28 13.563 -2.724 15.971 1.00 0.00 H new ATOM 0 HB3 GLU A 28 14.088 -1.753 14.610 1.00 0.00 H new ATOM 0 HG2 GLU A 28 11.793 -0.971 14.217 1.00 0.00 H new ATOM 0 HG3 GLU A 28 11.174 -2.045 15.455 1.00 0.00 H new ATOM 472 N LYS A 29 10.921 -3.603 13.019 1.00 0.00 N ATOM 473 CA LYS A 29 9.557 -4.057 12.734 1.00 0.00 C ATOM 474 C LYS A 29 9.535 -5.486 12.176 1.00 0.00 C ATOM 475 O LYS A 29 8.706 -6.294 12.593 1.00 0.00 O ATOM 476 CB LYS A 29 8.910 -3.037 11.785 1.00 0.00 C ATOM 477 CG LYS A 29 7.387 -2.962 11.942 1.00 0.00 C ATOM 478 CD LYS A 29 6.914 -2.066 13.102 1.00 0.00 C ATOM 479 CE LYS A 29 7.085 -0.578 12.753 1.00 0.00 C ATOM 480 NZ LYS A 29 6.495 0.319 13.780 1.00 0.00 N ATOM 0 H LYS A 29 11.215 -2.828 12.424 1.00 0.00 H new ATOM 0 HA LYS A 29 8.977 -4.107 13.656 1.00 0.00 H new ATOM 0 HB2 LYS A 29 9.339 -2.052 11.971 1.00 0.00 H new ATOM 0 HB3 LYS A 29 9.152 -3.301 10.756 1.00 0.00 H new ATOM 0 HG2 LYS A 29 6.955 -2.591 11.012 1.00 0.00 H new ATOM 0 HG3 LYS A 29 6.999 -3.969 12.094 1.00 0.00 H new ATOM 0 HD2 LYS A 29 5.867 -2.274 13.323 1.00 0.00 H new ATOM 0 HD3 LYS A 29 7.482 -2.300 14.002 1.00 0.00 H new ATOM 0 HE2 LYS A 29 8.146 -0.353 12.645 1.00 0.00 H new ATOM 0 HE3 LYS A 29 6.617 -0.378 11.789 1.00 0.00 H new ATOM 0 HZ1 LYS A 29 6.591 1.308 13.474 1.00 0.00 H new ATOM 0 HZ2 LYS A 29 5.488 0.091 13.903 1.00 0.00 H new ATOM 0 HZ3 LYS A 29 6.992 0.186 14.684 1.00 0.00 H new ATOM 494 N ILE A 30 10.487 -5.829 11.302 1.00 0.00 N ATOM 495 CA ILE A 30 10.728 -7.204 10.831 1.00 0.00 C ATOM 496 C ILE A 30 11.076 -8.128 12.007 1.00 0.00 C ATOM 497 O ILE A 30 10.450 -9.174 12.153 1.00 0.00 O ATOM 498 CB ILE A 30 11.813 -7.233 9.729 1.00 0.00 C ATOM 499 CG1 ILE A 30 11.312 -6.514 8.459 1.00 0.00 C ATOM 500 CG2 ILE A 30 12.191 -8.683 9.365 1.00 0.00 C ATOM 501 CD1 ILE A 30 12.429 -6.076 7.504 1.00 0.00 C ATOM 0 H ILE A 30 11.126 -5.148 10.892 1.00 0.00 H new ATOM 0 HA ILE A 30 9.809 -7.580 10.382 1.00 0.00 H new ATOM 0 HB ILE A 30 12.692 -6.720 10.119 1.00 0.00 H new ATOM 0 HG12 ILE A 30 10.631 -7.176 7.925 1.00 0.00 H new ATOM 0 HG13 ILE A 30 10.737 -5.637 8.755 1.00 0.00 H new ATOM 0 HG21 ILE A 30 12.956 -8.676 8.588 1.00 0.00 H new ATOM 0 HG22 ILE A 30 12.577 -9.191 10.249 1.00 0.00 H new ATOM 0 HG23 ILE A 30 11.308 -9.209 9.000 1.00 0.00 H new ATOM 0 HD11 ILE A 30 11.993 -5.579 6.638 1.00 0.00 H new ATOM 0 HD12 ILE A 30 13.098 -5.387 8.019 1.00 0.00 H new ATOM 0 HD13 ILE A 30 12.991 -6.950 7.176 1.00 0.00 H new ATOM 513 N GLU A 31 12.022 -7.750 12.873 1.00 0.00 N ATOM 514 CA GLU A 31 12.373 -8.521 14.079 1.00 0.00 C ATOM 515 C GLU A 31 11.154 -8.720 15.000 1.00 0.00 C ATOM 516 O GLU A 31 10.922 -9.822 15.499 1.00 0.00 O ATOM 517 CB GLU A 31 13.525 -7.829 14.833 1.00 0.00 C ATOM 518 CG GLU A 31 14.080 -8.708 15.962 1.00 0.00 C ATOM 519 CD GLU A 31 15.094 -7.965 16.846 1.00 0.00 C ATOM 520 OE1 GLU A 31 14.687 -7.281 17.813 1.00 0.00 O ATOM 521 OE2 GLU A 31 16.318 -8.108 16.618 1.00 0.00 O ATOM 0 H GLU A 31 12.570 -6.897 12.760 1.00 0.00 H new ATOM 0 HA GLU A 31 12.704 -9.511 13.764 1.00 0.00 H new ATOM 0 HB2 GLU A 31 14.325 -7.590 14.133 1.00 0.00 H new ATOM 0 HB3 GLU A 31 13.172 -6.885 15.248 1.00 0.00 H new ATOM 0 HG2 GLU A 31 13.255 -9.062 16.581 1.00 0.00 H new ATOM 0 HG3 GLU A 31 14.556 -9.589 15.531 1.00 0.00 H new ATOM 528 N SER A 32 10.349 -7.671 15.189 1.00 0.00 N ATOM 529 CA SER A 32 9.118 -7.673 15.993 1.00 0.00 C ATOM 530 C SER A 32 8.061 -8.653 15.463 1.00 0.00 C ATOM 531 O SER A 32 7.445 -9.381 16.244 1.00 0.00 O ATOM 532 CB SER A 32 8.518 -6.260 16.057 1.00 0.00 C ATOM 533 OG SER A 32 9.393 -5.365 16.725 1.00 0.00 O ATOM 0 H SER A 32 10.542 -6.761 14.771 1.00 0.00 H new ATOM 0 HA SER A 32 9.402 -8.005 16.992 1.00 0.00 H new ATOM 0 HB2 SER A 32 8.323 -5.898 15.048 1.00 0.00 H new ATOM 0 HB3 SER A 32 7.559 -6.291 16.575 1.00 0.00 H new ATOM 0 HG SER A 32 10.138 -5.133 16.132 1.00 0.00 H new ATOM 539 N GLU A 33 7.838 -8.686 14.146 1.00 0.00 N ATOM 540 CA GLU A 33 6.851 -9.554 13.488 1.00 0.00 C ATOM 541 C GLU A 33 7.358 -10.998 13.301 1.00 0.00 C ATOM 542 O GLU A 33 6.723 -11.953 13.757 1.00 0.00 O ATOM 543 CB GLU A 33 6.475 -8.927 12.134 1.00 0.00 C ATOM 544 CG GLU A 33 5.269 -9.585 11.448 1.00 0.00 C ATOM 545 CD GLU A 33 3.955 -9.327 12.214 1.00 0.00 C ATOM 546 OE1 GLU A 33 3.347 -8.242 12.042 1.00 0.00 O ATOM 547 OE2 GLU A 33 3.515 -10.209 12.990 1.00 0.00 O ATOM 0 H GLU A 33 8.350 -8.096 13.490 1.00 0.00 H new ATOM 0 HA GLU A 33 5.973 -9.625 14.131 1.00 0.00 H new ATOM 0 HB2 GLU A 33 6.261 -7.869 12.283 1.00 0.00 H new ATOM 0 HB3 GLU A 33 7.335 -8.987 11.467 1.00 0.00 H new ATOM 0 HG2 GLU A 33 5.177 -9.202 10.432 1.00 0.00 H new ATOM 0 HG3 GLU A 33 5.438 -10.659 11.370 1.00 0.00 H new ATOM 554 N LYS A 34 8.492 -11.170 12.605 1.00 0.00 N ATOM 555 CA LYS A 34 9.049 -12.467 12.172 1.00 0.00 C ATOM 556 C LYS A 34 9.817 -13.213 13.272 1.00 0.00 C ATOM 557 O LYS A 34 10.015 -14.425 13.170 1.00 0.00 O ATOM 558 CB LYS A 34 9.971 -12.257 10.954 1.00 0.00 C ATOM 559 CG LYS A 34 9.347 -11.484 9.776 1.00 0.00 C ATOM 560 CD LYS A 34 8.044 -12.094 9.232 1.00 0.00 C ATOM 561 CE LYS A 34 8.199 -13.520 8.677 1.00 0.00 C ATOM 562 NZ LYS A 34 9.070 -13.570 7.472 1.00 0.00 N ATOM 0 H LYS A 34 9.071 -10.381 12.316 1.00 0.00 H new ATOM 0 HA LYS A 34 8.195 -13.093 11.912 1.00 0.00 H new ATOM 0 HB2 LYS A 34 10.863 -11.725 11.283 1.00 0.00 H new ATOM 0 HB3 LYS A 34 10.296 -13.233 10.594 1.00 0.00 H new ATOM 0 HG2 LYS A 34 9.149 -10.460 10.094 1.00 0.00 H new ATOM 0 HG3 LYS A 34 10.075 -11.431 8.966 1.00 0.00 H new ATOM 0 HD2 LYS A 34 7.301 -12.105 10.029 1.00 0.00 H new ATOM 0 HD3 LYS A 34 7.656 -11.449 8.443 1.00 0.00 H new ATOM 0 HE2 LYS A 34 8.617 -14.164 9.451 1.00 0.00 H new ATOM 0 HE3 LYS A 34 7.216 -13.918 8.427 1.00 0.00 H new ATOM 0 HZ1 LYS A 34 8.515 -13.899 6.656 1.00 0.00 H new ATOM 0 HZ2 LYS A 34 9.445 -12.620 7.275 1.00 0.00 H new ATOM 0 HZ3 LYS A 34 9.859 -14.225 7.641 1.00 0.00 H new ATOM 576 N GLY A 35 10.223 -12.498 14.320 1.00 0.00 N ATOM 577 CA GLY A 35 10.948 -13.000 15.490 1.00 0.00 C ATOM 578 C GLY A 35 12.473 -12.943 15.337 1.00 0.00 C ATOM 579 O GLY A 35 13.034 -13.395 14.334 1.00 0.00 O ATOM 0 H GLY A 35 10.045 -11.495 14.380 1.00 0.00 H new ATOM 0 HA2 GLY A 35 10.657 -12.418 16.365 1.00 0.00 H new ATOM 0 HA3 GLY A 35 10.648 -14.031 15.678 1.00 0.00 H new ATOM 583 N LYS A 36 13.165 -12.458 16.376 1.00 0.00 N ATOM 584 CA LYS A 36 14.620 -12.403 16.542 1.00 0.00 C ATOM 