USER MOD reduce.3.24.130724 H: found=0, std=0, add=687, rem=0, adj=12 USER MOD reduce.3.24.130724 removed 687 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 Single : p 1 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : p 1 MET N :NH3+ 176:sc= 1.03 (180deg=0.919) USER MOD Single : p 2 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : p 6 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : p 10 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : p 11 ASN : amide:sc= -0.175 K(o=-0.18,f=-1.2!) USER MOD Single : p 16 GLN : amide:sc= 0.713 K(o=0.71,f=0) USER MOD Single : p 20 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : p 24 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : p 27 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : p 30 GLN :FLIP amide:sc= -0.0137 F(o=-0.76,f=-0.014) USER MOD Single : p 33 ASN : amide:sc= -0.207 K(o=-0.21,f=-3.5!) USER MOD Single : p 34 CYS SG : rot 180:sc= 0 USER MOD Single : p 36 CYS SG : rot 180:sc= 0 USER MOD Single : p 40 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : p 41 CYS SG : rot 180:sc= 0 USER MOD Single : p 42 SER OG : rot 179:sc= 1.25 USER MOD Single : p 43 ASN :FLIP amide:sc= -0.099 F(o=-1.6!,f=-0.099) USER MOD Single : p 44 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : p 48 TYR OH : rot 180:sc= 0 USER MOD Single : p 49 SER OG : rot 180:sc= 0 USER MOD Single : p 51 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : p 54 LYS NZ :NH3+ 179:sc= 0 (180deg=-0.000339) USER MOD Single : p 55 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : p 56 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : p 59 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : p 61 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : p 63 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : p 65 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : p 68 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : p 69 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : p 70 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : p 71 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : p 73 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : p 75 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : p 76 LYS NZ :NH3+ -179:sc= 0 (180deg=-0.00244) USER MOD Single : p 77 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : p 79 GLN :FLIP amide:sc= -0.0242 F(o=-2.2!,f=-0.024) USER MOD ----------------------------------------------------------------- ATOM 1 N MET p 1 -9.361 23.362 6.377 1.00 0.00 N ATOM 2 CA MET p 1 -9.471 23.153 4.907 1.00 0.00 C ATOM 3 C MET p 1 -8.195 22.531 4.338 1.00 0.00 C ATOM 4 O MET p 1 -8.263 21.663 3.467 1.00 0.00 O ATOM 5 CB MET p 1 -9.765 24.480 4.197 1.00 0.00 C ATOM 6 CG MET p 1 -11.200 24.964 4.357 1.00 0.00 C ATOM 7 SD MET p 1 -11.616 25.365 6.066 1.00 0.00 S ATOM 8 CE MET p 1 -13.316 25.901 5.882 1.00 0.00 C ATOM 0 H1 MET p 1 -10.213 23.847 6.723 1.00 0.00 H new ATOM 0 H2 MET p 1 -9.268 22.442 6.853 1.00 0.00 H new ATOM 0 H3 MET p 1 -8.524 23.944 6.583 1.00 0.00 H new ATOM 0 HA MET p 1 -10.296 22.463 4.732 1.00 0.00 H new ATOM 0 HB2 MET p 1 -9.090 25.244 4.583 1.00 0.00 H new ATOM 0 HB3 MET p 1 -9.547 24.368 3.135 