585 C LYS A 36 15.330 -13.760 16.419 1.00 0.00 C ATOM 586 O LYS A 36 16.508 -13.810 16.075 1.00 0.00 O ATOM 587 CB LYS A 36 14.834 -11.751 17.916 1.00 0.00 C ATOM 588 CG LYS A 36 16.254 -11.257 18.132 1.00 0.00 C ATOM 589 CD LYS A 36 16.409 -10.595 19.511 1.00 0.00 C ATOM 590 CE LYS A 36 17.714 -9.796 19.625 1.00 0.00 C ATOM 591 NZ LYS A 36 17.581 -8.431 19.051 1.00 0.00 N ATOM 0 H LYS A 36 12.683 -12.064 17.184 1.00 0.00 H new ATOM 0 HA LYS A 36 15.072 -11.830 15.732 1.00 0.00 H new ATOM 0 HB2 LYS A 36 14.145 -10.913 18.024 1.00 0.00 H new ATOM 0 HB3 LYS A 36 14.585 -12.471 18.695 1.00 0.00 H new ATOM 0 HG2 LYS A 36 16.949 -12.092 18.046 1.00 0.00 H new ATOM 0 HG3 LYS A 36 16.516 -10.543 17.351 1.00 0.00 H new ATOM 0 HD2 LYS A 36 15.562 -9.933 19.692 1.00 0.00 H new ATOM 0 HD3 LYS A 36 16.385 -11.362 20.285 1.00 0.00 H new ATOM 0 HE2 LYS A 36 18.004 -9.722 20.673 1.00 0.00 H new ATOM 0 HE3 LYS A 36 18.513 -10.330 19.110 1.00 0.00 H new ATOM 0 HZ1 LYS A 36 18.512 -7.967 19.039 1.00 0.00 H new ATOM 0 HZ2 LYS A 36 17.215 -8.497 18.080 1.00 0.00 H new ATOM 0 HZ3 LYS A 36 16.923 -7.873 19.632 1.00 0.00 H new ATOM 605 N ASP A 37 14.610 -14.863 16.627 1.00 0.00 N ATOM 606 CA ASP A 37 15.080 -16.234 16.375 1.00 0.00 C ATOM 607 C ASP A 37 15.458 -16.490 14.904 1.00 0.00 C ATOM 608 O ASP A 37 16.330 -17.317 14.626 1.00 0.00 O ATOM 609 CB ASP A 37 13.978 -17.231 16.752 1.00 0.00 C ATOM 610 CG ASP A 37 13.649 -17.203 18.253 1.00 0.00 C ATOM 611 OD1 ASP A 37 14.351 -17.882 19.041 1.00 0.00 O ATOM 612 OD2 ASP A 37 12.686 -16.502 18.648 1.00 0.00 O ATOM 0 H ASP A 37 13.656 -14.831 16.986 1.00 0.00 H new ATOM 0 HA ASP A 37 15.976 -16.364 16.983 1.00 0.00 H new ATOM 0 HB2 ASP A 37 13.077 -17.005 16.181 1.00 0.00 H new ATOM 0 HB3 ASP A 37 14.290 -18.237 16.470 1.00 0.00 H new ATOM 617 N ALA A 38 14.804 -15.789 13.969 1.00 0.00 N ATOM 618 CA ALA A 38 14.932 -15.988 12.525 1.00 0.00 C ATOM 619 C ALA A 38 15.437 -14.733 11.781 1.00 0.00 C ATOM 620 O ALA A 38 16.222 -14.853 10.837 1.00 0.00 O ATOM 621 CB ALA A 38 13.575 -16.462 11.990 1.00 0.00 C ATOM 0 H ALA A 38 14.150 -15.044 14.208 1.00 0.00 H new ATOM 0 HA ALA A 38 15.695 -16.744 12.340 1.00 0.00 H new ATOM 0 HB1 ALA A 38 13.643 -16.618 10.913 1.00 0.00 H new ATOM 0 HB2 ALA A 38 13.299 -17.398 12.476 1.00 0.00 H new ATOM 0 HB3 ALA A 38 12.817 -15.707 12.200 1.00 0.00 H new ATOM 627 N PHE A 39 15.025 -13.535 12.216 1.00 0.00 N ATOM 628 CA PHE A 39 15.385 -12.238 11.624 1.00 0.00 C ATOM 629 C PHE A 39 15.782 -11.208 12.708 1.00 0.00 C ATOM 630 O PHE A 39 15.069 -10.222 12.914 1.00 0.00 O ATOM 631 CB PHE A 39 14.224 -11.734 10.742 1.00 0.00 C ATOM 632 CG PHE A 39 13.899 -12.587 9.528 1.00 0.00 C ATOM 633 CD1 PHE A 39 13.006 -13.669 9.640 1.00 0.00 C ATOM 634 CD2 PHE A 39 14.473 -12.288 8.276 1.00 0.00 C ATOM 635 CE1 PHE A 39 12.694 -14.454 8.515 1.00 0.00 C ATOM 636 CE2 PHE A 39 14.157 -13.068 7.148 1.00 0.00 C ATOM 637 CZ PHE A 39 13.270 -14.153 7.268 1.00 0.00 C ATOM 0 H PHE A 39 14.407 -13.438 13.022 1.00 0.00 H new ATOM 0 HA PHE A 39 16.264 -12.369 10.993 1.00 0.00 H new ATOM 0 HB2 PHE A 39 13.329 -11.659 11.360 1.00 0.00 H new ATOM 0 HB3 PHE A 39 14.462 -10.726 10.402 1.00 0.00 H new ATOM 0 HD1 PHE A 39 12.558 -13.898 10.595 1.00 0.00 H new ATOM 0 HD2 PHE A 39 15.157 -11.458 8.182 1.00 0.00 H new ATOM 0 HE1 PHE A 39 12.013 -15.287 8.609 1.00 0.00 H new ATOM 0 HE2 PHE A 39 14.596 -12.833 6.190 1.00 0.00 H new ATOM 0 HZ PHE A 39 13.032 -14.754 6.403 1.00 0.00 H new ATOM 647 N PRO A 40 16.923 -11.375 13.404 1.00 0.00 N ATOM 648 CA PRO A 40 17.416 -10.380 14.362 1.00 0.00 C ATOM 649 C PRO A 40 17.916 -9.120 13.629 1.00 0.00 C ATOM 650 O PRO A 40 18.538 -9.227 12.571 1.00 0.00 O ATOM 651 CB PRO A 40 18.565 -11.084 15.095 1.00 0.00 C ATOM 652 CG PRO A 40 19.112 -12.068 14.060 1.00 0.00 C ATOM 653 CD PRO A 40 17.873 -12.472 13.261 1.00 0.00 C ATOM 0 HA PRO A 40 16.639 -10.043 15.048 1.00 0.00 H new ATOM 0 HB2 PRO A 40 19.329 -10.375 15.415 1.00 0.00 H new ATOM 0 HB3 PRO A 40 18.213 -11.599 15.989 1.00 0.00 H new ATOM 0 HG2 PRO A 40 19.866 -11.604 13.424 1.00 0.00 H new ATOM 0 HG3 PRO A 40 19.582 -12.929 14.534 1.00 0.00 H new ATOM 0 HD2 PRO A 40 18.122 -12.637 12.213 1.00 0.00 H new ATOM 0 HD3 PRO A 40 17.452 -13.404 13.639 1.00 0.00 H new ATOM 661 N VAL A 41 17.737 -7.925 14.201 1.00 0.00 N ATOM 662 CA VAL A 41 18.265 -6.645 13.665 1.00 0.00 C ATOM 663 C VAL A 41 19.766 -6.737 13.386 1.00 0.00 C ATOM 664 O VAL A 41 20.242 -6.306 12.336 1.00 0.00 O ATOM 665 CB VAL A 41 17.989 -5.480 14.643 1.00 0.00 C ATOM 666 CG1 VAL A 41 18.688 -4.167 14.257 1.00 0.00 C ATOM 667 CG2 VAL A 41 16.492 -5.189 14.709 1.00 0.00 C ATOM 0 H VAL A 41 17.212 -7.807 15.067 1.00 0.00 H new ATOM 0 HA VAL A 41 17.747 -6.450 12.726 1.00 0.00 H new ATOM 0 HB VAL A 41 18.385 -5.813 15.602 1.00 0.00 H new ATOM 0 HG11 VAL A 41 18.447 -3.397 14.990 1.00 0.00 H new ATOM 0 HG12 VAL A 41 19.767 -4.322 14.235 1.00 0.00 H new ATOM 0 HG13 VAL A 41 18.347 -3.849 13.272 1.00 0.00 H new ATOM 0 HG21 VAL A 41 16.311 -4.367 15.401 1.00 0.00 H new ATOM 0 HG22 VAL A 41 16.131 -4.915 13.718 1.00 0.00 H new ATOM 0 HG23 VAL A 41 15.964 -6.077 15.055 1.00 0.00 H new ATOM 677 N ALA A 42 20.506 -7.335 14.319 1.00 0.00 N ATOM 678 CA ALA A 42 21.956 -7.516 14.241 1.00 0.00 C ATOM 679 C ALA A 42 22.437 -8.456 13.105 1.00 0.00 C ATOM 680 O ALA A 42 23.626 -8.448 12.776 1.00 0.00 O ATOM 681 CB ALA A 42 22.439 -8.017 15.609 1.00 0.00 C ATOM 0 H ALA A 42 20.103 -7.718 15.174 1.00 0.00 H new ATOM 0 HA ALA A 42 22.393 -6.550 13.988 1.00 0.00 H new ATOM 0 HB1 ALA A 42 23.519 -8.162 15.583 1.00 0.00 H new ATOM 0 HB2 ALA A 42 22.190 -7.282 16.374 1.00 0.00 H new ATOM 0 HB3 ALA A 42 21.951 -8.963 15.843 1.00 0.00 H new ATOM 687 N GLY A 43 21.541 -9.251 12.500 1.00 0.00 N ATOM 688 CA GLY A 43 21.840 -10.189 11.405 1.00 0.00 C ATOM 689 C GLY A 43 21.157 -9.863 10.070 1.00 0.00 C ATOM 690 O GLY A 43 21.643 -10.282 9.021 1.00 0.00 O ATOM 0 H GLY A 43 20.557 -9.260 12.767 1.00 0.00 H new ATOM 0 HA2 GLY A 43 22.919 -10.210 11.249 1.00 0.00 H new ATOM 0 HA3 GLY A 43 21.543 -11.191 11.713 1.00 0.00 H new ATOM 694 N GLN A 44 20.042 -9.127 10.079 1.00 0.00 N ATOM 695 CA GLN A 44 19.321 -8.699 8.874 1.00 0.00 C ATOM 696 C GLN A 44 20.126 -7.718 7.996 1.00 0.00 C ATOM 697 O GLN A 44 20.799 -6.813 8.502 1.00 0.00 O ATOM 698 CB GLN A 44 18.028 -7.976 9.279 1.00 0.00 C ATOM 699 CG GLN A 44 16.835 -8.859 9.665 1.00 0.00 C ATOM 700 CD GLN A 44 15.657 -7.950 10.011 1.00 0.00 C ATOM 701 OE1 GLN A 44 15.178 -7.193 9.184 1.00 0.00 O ATOM 702 NE2 GLN A 44 15.173 -7.934 11.232 1.00 0.00 N ATOM 0 H GLN A 44 19.605 -8.804 10.942 1.00 0.00 H new ATOM 0 HA GLN A 44 19.131 -9.606 8.300 1.00 0.00 H new ATOM 0 HB2 GLN A 44 18.254 -7.322 10.122 1.00 0.00 H new ATOM 0 HB3 GLN A 44 17.723 -7.336 8.451 1.00 0.00 H new ATOM 0 HG2 GLN A 44 16.573 -9.524 8.842 1.00 0.00 H new ATOM 0 HG3 GLN A 44 17.090 -9.491 10.516 1.00 0.00 H new ATOM 0 HE21 GLN A 44 15.557 -8.558 11.941 1.00 0.00 H new ATOM 0 HE22 GLN A 44 14.413 -7.297 11.471 1.00 0.00 H new ATOM 711 N LYS A 45 19.959 -7.829 6.673 1.00 0.00 N ATOM 712 CA LYS A 45 20.413 -6.870 5.649 1.00 0.00 C ATOM 713 C LYS A 45 19.234 -6.567 4.716 1.00 0.00 C ATOM 714 O LYS A 45 18.416 -7.444 4.429 1.00 0.00 O ATOM 715 CB LYS A 45 21.660 -7.340 4.874 1.00 0.00 C ATOM 716 CG LYS A 45 22.902 -7.531 5.764 1.00 0.00 C ATOM 717 CD LYS A 45 24.212 -7.410 4.963 1.00 0.00 C ATOM 718 CE LYS A 45 25.422 -7.169 5.880 1.00 0.00 C ATOM 719 NZ LYS A 45 25.871 -8.389 6.596 1.00 0.00 N ATOM 0 H LYS A 45 19.479 -8.630 6.263 1.00 0.00 H new ATOM 0 HA LYS A 45 20.735 -5.958 6.151 1.00 0.00 H new ATOM 0 HB2 LYS A 45 21.433 -8.282 4.374 1.00 0.00 H new ATOM 0 HB3 LYS A 45 21.889 -6.613 4.095 1.00 0.00 H new ATOM 0 HG2 LYS A 45 22.895 -6.787 6.561 1.00 0.00 H new ATOM 0 HG3 LYS A 45 22.858 -8.510 6.241 1.00 0.00 H new ATOM 0 HD2 LYS A 45 24.370 -8.320 4.385 1.00 0.00 H new ATOM 0 HD3 LYS A 45 24.127 -6.590 4.250 1.00 0.00 H new ATOM 0 HE2 LYS A 45 26.248 -6.781 5.284 1.00 0.00 H new ATOM 0 HE3 LYS A 45 25.168 -6.401 6.610 1.00 0.00 H new ATOM 0 HZ1 LYS A 45 26.453 -8.117 7.414 1.00 0.00 H new ATOM 0 HZ2 LYS A 45 25.042 -8.924 6.924 1.00 0.00 H new ATOM 0 HZ3 LYS A 45 26.434 -8.982 5.953 1.00 0.00 H new ATOM 733 N LEU A 46 19.150 -5.318 4.261 1.00 0.00 N ATOM 734 CA LEU A 46 18.018 -4.732 3.542 1.00 0.00 C ATOM 735 C LEU A 46 18.490 -4.118 2.219 1.00 0.00 C ATOM 736 O LEU A 46 19.387 -3.279 2.226 1.00 0.00 O ATOM 737 CB LEU A 46 17.367 -3.675 4.471 1.00 0.00 C ATOM 738 CG LEU A 46 15.941 -3.988 4.943 1.00 0.00 C ATOM 739 CD1 LEU A 46 14.987 -4.012 3.756 1.00 0.00 C ATOM 740 CD2 LEU A 46 15.844 -5.313 5.698 1.00 0.00 C ATOM 0 H LEU A 46 19.911 -4.651 4.391 1.00 0.00 H new ATOM 0 HA LEU A 46 17.280 -5.493 3.288 1.00 0.00 H new ATOM 0 HB2 LEU A 46 18.001 -3.551 5.349 1.00 0.00 H new ATOM 0 HB3 LEU A 46 17.355 -2.718 3.949 1.00 0.00 H new ATOM 0 HG LEU A 46 15.661 -3.195 5.636 1.00 0.00 H new ATOM 0 HD11 LEU A 46 13.979 -4.235 4.104 1.00 0.00 H new ATOM 0 HD12 LEU A 46 14.994 -3.039 3.264 1.00 0.00 H new ATOM 0 HD13 LEU A 46 15.305 -4.779 3.049 1.00 0.00 H new ATOM 0 HD21 LEU A 46 14.812 -5.481 6.007 1.00 0.00 H new ATOM 0 HD22 LEU A 46 16.165 -6.127 5.048 1.00 0.00 H new ATOM 0 HD23 LEU A 46 16.485 -5.278 6.579 1.00 0.00 H new ATOM 752 N ILE A 47 17.922 -4.538 1.087 1.00 0.00 N ATOM 753 CA ILE A 47 18.401 -4.206 -0.267 1.00 0.00 C ATOM 754 C ILE A 47 17.246 -3.732 -1.158 1.00 0.00 C ATOM 755 O ILE A 47 16.221 -4.410 -1.270 1.00 0.00 O ATOM 756 CB ILE A 47 19.156 -5.420 -0.863 1.00 0.00 C ATOM 757 CG1 ILE A 47 20.419 -5.776 -0.040 1.00 0.00 C ATOM 758 CG2 ILE A 47 19.640 -5.178 -2.294 1.00 0.00 C ATOM 759 CD1 ILE A 47 20.214 -7.004 0.830 1.00 0.00 C ATOM 0 H ILE A 47 17.094 -5.134 1.080 1.00 0.00 H new ATOM 0 HA ILE A 47 19.103 -3.374 -0.211 1.00 0.00 H new ATOM 0 HB ILE A 47 18.425 -6.228 -0.841 1.00 0.00 H new ATOM 0 HG12 ILE A 47 21.255 -5.949 -0.718 1.00 0.00 H new ATOM 0 HG13 ILE A 47 20.690 -4.929 0.590 1.00 0.00 H new ATOM 0 HG21 ILE A 47 20.161 -6.064 -2.656 1.00 0.00 H new ATOM 0 HG22 ILE A 47 18.785 -4.972 -2.937 1.00 0.00 H new ATOM 0 HG23 ILE A 47 20.319 -4.326 -2.309 1.00 0.00 H new ATOM 0 HD11 ILE A 47 21.128 -7.212 1.387 1.00 0.00 H new ATOM 0 HD12 ILE A 47 19.397 -6.823 1.528 1.00 0.00 H new ATOM 0 HD13 ILE A 47 19.970 -7.860 0.200 1.00 0.00 H new ATOM 771 N TYR A 48 17.424 -2.577 -1.809 1.00 0.00 N ATOM 772 CA TYR A 48 16.498 -2.030 -2.807 1.00 0.00 C ATOM 773 C TYR A 48 17.237 -1.585 -4.074 1.00 0.00 C ATOM 774 O TYR A 48 18.321 -1.009 -3.981 1.00 0.00 O ATOM 775 CB TYR A 48 15.703 -0.859 -2.216 1.00 0.00 C ATOM 776 CG TYR A 48 14.494 -0.403 -3.024 1.00 0.00 C ATOM 777 CD1 TYR A 48 13.551 -1.335 -3.510 1.00 0.00 C ATOM 778 CD2 TYR A 48 14.285 0.973 -3.249 1.00 0.00 C ATOM 779 CE1 TYR A 48 12.408 -0.897 -4.207 1.00 0.00 C ATOM 780 CE2 TYR A 48 13.140 1.416 -3.940 1.00 0.00 C ATOM 781 CZ TYR A 48 12.196 0.483 -4.419 1.00 0.00 C ATOM 782 OH TYR A 48 11.081 0.921 -5.066 1.00 0.00 O ATOM 0 H TYR A 48 18.237 -1.981 -1.652 1.00 0.00 H new ATOM 0 HA TYR A 48 15.805 -2.824 -3.085 1.00 0.00 H new ATOM 0 HB2 TYR A 48 15.365 -1.141 -1.219 1.00 0.00 H new ATOM 0 HB3 TYR A 48 16.377 -0.011 -2.096 1.00 0.00 H new ATOM 0 HD1 TYR A 48 13.707 -2.391 -3.346 1.00 0.00 H new ATOM 0 HD2 TYR A 48 15.007 1.692 -2.890 1.00 0.00 H new ATOM 0 HE1 TYR A 48 11.694 -1.617 -4.579 1.00 0.00 H new ATOM 0 HE2 TYR A 48 12.984 2.472 -4.103 1.00 0.00 H new ATOM 0 HH TYR A 48 11.098 1.899 -5.122 1.00 0.00 H new ATOM 792 N ALA A 49 16.654 -1.819 -5.256 1.00 0.00 N ATOM 793 CA ALA A 49 17.205 -1.403 -6.554 1.00 0.00 C ATOM 794 C ALA A 49 18.703 -1.766 -6.765 1.00 0.00 C ATOM 795 O ALA A 49 19.463 -1.035 -7.404 1.00 0.00 O ATOM 796 CB ALA A 49 16.886 0.089 -6.726 1.00 0.00 C ATOM 0 H ALA A 49 15.766 -2.314 -5.340 1.00 0.00 H new ATOM 0 HA ALA A 49 16.728 -1.974 -7.351 1.00 0.00 H new ATOM 0 HB1 ALA A 49 17.280 0.438 -7.681 1.00 0.00 H new ATOM 0 HB2 ALA A 49 15.806 0.235 -6.704 1.00 0.00 H new ATOM 0 HB3 ALA A 49 17.345 0.655 -5.916 1.00 0.00 H new ATOM 802 N GLY A 50 19.139 -2.896 -6.197 1.00 0.00 N ATOM 803 CA GLY A 50 20.509 -3.419 -6.229 1.00 0.00 C ATOM 804 C GLY A 50 21.517 -2.688 -5.332 1.00 0.00 C ATOM 805 O GLY A 50 22.724 -2.836 -5.532 1.00 0.00 O ATOM 0 H GLY A 50 18.510 -3.504 -5.673 1.00 0.00 H new ATOM 0 HA2 GLY A 50 20.485 -4.469 -5.938 1.00 0.00 H new ATOM 0 HA3 GLY A 50 20.870 -3.381 -7.257 1.00 0.00 H new ATOM 809 N LYS A 51 21.048 -1.916 -4.343 1.00 0.00 N ATOM 810 CA LYS A 51 21.853 -1.178 -3.353 1.00 0.00 C ATOM 811 C LYS A 51 21.376 -1.483 -1.929 1.00 0.00 C ATOM 812 O LYS A 51 20.181 -1.413 -1.635 1.00 0.00 O ATOM 813 CB LYS A 51 21.771 0.335 -3.636 1.00 0.00 C ATOM 814 CG LYS A 51 22.407 0.722 -4.984 1.00 0.00 C ATOM 815 CD LYS A 51 22.309 2.225 -5.286 1.00 0.00 C ATOM 816 CE LYS A 51 23.163 3.068 -4.329 1.00 0.00 C ATOM 817 NZ LYS A 51 23.122 4.510 -4.689 1.00 0.00 N ATOM 0 H LYS A 51 20.047 -1.781 -4.202 1.00 0.00 H new ATOM 0 HA LYS A 51 22.891 -1.499 -3.437 1.00 0.00 H new ATOM 0 HB2 LYS A 51 20.726 0.646 -3.629 1.00 0.00 H new ATOM 0 HB3 LYS A 51 22.270 0.878 -2.834 1.00 0.00 H new ATOM 0 HG2 LYS A 51 23.456 0.425 -4.983 1.00 0.00 H new ATOM 0 HG3 LYS A 51 21.919 0.164 -5.783 1.00 0.00 H new ATOM 0 HD2 LYS A 51 22.628 2.409 -6.312 1.00 0.00 H new ATOM 0 HD3 LYS A 51 21.268 2.541 -5.215 1.00 0.00 H new ATOM 0 HE2 LYS A 51 22.805 2.936 -3.308 1.00 0.00 H new ATOM 0 HE3 LYS A 51 24.194 2.715 -4.353 1.00 0.00 H new ATOM 0 HZ1 LYS A 51 23.709 5.051 -4.023 1.00 0.00 H new ATOM 0 HZ2 LYS A 51 23.487 4.637 -5.654 1.00 0.00 H new ATOM 0 HZ3 LYS A 51 22.141 4.852 -4.642 1.00 0.00 H new ATOM 831 N ILE A 52 22.300 -1.838 -1.034 1.00 0.00 N ATOM 832 CA ILE A 52 21.997 -2.059 0.387 1.00 0.00 C ATOM 833 C ILE A 52 21.614 -0.737 1.062 1.00 0.00 C ATOM 834 O ILE A 52 22.343 0.256 0.992 1.00 0.00 O ATOM 835 CB ILE A 52 23.169 -2.753 1.110 1.00 0.00 C ATOM 836 CG1 ILE A 52 23.679 -3.922 0.236 1.00 0.00 C ATOM 837 CG2 ILE A 52 22.728 -3.207 2.512 1.00 0.00 C ATOM 838 CD1 ILE A 52 24.308 -5.095 0.970 1.00 0.00 C ATOM 0 H ILE A 52 23.282 -1.981 -1.271 1.00 0.00 H new ATOM 0 HA ILE A 52 21.142 -2.731 0.456 1.00 0.00 H new ATOM 0 HB ILE A 52 23.997 -2.059 1.252 1.00 0.00 H new ATOM 0 HG12 ILE A 52 22.842 -4.298 -0.353 1.00 0.00 H new ATOM 0 HG13 ILE A 52 24.412 -3.527 -0.467 1.00 0.00 H new ATOM 0 HG21 ILE A 52 23.562 -3.696 3.015 1.00 0.00 H new ATOM 0 HG22 ILE A 52 22.412 -2.340 3.092 1.00 0.00 H new ATOM 0 HG23 ILE A 52 21.897 -3.907 2.423 1.00 0.00 H new ATOM 0 HD11 ILE A 52 24.625 -5.848 0.248 1.00 0.00 H new ATOM 0 HD12 ILE A 52 25.172 -4.749 1.536 1.00 0.00 H new ATOM 0 HD13 ILE A 52 23.578 -5.531 1.652 1.00 0.00 H new ATOM 850 N LEU A 53 20.452 -0.734 1.706 1.00 0.00 N ATOM 851 CA LEU A 53 19.915 0.360 2.502 1.00 0.00 C ATOM 852 C LEU A 53 20.772 0.572 3.763 1.00 0.00 C ATOM 853 O LEU A 53 20.927 -0.339 4.581 1.00 0.00 O ATOM 854 CB LEU A 53 18.456 0.041 2.870 1.00 0.00 C ATOM 855 CG LEU A 53 17.499 -0.281 1.711 1.00 0.00 C ATOM 856 CD1 LEU A 53 16.064 -0.347 2.235 1.00 0.00 C ATOM 857 CD2 LEU A 53 17.545 0.792 0.637 1.00 0.00 C ATOM 0 H LEU A 53 19.827 -1.539 1.684 1.00 0.00 H new ATOM 0 HA LEU A 53 19.941 1.285 1.926 1.00 0.00 H new ATOM 0 HB2 LEU A 53 18.457 -0.807 3.554 1.00 0.00 H new ATOM 0 HB3 LEU A 53 18.051 0.892 3.418 1.00 0.00 H new ATOM 0 HG LEU A 53 17.811 -1.235 1.285 1.00 0.00 H new ATOM 0 HD11 LEU A 53 15.386 -0.575 1.412 1.00 0.00 H new ATOM 0 HD12 LEU A 53 15.989 -1.126 2.994 1.00 0.00 H new ATOM 0 HD13 LEU A 53 15.792 0.613 2.673 1.00 0.00 H new ATOM 0 HD21 LEU A 53 16.856 0.532 -0.167 1.00 0.00 H new ATOM 0 HD22 LEU A 53 17.255 1.750 1.068 1.00 0.00 H new ATOM 0 HD23 LEU A 53 18.557 0.865 0.238 1.00 0.00 H new ATOM 869 N ASN A 54 21.355 1.761 3.914 1.00 0.00 N ATOM 870 CA ASN A 54 22.181 2.119 5.074 1.00 0.00 C ATOM 871 C ASN A 54 21.328 2.238 6.352 1.00 0.00 C ATOM 872 O ASN A 54 20.352 2.985 6.381 1.00 0.00 O ATOM 873 CB ASN A 54 22.922 3.430 4.779 1.00 0.00 C ATOM 874 CG ASN A 54 24.041 3.256 3.766 1.00 0.00 C ATOM 875 OD1 ASN A 54 25.008 2.538 3.988 1.00 0.00 O ATOM 876 ND2 ASN A 54 23.963 3.915 2.632 1.00 0.00 N ATOM 0 H ASN A 54 21.268 2.512 3.230 1.00 0.00 H new ATOM 0 HA ASN A 54 22.910 1.328 5.250 1.00 0.00 H new ATOM 0 HB2 ASN A 54 22.212 4.168 4.406 1.00 0.00 H new ATOM 0 HB3 ASN A 54 23.336 3.826 5.707 1.00 0.00 H new ATOM 0 HD21 ASN A 54 24.707 3.828 1.939 1.00 0.00 H new ATOM 0 HD22 ASN A 54 23.159 4.514 2.444 1.00 0.00 H new ATOM 883 N ASP A 55 21.704 1.520 7.414 1.00 0.00 N ATOM 884 CA ASP A 55 20.927 1.341 8.654 1.00 0.00 C ATOM 885 C ASP A 55 20.466 2.662 9.300 1.00 0.00 C ATOM 886 O ASP A 55 19.293 2.816 9.642 1.00 0.00 O ATOM 887 CB ASP A 55 21.755 0.537 9.669 1.00 0.00 C ATOM 888 CG ASP A 55 22.113 -0.866 9.162 1.00 0.00 C ATOM 889 OD1 ASP A 55 23.133 -1.009 8.446 1.00 0.00 O ATOM 890 OD2 ASP A 55 21.384 -1.830 9.493 1.00 0.00 O ATOM 0 H ASP A 55 22.595 1.025 7.439 1.00 0.00 H new ATOM 0 HA ASP A 55 20.022 0.803 8.372 1.00 0.00 H new ATOM 0 HB2 ASP A 55 22.671 1.081 9.897 1.00 0.00 H new ATOM 0 HB3 ASP A 55 21.196 0.451 10.601 1.00 0.00 H new ATOM 895 N ASP A 56 21.389 3.614 9.471 1.00 0.00 N ATOM 896 CA ASP A 56 21.150 4.926 10.091 1.00 0.00 C ATOM 897 C ASP A 56 20.407 5.926 9.175 1.00 0.00 C ATOM 898 O ASP A 56 19.920 6.959 9.641 1.00 0.00 O ATOM 899 CB ASP A 56 22.513 5.494 10.521 1.00 0.00 C ATOM 900 CG ASP A 56 22.396 6.768 11.378 1.00 0.00 C ATOM 901 OD1 ASP A 56 21.844 6.693 12.503 1.00 0.00 O ATOM 902 OD2 ASP A 56 22.903 7.836 10.956 1.00 0.00 O ATOM 0 H ASP A 56 22.356 3.490 9.172 1.00 0.00 H new ATOM 0 HA ASP A 56 20.489 4.782 10.945 1.00 0.00 H new ATOM 0 HB2 ASP A 56 23.055 4.734 11.084 1.00 0.00 H new ATOM 0 HB3 ASP A 56 23.104 5.715 9.632 1.00 0.00 H new ATOM 907 N THR A 57 20.302 5.639 7.875 1.00 0.00 N ATOM 908 CA THR A 57 19.643 6.497 6.876 1.00 0.00 C ATOM 909 C THR A 57 18.122 6.292 6.900 1.00 0.00 C ATOM 910 O THR A 57 17.628 5.197 7.183 1.00 0.00 O ATOM 911 CB THR A 57 20.242 6.223 5.484 1.00 0.00 C ATOM 912 OG1 THR A 57 21.635 6.469 5.535 1.00 0.00 O ATOM 913 CG2 THR A 57 19.710 7.134 4.386 1.00 0.00 C ATOM 0 H THR A 57 20.682 4.782 7.473 1.00 0.00 H new ATOM 0 HA THR A 57 19.824 7.543 7.122 1.00 0.00 H new ATOM 0 HB THR A 57 19.976 5.193 5.247 1.00 0.00 H new ATOM 0 HG1 THR A 57 22.003 6.453 4.627 1.00 0.00 H new ATOM 0 HG21 THR A 57 20.182 6.875 3.438 1.00 0.00 H new ATOM 0 HG22 THR A 57 18.631 7.008 4.300 1.00 0.00 H new ATOM 0 HG23 THR A 57 19.936 8.171 4.633 1.00 0.00 H new ATOM 921 N ALA A 58 17.352 7.352 6.632 1.00 0.00 N ATOM 922 CA ALA A 58 15.889 7.303 6.648 1.00 0.00 C ATOM 923 C ALA A 58 15.277 6.626 5.404 1.00 0.00 C ATOM 924 O ALA A 58 15.890 6.584 4.339 1.00 0.00 O ATOM 925 CB ALA A 58 15.357 8.720 6.850 1.00 0.00 C ATOM 0 H ALA A 58 17.729 8.270 6.397 1.00 0.00 H new ATOM 0 HA ALA A 58 15.580 6.669 7.479 1.00 0.00 H new ATOM 0 HB1 ALA A 58 14.267 8.701 6.864 1.00 0.00 H new ATOM 0 HB2 ALA A 58 15.725 9.115 7.797 1.00 0.00 H new ATOM 0 HB3 ALA A 58 15.698 9.357 6.034 1.00 0.00 H new ATOM 931 N LEU A 59 14.036 6.136 5.507 1.00 0.00 N ATOM 932 CA LEU A 59 13.340 5.459 4.395 1.00 0.00 C ATOM 933 C LEU A 59 12.950 6.415 3.251 1.00 0.00 C ATOM 934 O LEU A 59 12.960 6.022 2.081 1.00 0.00 O ATOM 935 CB LEU A 59 12.116 4.706 4.949 1.00 0.00 C ATOM 936 CG LEU A 59 12.496 3.541 5.882 1.00 0.00 C ATOM 937 CD1 LEU A 59 11.252 2.976 6.553 1.00 0.00 C ATOM 938 CD2 LEU A 59 13.148 2.385 5.126 1.00 0.00 C ATOM 0 H LEU A 59 13.482 6.195 6.361 1.00 0.00 H new ATOM 0 HA LEU A 59 14.035 4.748 3.948 1.00 0.00 H new ATOM 0 HB2 LEU A 59 11.481 5.406 5.492 1.00 0.00 H new ATOM 0 HB3 LEU A 59 11.527 4.320 4.117 1.00 0.00 H new ATOM 0 HG LEU A 59 13.198 3.950 6.609 1.00 0.00 H new ATOM 0 HD11 LEU A 59 11.535 2.153 7.210 1.00 0.00 H new ATOM 0 HD12 LEU A 59 10.768 3.758 7.138 1.00 0.00 H new ATOM 0 HD13 LEU A 59 10.562 2.612 5.792 1.00 0.00 H new ATOM 0 HD21 LEU A 59 13.398 1.588 5.826 1.00 0.00 H new ATOM 0 HD22 LEU A 59 12.455 2.005 4.375 1.00 0.00 H new ATOM 0 HD23 LEU A 59 14.056 2.737 4.637 1.00 0.00 H new ATOM 950 N LYS A 60 12.695 7.692 3.568 1.00 0.00 N ATOM 951 CA LYS A 60 12.440 8.776 2.596 1.00 0.00 C ATOM 952 C LYS A 60 13.601 9.026 1.623 1.00 0.00 C ATOM 953 O LYS A 60 13.380 9.550 0.532 1.00 0.00 O ATOM 954 CB LYS A 60 12.087 10.080 3.336 1.00 0.00 C ATOM 955 CG LYS A 60 10.753 9.990 4.094 1.00 0.00 C ATOM 956 CD LYS A 60 10.391 11.343 4.721 1.00 0.00 C ATOM 957 CE LYS A 60 9.058 11.251 5.475 1.00 0.00 C ATOM 958 NZ LYS A 60 8.646 12.577 6.009 1.00 0.00 N ATOM 0 H LYS A 60 12.658 8.014 4.535 1.00 0.00 H new ATOM 0 HA LYS A 60 11.598 8.444 1.989 1.00 0.00 H new ATOM 0 HB2 LYS A 60 12.884 10.321 4.039 1.00 0.00 H new ATOM 0 HB3 LYS A 60 12.037 10.898 2.618 1.00 0.00 H new ATOM 0 HG2 LYS A 60 9.962 9.677 3.412 1.00 0.00 H new ATOM 0 HG3 LYS A 60 10.822 9.230 4.872 1.00 0.00 H new ATOM 0 HD2 LYS A 60 11.180 11.656 5.404 1.00 0.00 H new ATOM 0 HD3 LYS A 60 10.323 12.104 3.943 1.00 0.00 H new ATOM 0 HE2 LYS A 60 8.286 10.870 4.807 1.00 0.00 H new ATOM 0 HE3 LYS A 60 9.150 10.539 6.295 1.00 0.00 H new ATOM 0 HZ1 LYS A 60 7.741 12.482 6.513 1.00 0.00 H new ATOM 0 HZ2 LYS A 60 9.373 12.928 6.665 1.00 0.00 H new ATOM 0 HZ3 LYS A 60 8.535 13.249 5.223 1.00 0.00 H new ATOM 972 N GLU A 61 14.821 8.615 1.968 1.00 0.00 N ATOM 973 CA GLU A 61 16.020 8.715 1.117 1.00 0.00 C ATOM 974 C GLU A 61 16.033 7.714 -0.053 1.00 0.00 C ATOM 975 O GLU A 61 16.804 7.882 -1.000 1.00 0.00 O ATOM 976 CB GLU A 61 17.269 8.492 1.985 1.00 0.00 C ATOM 977 CG GLU A 61 17.437 9.582 3.060 1.00 0.00 C ATOM 978 CD GLU A 61 17.722 10.968 2.448 1.00 0.00 C ATOM 979 OE1 GLU A 61 18.887 11.243 2.071 1.00 0.00 O ATOM 980 OE2 GLU A 61 16.785 11.796 2.342 1.00 0.00 O ATOM 0 H GLU A 61 15.015 8.189 2.874 1.00 0.00 H new ATOM 0 HA GLU A 61 16.012 9.712 0.676 1.00 0.00 H new ATOM 0 HB2 GLU A 61 17.204 7.517 2.467 1.00 0.00 H new ATOM 0 HB3 GLU A 61 18.153 8.474 1.348 1.00 0.00 H new ATOM 0 HG2 GLU A 61 16.533 9.634 3.666 1.00 0.00 H new ATOM 0 HG3 GLU A 61 18.253 9.307 3.728 1.00 0.00 H new ATOM 987 N TYR A 62 15.163 6.698 -0.012 1.00 0.00 N ATOM 988 CA TYR A 62 15.116 5.582 -0.965 1.00 0.00 C ATOM 989 C TYR A 62 13.782 5.488 -1.727 1.00 0.00 C ATOM 990 O TYR A 62 13.648 4.671 -2.639 1.00 0.00 O ATOM 991 CB TYR A 62 15.445 4.293 -0.201 1.00 0.00 C ATOM 992 CG TYR A 62 16.862 4.254 0.344 1.00 0.00 C ATOM 993 CD1 TYR A 62 17.932 3.994 -0.535 1.00 0.00 C ATOM 994 CD2 TYR A 62 17.114 4.442 1.720 1.00 0.00 C ATOM 995 CE1 TYR A 62 19.247 3.892 -0.043 1.00 0.00 C ATOM 996 CE2 TYR A 62 18.430 4.337 2.218 1.00 0.00 C ATOM 997 CZ TYR A 62 19.498 4.058 1.337 1.00 0.00 C ATOM 998 OH TYR A 62 20.766 3.930 1.818 1.00 0.00 O ATOM 0 H TYR A 62 14.447 6.628 0.711 1.00 0.00 H new ATOM 0 HA TYR A 62 15.858 5.751 -1.745 1.00 0.00 H new ATOM 0 HB2 TYR A 62 14.743 4.182 0.626 1.00 0.00 H new ATOM 0 HB3 TYR A 62 15.296 3.440 -0.863 1.00 0.00 H new ATOM 0 HD1 TYR A 62 17.742 3.872 -1.591 1.00 0.00 H new ATOM 0 HD2 TYR A 62 16.299 4.666 2.392 1.00 0.00 H new ATOM 0 HE1 TYR A 62 20.063 3.687 -0.720 1.00 0.00 H new ATOM 0 HE2 TYR A 62 18.621 4.470 3.273 1.00 0.00 H new ATOM 0 HH TYR A 62 20.872 4.492 2.614 1.00 0.00 H new ATOM 1008 N LYS A 63 12.813 6.354 -1.385 1.00 0.00 N ATOM 1009 CA LYS A 63 11.483 6.520 -2.008 1.00 0.00 C ATOM 1010 C LYS A 63 10.728 5.194 -2.250 1.00 0.00 C ATOM 1011 O LYS A 63 10.049 5.024 -3.265 1.00 0.00 O ATOM 1012 CB LYS A 63 11.599 7.395 -3.275 1.00 0.00 C ATOM 1013 CG LYS A 63 12.146 8.808 -3.012 1.00 0.00 C ATOM 1014 CD LYS A 63 11.192 9.693 -2.191 1.00 0.00 C ATOM 1015 CE LYS A 63 11.617 11.169 -2.171 1.00 0.00 C ATOM 1016 NZ LYS A 63 12.975 11.364 -1.598 1.00 0.00 N ATOM 0 H LYS A 63 12.945 7.004 -0.611 1.00 0.00 H new ATOM 0 HA LYS A 63 10.853 7.043 -1.288 1.00 0.00 H new ATOM 0 HB2 LYS A 63 12.248 6.893 -3.992 1.00 0.00 H new ATOM 0 HB3 LYS A 63 10.616 7.478 -3.738 1.00 0.00 H new ATOM 0 HG2 LYS A 63 13.098 8.729 -2.486 1.00 0.00 H new ATOM 0 HG3 LYS A 63 12.349 9.294 -3.966 1.00 0.00 H new ATOM 0 HD2 LYS A 63 10.186 9.615 -2.604 1.00 0.00 H new ATOM 0 HD3 LYS A 63 11.147 9.319 -1.168 1.00 0.00 H new ATOM 0 HE2 LYS A 63 11.595 11.564 -3.187 1.00 0.00 H new ATOM 0 HE3 LYS A 63 10.895 11.743 -1.590 1.00 0.00 H new ATOM 0 HZ1 LYS A 63 13.061 12.333 -1.232 1.00 0.00 H new ATOM 0 HZ2 LYS A 63 13.126 10.686 -0.823 1.00 0.00 H new ATOM 0 HZ3 LYS A 63 13.689 11.209 -2.338 1.00 0.00 H new ATOM 1030 N ILE A 64 10.866 4.247 -1.317 1.00 0.00 N ATOM 1031 CA ILE A 64 10.285 2.894 -1.373 1.00 0.00 C ATOM 1032 C ILE A 64 8.749 2.975 -1.470 1.00 0.00 C ATOM 1033 O ILE A 64 8.117 3.820 -0.831 1.00 0.00 O ATOM 1034 CB ILE A 64 10.744 2.052 -0.152 1.00 0.00 C ATOM 1035 CG1 ILE A 64 12.285 2.047 0.014 1.00 0.00 C ATOM 1036 CG2 ILE A 64 10.247 0.598 -0.267 1.00 0.00 C ATOM 1037 CD1 ILE A 64 12.745 1.472 1.358 1.00 0.00 C ATOM 0 H ILE A 64 11.406 4.404 -0.466 1.00 0.00 H new ATOM 0 HA ILE A 64 10.646 2.390 -2.269 1.00 0.00 H new ATOM 0 HB ILE A 64 10.305 2.524 0.727 1.00 0.00 H new ATOM 0 HG12 ILE A 64 12.729 1.465 -0.794 1.00 0.00 H new ATOM 0 HG13 ILE A 64 12.658 3.066 -0.085 1.00 0.00 H new ATOM 0 HG21 ILE A 64 10.582 0.029 0.601 1.00 0.00 H new ATOM 0 HG22 ILE A 64 9.158 0.588 -0.309 1.00 0.00 H new ATOM 0 HG23 ILE A 64 10.649 0.147 -1.174 1.00 0.00 H new ATOM 0 HD11 ILE A 64 13.833 1.497 1.411 1.00 0.00 H new ATOM 0 HD12 ILE A 64 12.328 2.068 2.170 1.00 0.00 H new ATOM 0 HD13 ILE A 64 12.401 0.442 1.450 1.00 0.00 H new ATOM 1049 N ASP A 65 8.145 2.092 -2.266 1.00 0.00 N ATOM 1050 CA ASP A 65 6.691 1.972 -2.451 1.00 0.00 C ATOM 1051 C ASP A 65 6.109 0.761 -1.688 1.00 0.00 C ATOM 1052 O ASP A 65 6.827 -0.145 -1.264 1.00 0.00 O ATOM 1053 CB ASP A 65 6.401 1.905 -3.959 1.00 0.00 C ATOM 1054 CG ASP A 65 4.919 1.701 -4.287 1.00 0.00 C ATOM 1055 OD1 ASP A 65 4.068 2.489 -3.821 1.00 0.00 O ATOM 1056 OD2 ASP A 65 4.588 0.710 -4.977 1.00 0.00 O ATOM 0 H ASP A 65 8.669 1.415 -2.821 1.00 0.00 H new ATOM 0 HA ASP A 65 6.195 2.845 -2.028 1.00 0.00 H new ATOM 0 HB2 ASP A 65 6.746 2.826 -4.429 1.00 0.00 H new ATOM 0 HB3 ASP A 65 6.977 1.090 -4.396 1.00 0.00 H new ATOM 1061 N GLU A 66 4.788 0.745 -1.509 1.00 0.00 N ATOM 1062 CA GLU A 66 4.062 -0.304 -0.781 1.00 0.00 C ATOM 1063 C GLU A 66 3.713 -1.515 -1.665 1.00 0.00 C ATOM 1064 O GLU A 66 3.788 -2.662 -1.218 1.00 0.00 O ATOM 1065 CB GLU A 66 2.768 0.281 -0.187 1.00 0.00 C ATOM 1066 CG GLU A 66 3.029 1.413 0.816 1.00 0.00 C ATOM 1067 CD GLU A 66 1.715 1.932 1.431 1.00 0.00 C ATOM 1068 OE1 GLU A 66 0.923 2.599 0.721 1.00 0.00 O ATOM 1069 OE2 GLU A 66 1.482 1.691 2.639 1.00 0.00 O ATOM 0 H GLU A 66 4.176 1.476 -1.873 1.00 0.00 H new ATOM 0 HA GLU A 66 4.724 -0.659 0.009 1.00 0.00 H new ATOM 0 HB2 GLU A 66 2.141 0.656 -0.995 1.00 0.00 H new ATOM 0 HB3 GLU A 66 2.209 -0.514 0.307 1.00 0.00 H new ATOM 0 HG2 GLU A 66 3.687 1.055 1.608 1.00 0.00 H new ATOM 0 HG3 GLU A 66 3.547 2.232 0.317 1.00 0.00 H new ATOM 1076 N LYS A 67 3.320 -1.267 -2.923 1.00 0.00 N ATOM 1077 CA LYS A 67 2.894 -2.279 -3.907 1.00 0.00 C ATOM 1078 C LYS A 67 4.084 -3.045 -4.493 1.00 0.00 C ATOM 1079 O LYS A 67 4.004 -4.256 -4.708 1.00 0.00 O ATOM 1080 CB LYS A 67 2.111 -1.599 -5.046 1.00 0.00 C ATOM 1081 CG LYS A 67 0.924 -0.750 -4.555 1.00 0.00 C ATOM 1082 CD LYS A 67 0.266 0.065 -5.680 1.00 0.00 C ATOM 1083 CE LYS A 67 0.832 1.491 -5.819 1.00 0.00 C ATOM 1084 NZ LYS A 67 2.228 1.536 -6.330 1.00 0.00 N ATOM 0 H LYS A 67 3.288 -0.320 -3.300 1.00 0.00 H new ATOM 0 HA LYS A 67 2.258 -2.996 -3.388 1.00 0.00 H new ATOM 0 HB2 LYS A 67 2.791 -0.964 -5.615 1.00 0.00 H new ATOM 0 HB3 LYS A 67 1.742 -2.364 -5.729 1.00 0.00 H new ATOM 0 HG2 LYS A 67 0.178 -1.404 -4.103 1.00 0.00 H new ATOM 0 HG3 LYS A 67 1.268 -0.071 -3.774 1.00 0.00 H new ATOM 0 HD2 LYS A 67 0.397 -0.463 -6.625 1.00 0.00 H new ATOM 0 HD3 LYS A 67 -0.806 0.125 -5.495 1.00 0.00 H new ATOM 0 HE2 LYS A 67 0.191 2.062 -6.490 1.00 0.00 H new ATOM 0 HE3 LYS A 67 0.795 1.983 -4.847 1.00 0.00 H new ATOM 0 HZ1 LYS A 67 2.500 2.524 -6.510 1.00 0.00 H new ATOM 0 HZ2 LYS A 67 2.870 1.123 -5.624 1.00 0.00 H new ATOM 0 HZ3 LYS A 67 2.292 0.993 -7.215 1.00 0.00 H new ATOM 1098 N ASN A 68 5.182 -2.333 -4.752 1.00 0.00 N ATOM 1099 CA ASN A 68 6.476 -2.901 -5.149 1.00 0.00 C ATOM 1100 C ASN A 68 7.196 -3.513 -3.931 1.00 0.00 C ATOM 1101 O ASN A 68 6.838 -3.217 -2.788 1.00 0.00 O ATOM 1102 CB ASN A 68 7.319 -1.796 -5.809 1.00 0.00 C ATOM 1103 CG ASN A 68 6.762 -1.375 -7.163 1.00 0.00 C ATOM 1104 OD1 ASN A 68 7.100 -1.925 -8.201 1.00 0.00 O ATOM 1105 ND2 ASN A 68 5.882 -0.401 -7.213 1.00 0.00 N ATOM 0 H ASN A 68 5.198 -1.315 -4.690 1.00 0.00 H new ATOM 0 HA ASN A 68 6.324 -3.707 -5.867 1.00 0.00 H new ATOM 0 HB2 ASN A 68 7.358 -0.929 -5.149 1.00 0.00 H new ATOM 0 HB3 ASN A 68 8.343 -2.149 -5.933 1.00 0.00 H new ATOM 0 HD21 ASN A 68 5.490 -0.113 -8.110 1.00 0.00 H new ATOM 0 HD22 ASN A 68 5.590 0.067 -6.355 1.00 0.00 H new ATOM 1112 N PHE A 69 8.224 -4.343 -4.156 1.00 0.00 N ATOM 1113 CA PHE A 69 8.915 -5.065 -3.078 1.00 0.00 C ATOM 1114 C PHE A 69 10.391 -4.684 -2.900 1.00 0.00 C ATOM 1115 O PHE A 69 11.111 -4.369 -3.851 1.00 0.00 O ATOM 1116 CB PHE A 69 8.723 -6.586 -3.228 1.00 0.00 C ATOM 1117 CG PHE A 69 9.470 -7.269 -4.364 1.00 0.00 C ATOM 1118 CD1 PHE A 69 10.808 -7.677 -4.191 1.00 0.00 C ATOM 1119 CD2 PHE A 69 8.810 -7.559 -5.575 1.00 0.00 C ATOM 1120 CE1 PHE A 69 11.486 -8.352 -5.222 1.00 0.00 C ATOM 1121 CE2 PHE A 69 9.484 -8.247 -6.601 1.00 0.00 C ATOM 1122 CZ PHE A 69 10.823 -8.639 -6.428 1.00 0.00 C ATOM 0 H PHE A 69 8.599 -4.532 -5.086 1.00 0.00 H new ATOM 0 HA PHE A 69 8.439 -4.744 -2.151 1.00 0.00 H new ATOM 0 HB2 PHE A 69 9.023 -7.059 -2.293 1.00 0.00 H new ATOM 0 HB3 PHE A 69 7.658 -6.782 -3.357 1.00 0.00 H new ATOM 0 HD1 PHE A 69 11.316 -7.470 -3.261 1.00 0.00 H new ATOM 0 HD2 PHE A 69 7.784 -7.252 -5.716 1.00 0.00 H new ATOM 0 HE1 PHE A 69 12.515 -8.650 -5.087 1.00 0.00 H new ATOM 0 HE2 PHE A 69 8.971 -8.475 -7.524 1.00 0.00 H new ATOM 0 HZ PHE A 69 11.341 -9.159 -7.220 1.00 0.00 H new ATOM 1132 N VAL A 70 10.831 -4.757 -1.644 1.00 0.00 N ATOM 1133 CA VAL A 70 12.219 -4.673 -1.168 1.00 0.00 C ATOM 1134 C VAL A 70 12.718 -6.105 -0.904 1.00 0.00 C ATOM 1135 O VAL A 70 11.912 -7.032 -0.779 1.00 0.00 O ATOM 1136 CB VAL A 70 12.271 -3.764 0.092 1.00 0.00 C ATOM 1137 CG1 VAL A 70 12.628 -4.475 1.395 1.00 0.00 C ATOM 1138 CG2 VAL A 70 13.267 -2.617 -0.081 1.00 0.00 C ATOM 0 H VAL A 70 10.179 -4.886 -0.870 1.00 0.00 H new ATOM 0 HA VAL A 70 12.879 -4.220 -1.908 1.00 0.00 H new ATOM 0 HB VAL A 70 11.246 -3.403 0.176 1.00 0.00 H new ATOM 0 HG11 VAL A 70 12.638 -3.754 2.212 1.00 0.00 H new ATOM 0 HG12 VAL A 70 11.888 -5.248 1.602 1.00 0.00 H new ATOM 0 HG13 VAL A 70 13.614 -4.931 1.302 1.00 0.00 H new ATOM 0 HG21 VAL A 70 13.275 -2.003 0.820 1.00 0.00 H new ATOM 0 HG22 VAL A 70 14.264 -3.023 -0.253 1.00 0.00 H new ATOM 0 HG23 VAL A 70 12.973 -2.005 -0.934 1.00 0.00 H new ATOM 1148 N VAL A 71 14.029 -6.305 -0.755 1.00 0.00 N ATOM 1149 CA VAL A 71 14.599 -7.621 -0.405 1.00 0.00 C ATOM 1150 C VAL A 71 15.196 -7.603 0.998 1.00 0.00 C ATOM 1151 O VAL A 71 16.032 -6.757 1.323 1.00 0.00 O ATOM 1152 CB VAL A 71 15.609 -8.113 -1.454 1.00 0.00 C ATOM 1153 CG1 VAL A 71 16.156 -9.502 -1.099 1.00 0.00 C ATOM 1154 CG2 VAL A 71 14.936 -8.243 -2.825 1.00 0.00 C ATOM 0 H VAL A 71 14.726 -5.570 -0.871 1.00 0.00 H new ATOM 0 HA VAL A 71 13.781 -8.341 -0.406 1.00 0.00 H new ATOM 0 HB VAL A 71 16.417 -7.381 -1.475 1.00 0.00 H new ATOM 0 HG11 VAL A 71 16.867 -9.819 -1.862 1.00 0.00 H new ATOM 0 HG12 VAL A 71 16.656 -9.460 -0.132 1.00 0.00 H new ATOM 0 HG13 VAL A 71 15.333 -10.216 -1.051 1.00 0.00 H new ATOM 0 HG21 VAL A 71 15.665 -8.592 -3.556 1.00 0.00 H new ATOM 0 HG22 VAL A 71 14.115 -8.957 -2.761 1.00 0.00 H new ATOM 0 HG23 VAL A 71 14.549 -7.272 -3.134 1.00 0.00 H new ATOM 1164 N VAL A 72 14.763 -8.559 1.824 1.00 0.00 N ATOM 1165 CA VAL A 72 15.320 -8.853 3.152 1.00 0.00 C ATOM 1166 C VAL A 72 16.148 -10.141 3.092 1.00 0.00 C ATOM 1167 O VAL A 72 15.738 -11.143 2.500 1.00 0.00 O ATOM 1168 CB VAL A 72 14.224 -8.913 4.237 1.00 0.00 C ATOM 1169 CG1 VAL A 72 13.127 -9.947 3.946 1.00 0.00 C ATOM 1170 CG2 VAL A 72 14.823 -9.182 5.630 1.00 0.00 C ATOM 0 H VAL A 72 13.986 -9.174 1.580 1.00 0.00 H new ATOM 0 HA VAL A 72 15.980 -8.035 3.440 1.00 0.00 H new ATOM 0 HB VAL A 72 13.756 -7.929 4.222 1.00 0.00 H new ATOM 0 HG11 VAL A 72 12.392 -9.933 4.750 1.00 0.00 H new ATOM 0 HG12 VAL A 72 12.638 -9.703 3.003 1.00 0.00 H new ATOM 0 HG13 VAL A 72 13.572 -10.940 3.878 1.00 0.00 H new ATOM 0 HG21 VAL A 72 14.023 -9.218 6.369 1.00 0.00 H new ATOM 0 HG22 VAL A 72 15.352 -10.135 5.621 1.00 0.00 H new ATOM 0 HG23 VAL A 72 15.519 -8.384 5.887 1.00 0.00 H new ATOM 1180 N MET A 73 17.315 -10.126 3.730 1.00 0.00 N ATOM 1181 CA MET A 73 18.158 -11.300 3.969 1.00 0.00 C ATOM 1182 C MET A 73 18.728 -11.290 5.386 1.00 0.00 C ATOM 1183 O MET A 73 18.621 -10.289 6.092 1.00 0.00 O ATOM 1184 CB MET A 73 19.243 -11.397 2.890 1.00 0.00 C ATOM 1185 CG MET A 73 20.267 -10.262 2.899 1.00 0.00 C ATOM 1186 SD MET A 73 21.581 -10.422 1.657 1.00 0.00 S ATOM 1187 CE MET A 73 22.430 -11.896 2.285 1.00 0.00 C ATOM 0 H MET A 73 17.716 -9.268 4.109 1.00 0.00 H new ATOM 0 HA MET A 73 17.547 -12.200 3.895 1.00 0.00 H new ATOM 0 HB2 MET A 73 19.771 -12.343 3.011 1.00 0.00 H new ATOM 0 HB3 MET A 73 18.761 -11.423 1.913 1.00 0.00 H new ATOM 0 HG2 MET A 73 19.746 -9.318 2.738 1.00 0.00 H new ATOM 0 HG3 MET A 73 20.723 -10.210 3.887 1.00 0.00 H new ATOM 0 HE1 MET A 73 23.391 -12.004 1.783 1.00 0.00 H new ATOM 0 HE2 MET A 73 22.591 -11.794 3.358 1.00 0.00 H new ATOM 0 HE3 MET A 73 21.819 -12.778 2.092 1.00 0.00 H new ATOM 1197 N VAL A 74 19.341 -12.399 5.799 1.00 0.00 N ATOM 1198 CA VAL A 74 19.998 -12.553 7.102 1.00 0.00 C ATOM 1199 C VAL A 74 21.371 -13.213 6.914 1.00 0.00 C ATOM 1200 O VAL A 74 21.485 -14.220 6.212 1.00 0.00 O ATOM 1201 CB VAL A 74 19.075 -13.289 8.100 1.00 0.00 C ATOM 1202 CG1 VAL A 74 18.657 -14.697 7.655 1.00 0.00 C ATOM 1203 CG2 VAL A 74 19.693 -13.376 9.499 1.00 0.00 C ATOM 0 H VAL A 74 19.397 -13.239 5.223 1.00 0.00 H new ATOM 0 HA VAL A 74 20.181 -11.575 7.547 1.00 0.00 H new ATOM 0 HB VAL A 74 18.176 -12.674 8.128 1.00 0.00 H new ATOM 0 HG11 VAL A 74 18.011 -15.141 8.412 1.00 0.00 H new ATOM 0 HG12 VAL A 74 18.118 -14.635 6.710 1.00 0.00 H new ATOM 0 HG13 VAL A 74 19.545 -15.316 7.526 1.00 0.00 H new ATOM 0 HG21 VAL A 74 19.010 -13.901 10.167 1.00 0.00 H new ATOM 0 HG22 VAL A 74 20.637 -13.918 9.447 1.00 0.00 H new ATOM 0 HG23 VAL A 74 19.873 -12.371 9.881 1.00 0.00 H new ATOM 1872 N GLU B 283 28.618 -14.868 1.526 1.00 0.00 N ATOM 1873 CA GLU B 283 27.836 -13.663 1.860 1.00 0.00 C ATOM 1874 C GLU B 283 27.698 -12.691 0.672 1.00 0.00 C ATOM 1875 O GLU B 283 26.600 -12.223 0.380 1.00 0.00 O ATOM 1876 CB GLU B 283 28.478 -12.973 3.077 1.00 0.00 C ATOM 1877 CG GLU B 283 27.649 -11.785 3.591 1.00 0.00 C ATOM 1878 CD GLU B 283 28.253 -11.077 4.821 1.00 0.00 C ATOM 1879 OE1 GLU B 283 29.373 -11.419 5.272 1.00 0.00 O ATOM 1880 OE2 GLU B 283 27.590 -10.149 5.345 1.00 0.00 O ATOM 0 HA GLU B 283 26.820 -13.973 2.105 1.00 0.00 H new ATOM 0 HB2 GLU B 283 28.599 -13.700 3.880 1.00 0.00 H new ATOM 0 HB3 GLU B 283 29.476 -12.625 2.808 1.00 0.00 H new ATOM 0 HG2 GLU B 283 27.538 -11.059 2.786 1.00 0.00 H new ATOM 0 HG3 GLU B 283 26.649 -12.137 3.843 1.00 0.00 H new ATOM 1887 N GLU B 284 28.787 -12.426 -0.056 1.00 0.00 N ATOM 1888 CA GLU B 284 28.794 -11.560 -1.247 1.00 0.00 C ATOM 1889 C GLU B 284 27.904 -12.089 -2.389 1.00 0.00 C ATOM 1890 O GLU B 284 27.265 -11.309 -3.094 1.00 0.00 O ATOM 1891 CB GLU B 284 30.232 -11.387 -1.762 1.00 0.00 C ATOM 1892 CG GLU B 284 31.145 -10.673 -0.756 1.00 0.00 C ATOM 1893 CD GLU B 284 32.544 -10.435 -1.357 1.00 0.00 C ATOM 1894 OE1 GLU B 284 33.411 -11.339 -1.270 1.00 0.00 O ATOM 1895 OE2 GLU B 284 32.793 -9.338 -1.917 1.00 0.00 O ATOM 0 H GLU B 284 29.705 -12.812 0.166 1.00 0.00 H new ATOM 0 HA GLU B 284 28.380 -10.601 -0.934 1.00 0.00 H new ATOM 0 HB2 GLU B 284 30.650 -12.367 -1.993 1.00 0.00 H new ATOM 0 HB3 GLU B 284 30.213 -10.821 -2.693 1.00 0.00 H new ATOM 0 HG2 GLU B 284 30.701 -9.720 -0.469 1.00 0.00 H new ATOM 0 HG3 GLU B 284 31.231 -11.271 0.151 1.00 0.00 H new ATOM 1902 N GLU B 285 27.831 -13.411 -2.570 1.00 0.00 N ATOM 1903 CA GLU B 285 26.981 -14.062 -3.578 1.00 0.00 C ATOM 1904 C GLU B 285 25.498 -14.012 -3.178 1.00 0.00 C ATOM 1905 O GLU B 285 24.643 -13.691 -4.004 1.00 0.00 O ATOM 1906 CB GLU B 285 27.420 -15.519 -3.794 1.00 0.00 C ATOM 1907 CG GLU B 285 28.859 -15.633 -4.315 1.00 0.00 C ATOM 1908 CD GLU B 285 29.244 -17.106 -4.541 1.00 0.00 C ATOM 1909 OE1 GLU B 285 29.413 -17.842 -3.540 1.00 0.00 O ATOM 1910 OE2 GLU B 285 29.386 -17.530 -5.714 1.00 0.00 O ATOM 0 H GLU B 285 28.370 -14.073 -2.011 1.00 0.00 H new ATOM 0 HA GLU B 285 27.099 -13.513 -4.512 1.00 0.00 H new ATOM 0 HB2 GLU B 285 27.334 -16.063 -2.853 1.00 0.00 H new ATOM 0 HB3 GLU B 285 26.743 -15.997 -4.502 1.00 0.00 H new ATOM 0 HG2 GLU B 285 28.957 -15.079 -5.249 1.00 0.00 H new ATOM 0 HG3 GLU B 285 29.546 -15.178 -3.601 1.00 0.00 H new ATOM 1917 N GLN B 286 25.193 -14.262 -1.898 1.00 0.00 N ATOM 1918 CA GLN B 286 23.855 -14.084 -1.322 1.00 0.00 C ATOM 1919 C GLN B 286 23.369 -12.628 -1.453 1.00 0.00 C ATOM 1920 O GLN B 286 22.226 -12.391 -1.850 1.00 0.00 O ATOM 1921 CB GLN B 286 23.855 -14.516 0.151 1.00 0.00 C ATOM 1922 CG GLN B 286 24.024 -16.031 0.333 1.00 0.00 C ATOM 1923 CD GLN B 286 24.046 -16.423 1.812 1.00 0.00 C ATOM 1924 OE1 GLN B 286 23.208 -16.020 2.607 1.00 0.00 O ATOM 1925 NE2 GLN B 286 24.992 -17.223 2.252 1.00 0.00 N ATOM 0 H GLN B 286 25.880 -14.599 -1.224 1.00 0.00 H new ATOM 0 HA GLN B 286 23.163 -14.713 -1.881 1.00 0.00 H new ATOM 0 HB2 GLN B 286 24.660 -14.001 0.675 1.00 0.00 H new ATOM 0 HB3 GLN B 286 22.920 -14.202 0.616 1.00 0.00 H new ATOM 0 HG2 GLN B 286 23.209 -16.551 -0.170 1.00 0.00 H new ATOM 0 HG3 GLN B 286 24.950 -16.354 -0.143 1.00 0.00 H new ATOM 0 HE21 GLN B 286 25.703 -17.573 1.610 1.00 0.00 H new ATOM 0 HE22 GLN B 286 25.015 -17.493 3.235 1.00 0.00 H new ATOM 1934 N ILE B 287 24.243 -11.653 -1.178 1.00 0.00 N ATOM 1935 CA ILE B 287 24.006 -10.225 -1.424 1.00 0.00 C ATOM 1936 C ILE B 287 23.714 -9.965 -2.909 1.00 0.00 C ATOM 1937 O ILE B 287 22.685 -9.375 -3.218 1.00 0.00 O ATOM 1938 CB ILE B 287 25.174 -9.371 -0.873 1.00 0.00 C ATOM 1939 CG1 ILE B 287 25.071 -9.298 0.669 1.00 0.00 C ATOM 1940 CG2 ILE B 287 25.175 -7.952 -1.471 1.00 0.00 C ATOM 1941 CD1 ILE B 287 26.321 -8.736 1.359 1.00 0.00 C ATOM 0 H ILE B 287 25.158 -11.840 -0.768 1.00 0.00 H new ATOM 0 HA ILE B 287 23.114 -9.916 -0.879 1.00 0.00 H new ATOM 0 HB ILE B 287 26.111 -9.847 -1.161 1.00 0.00 H new ATOM 0 HG12 ILE B 287 24.214 -8.679 0.935 1.00 0.00 H new ATOM 0 HG13 ILE B 287 24.875 -10.298 1.056 1.00 0.00 H new ATOM 0 HG21 ILE B 287 26.009 -7.384 -1.059 1.00 0.00 H new ATOM 0 HG22 ILE B 287 25.277 -8.014 -2.554 1.00 0.00 H new ATOM 0 HG23 ILE B 287 24.239 -7.452 -1.223 1.00 0.00 H new ATOM 0 HD11 ILE B 287 26.165 -8.719 2.438 1.00 0.00 H new ATOM 0 HD12 ILE B 287 27.179 -9.366 1.126 1.00 0.00 H new ATOM 0 HD13 ILE B 287 26.508 -7.723 1.004 1.00 0.00 H new ATOM 1953 N ALA B 288 24.564 -10.397 -3.845 1.00 0.00 N ATOM 1954 CA ALA B 288 24.337 -10.154 -5.274 1.00 0.00 C ATOM 1955 C ALA B 288 23.030 -10.790 -5.806 1.00 0.00 C ATOM 1956 O ALA B 288 22.344 -10.198 -6.643 1.00 0.00 O ATOM 1957 CB ALA B 288 25.563 -10.635 -6.052 1.00 0.00 C ATOM 0 H ALA B 288 25.417 -10.917 -3.639 1.00 0.00 H new ATOM 0 HA ALA B 288 24.202 -9.082 -5.420 1.00 0.00 H new ATOM 0 HB1 ALA B 288 25.409 -10.461 -7.117 1.00 0.00 H new ATOM 0 HB2 ALA B 288 26.444 -10.087 -5.718 1.00 0.00 H new ATOM 0 HB3 ALA B 288 25.711 -11.701 -5.876 1.00 0.00 H new ATOM 1963 N TYR B 289 22.641 -11.961 -5.291 1.00 0.00 N ATOM 1964 CA TYR B 289 21.332 -12.580 -5.531 1.00 0.00 C ATOM 1965 C TYR B 289 20.179 -11.694 -5.013 1.00 0.00 C ATOM 1966 O TYR B 289 19.222 -11.433 -5.748 1.00 0.00 O ATOM 1967 CB TYR B 289 21.337 -13.981 -4.902 1.00 0.00 C ATOM 1968 CG TYR B 289 20.005 -14.710 -4.859 1.00 0.00 C ATOM 1969 CD1 TYR B 289 19.214 -14.853 -6.018 1.00 0.00 C ATOM 1970 CD2 TYR B 289 19.576 -15.279 -3.645 1.00 0.00 C ATOM 1971 CE1 TYR B 289 17.994 -15.559 -5.958 1.00 0.00 C ATOM 1972 CE2 TYR B 289 18.360 -15.983 -3.584 1.00 0.00 C ATOM 1973 CZ TYR B 289 17.567 -16.130 -4.739 1.00 0.00 C ATOM 1974 OH TYR B 289 16.403 -16.832 -4.672 1.00 0.00 O ATOM 0 H TYR B 289 23.241 -12.518 -4.682 1.00 0.00 H new ATOM 0 HA TYR B 289 21.157 -12.678 -6.602 1.00 0.00 H new ATOM 0 HB2 TYR B 289 22.047 -14.599 -5.452 1.00 0.00 H new ATOM 0 HB3 TYR B 289 21.712 -13.896 -3.882 1.00 0.00 H new ATOM 0 HD1 TYR B 289 19.542 -14.422 -6.952 1.00 0.00 H new ATOM 0 HD2 TYR B 289 20.183 -15.175 -2.758 1.00 0.00 H new ATOM 0 HE1 TYR B 289 17.386 -15.663 -6.845 1.00 0.00 H new ATOM 0 HE2 TYR B 289 18.033 -16.412 -2.649 1.00 0.00 H new ATOM 0 HH TYR B 289 16.195 -17.033 -3.735 1.00 0.00 H new ATOM 1984 N ALA B 290 20.293 -11.155 -3.792 1.00 0.00 N ATOM 1985 CA ALA B 290 19.371 -10.153 -3.252 1.00 0.00 C ATOM 1986 C ALA B 290 19.269 -8.893 -4.138 1.00 0.00 C ATOM 1987 O ALA B 290 18.165 -8.445 -4.453 1.00 0.00 O ATOM 1988 CB ALA B 290 19.796 -9.792 -1.822 1.00 0.00 C ATOM 0 H ALA B 290 21.039 -11.408 -3.144 1.00 0.00 H new ATOM 0 HA ALA B 290 18.372 -10.590 -3.239 1.00 0.00 H new ATOM 0 HB1 ALA B 290 19.112 -9.046 -1.416 1.00 0.00 H new ATOM 0 HB2 ALA B 290 19.770 -10.685 -1.198 1.00 0.00 H new ATOM 0 HB3 ALA B 290 20.808 -9.387 -1.834 1.00 0.00 H new ATOM 1994 N MET B 291 20.408 -8.342 -4.579 1.00 0.00 N ATOM 1995 CA MET B 291 20.497 -7.202 -5.493 1.00 0.00 C ATOM 1996 C MET B 291 19.728 -7.460 -6.794 1.00 0.00 C ATOM 1997 O MET B 291 18.863 -6.661 -7.149 1.00 0.00 O ATOM 1998 CB MET B 291 21.966 -6.841 -5.783 1.00 0.00 C ATOM 1999 CG MET B 291 22.707 -6.314 -4.549 1.00 0.00 C ATOM 2000 SD MET B 291 24.419 -5.816 -4.874 1.00 0.00 S ATOM 2001 CE MET B 291 24.730 -4.832 -3.381 1.00 0.00 C ATOM 0 H MET B 291 21.324 -8.692 -4.297 1.00 0.00 H new ATOM 0 HA MET B 291 20.029 -6.350 -5.000 1.00 0.00 H new ATOM 0 HB2 MET B 291 22.483 -7.723 -6.162 1.00 0.00 H new ATOM 0 HB3 MET B 291 22.001 -6.088 -6.570 1.00 0.00 H new ATOM 0 HG2 MET B 291 22.161 -5.460 -4.147 1.00 0.00 H new ATOM 0 HG3 MET B 291 22.704 -7.085 -3.779 1.00 0.00 H new ATOM 0 HE1 MET B 291 25.796 -4.620 -3.301 1.00 0.00 H new ATOM 0 HE2 MET B 291 24.177 -3.895 -3.441 1.00 0.00 H new ATOM 0 HE3 MET B 291 24.404 -5.390 -2.503 1.00 0.00 H new ATOM 2011 N GLN B 292 19.980 -8.584 -7.472 1.00 0.00 N ATOM 2012 CA GLN B 292 19.264 -8.975 -8.691 1.00 0.00 C ATOM 2013 C GLN B 292 17.742 -9.035 -8.489 1.00 0.00 C ATOM 2014 O GLN B 292 17.000 -8.522 -9.330 1.00 0.00 O ATOM 2015 CB GLN B 292 19.817 -10.313 -9.212 1.00 0.00 C ATOM 2016 CG GLN B 292 19.094 -10.845 -10.465 1.00 0.00 C ATOM 2017 CD GLN B 292 19.245 -9.939 -11.689 1.00 0.00 C ATOM 2018 OE1 GLN B 292 20.124 -10.113 -12.522 1.00 0.00 O ATOM 2019 NE2 GLN B 292 18.397 -8.945 -11.853 1.00 0.00 N ATOM 0 H GLN B 292 20.694 -9.255 -7.187 1.00 0.00 H new ATOM 0 HA GLN B 292 19.436 -8.203 -9.441 1.00 0.00 H new ATOM 0 HB2 GLN B 292 20.876 -10.193 -9.440 1.00 0.00 H new ATOM 0 HB3 GLN B 292 19.744 -11.058 -8.419 1.00 0.00 H new ATOM 0 HG2 GLN B 292 19.482 -11.835 -10.706 1.00 0.00 H new ATOM 0 HG3 GLN B 292 18.034 -10.964 -10.240 1.00 0.00 H new ATOM 0 HE21 GLN B 292 17.658 -8.786 -11.168 1.00 0.00 H new ATOM 0 HE22 GLN B 292 18.479 -8.334 -12.665 1.00 0.00 H new ATOM 2028 N MET B 293 17.259 -9.640 -7.399 1.00 0.00 N ATOM 2029 CA MET B 293 15.821 -9.670 -7.111 1.00 0.00 C ATOM 2030 C MET B 293 15.251 -8.267 -6.855 1.00 0.00 C ATOM 2031 O MET B 293 14.206 -7.925 -7.407 1.00 0.00 O ATOM 2032 CB MET B 293 15.511 -10.612 -5.939 1.00 0.00 C ATOM 2033 CG MET B 293 15.691 -12.080 -6.343 1.00 0.00 C ATOM 2034 SD MET B 293 15.010 -13.274 -5.160 1.00 0.00 S ATOM 2035 CE MET B 293 16.119 -12.998 -3.756 1.00 0.00 C ATOM 0 H MET B 293 17.838 -10.113 -6.705 1.00 0.00 H new ATOM 0 HA MET B 293 15.327 -10.059 -8.001 1.00 0.00 H new ATOM 0 HB2 MET B 293 16.167 -10.380 -5.100 1.00 0.00 H new ATOM 0 HB3 MET B 293 14.488 -10.449 -5.599 1.00 0.00 H new ATOM 0 HG2 MET B 293 15.218 -12.238 -7.312 1.00 0.00 H new ATOM 0 HG3 MET B 293 16.755 -12.281 -6.471 1.00 0.00 H new ATOM 0 HE1 MET B 293 16.337 -13.950 -3.272 1.00 0.00 H new ATOM 0 HE2 MET B 293 17.048 -12.549 -4.109 1.00 0.00 H new ATOM 0 HE3 MET B 293 15.641 -12.328 -3.041 1.00 0.00 H new ATOM 2045 N SER B 294 15.938 -7.427 -6.073 1.00 0.00 N ATOM 2046 CA SER B 294 15.498 -6.050 -5.788 1.00 0.00 C ATOM 2047 C SER B 294 15.512 -5.123 -7.014 1.00 0.00 C ATOM 2048 O SER B 294 14.701 -4.202 -7.087 1.00 0.00 O ATOM 2049 CB SER B 294 16.332 -5.442 -4.659 1.00 0.00 C ATOM 2050 OG SER B 294 17.603 -5.052 -5.131 1.00 0.00 O ATOM 0 H SER B 294 16.815 -7.679 -5.618 1.00 0.00 H new ATOM 0 HA SER B 294 14.456 -6.131 -5.479 1.00 0.00 H new ATOM 0 HB2 SER B 294 15.813 -4.579 -4.241 1.00 0.00 H new ATOM 0 HB3 SER B 294 16.445 -6.167 -3.853 1.00 0.00 H new ATOM 0 HG SER B 294 17.909 -5.689 -5.810 1.00 0.00 H new