1.00 0.00 H new ATOM 0 HG2 MET p 1 -11.353 25.845 3.734 1.00 0.00 H new ATOM 0 HG3 MET p 1 -11.881 24.195 3.993 1.00 0.00 H new ATOM 0 HE1 MET p 1 -13.716 26.184 6.856 1.00 0.00 H new ATOM 0 HE2 MET p 1 -13.356 26.759 5.210 1.00 0.00 H new ATOM 0 HE3 MET p 1 -13.911 25.087 5.468 1.00 0.00 H new ATOM 20 N GLN p 2 -7.038 22.981 4.845 1.00 0.00 N ATOM 21 CA GLN p 2 -5.732 22.496 4.412 1.00 0.00 C ATOM 22 C GLN p 2 -5.283 21.280 5.234 1.00 0.00 C ATOM 23 O GLN p 2 -4.236 20.707 4.974 1.00 0.00 O ATOM 24 CB GLN p 2 -4.720 23.628 4.552 1.00 0.00 C ATOM 25 CG GLN p 2 -4.665 24.551 3.346 1.00 0.00 C ATOM 26 CD GLN p 2 -3.563 25.588 3.452 1.00 0.00 C ATOM 27 OE1 GLN p 2 -2.435 25.357 3.020 1.00 0.00 O ATOM 28 NE2 GLN p 2 -3.887 26.737 4.034 1.00 0.00 N ATOM 0 H GLN p 2 -6.989 23.696 5.571 1.00 0.00 H new ATOM 0 HA GLN p 2 -5.801 22.178 3.372 1.00 0.00 H new ATOM 0 HB2 GLN p 2 -4.965 24.215 5.437 1.00 0.00 H new ATOM 0 HB3 GLN p 2 -3.731 23.201 4.717 1.00 0.00 H new ATOM 0 HG2 GLN p 2 -4.513 23.956 2.445 1.00 0.00 H new ATOM 0 HG3 GLN p 2 -5.625 25.056 3.236 1.00 0.00 H new ATOM 0 HE21 GLN p 2 -4.836 26.885 4.378 1.00 0.00 H new ATOM 0 HE22 GLN p 2 -3.187 27.472 4.137 1.00 0.00 H new ATOM 37 N ALA p 3 -6.119 20.909 6.207 1.00 0.00 N ATOM 38 CA ALA p 3 -5.895 19.790 7.125 1.00 0.00 C ATOM 39 C ALA p 3 -6.514 18.520 6.562 1.00 0.00 C ATOM 40 O ALA p 3 -6.230 17.419 7.023 1.00 0.00 O ATOM 41 CB ALA p 3 -6.481 20.105 8.492 1.00 0.00 C ATOM 0 H ALA p 3 -6.998 21.395 6.383 1.00 0.00 H new ATOM 0 HA ALA p 3 -4.822 19.635 7.236 1.00 0.00 H new ATOM 0 HB1 ALA p 3 -6.308 19.265 9.165 1.00 0.00 H new ATOM 0 HB2 ALA p 3 -6.003 20.998 8.896 1.00 0.00 H new ATOM 0 HB3 ALA p 3 -7.553 20.278 8.397 1.00 0.00 H new ATOM 47 N LEU p 4 -7.387 18.729 5.574 1.00 0.00 N ATOM 48 CA LEU p 4 -8.097 17.680 4.863 1.00 0.00 C ATOM 49 C LEU p 4 -7.272 17.325 3.639 1.00 0.00 C ATOM 50 O LEU p 4 -7.212 16.173 3.205 1.00 0.00 O ATOM 51 CB LEU p 4 -9.515 18.181 4.481 1.00 0.00 C ATOM 52 CG LEU p 4 -10.462 17.183 3.770 1.00 0.00 C ATOM 53 CD1 LEU p 4 -10.342 17.319 2.261 1.00 0.00 C ATOM 54 CD2 LEU p 4 -10.178 15.751 4.195 1.00 0.00 C ATOM 0 H LEU p 4 -7.622 19.664 5.241 1.00 0.00 H new ATOM 0 HA LEU p 4 -8.227 16.791 5.480 1.00 0.00 H new ATOM 0 HB2 LEU p 4 -10.008 18.520 5.392 1.00 0.00 H new ATOM 0 HB3 LEU p 4 -9.401 19.053 3.837 1.00 0.00 H new ATOM 0 HG LEU p 4 -11.483 17.425 4.066 1.00 0.00 H new ATOM 0 HD11 LEU p 4 -11.014 16.610 1.777 1.00 0.00 H new ATOM 0 HD12 LEU p 4 -10.610 18.333 1.965 1.00 0.00 H new ATOM 0 HD13 LEU p 4 -9.316 17.111 1.957 1.00 0.00 H new ATOM 0 HD21 LEU p 4 -10.860 15.076 3.678 1.00 0.00 H new ATOM 0 HD22 LEU p 4 -9.150 15.493 3.941 1.00 0.00 H new ATOM 0 HD23 LEU p 4 -10.320 15.656 5.271 1.00 0.00 H new ATOM 66 N GLU p 5 -6.644 18.371 3.115 1.00 0.00 N ATOM 67 CA GLU p 5 -5.737 18.296 1.971 1.00 0.00 C ATOM 68 C GLU p 5 -4.375 17.873 2.472 1.00 0.00 C ATOM 69 O GLU p 5 -3.562 17.341 1.726 1.00 0.00 O ATOM 70 CB GLU p 5 -5.615 19.648 1.269 1.00 0.00 C ATOM 71 CG GLU p 5 -6.936 20.373 1.128 1.00 0.00 C ATOM 72 CD GLU p 5 -7.197 20.866 -0.282 1.00 0.00 C ATOM 73 OE1 GLU p 5 -7.728 20.083 -1.096 1.00 0.00 O ATOM 74 OE2 GLU p 5 -6.869 22.036 -0.572 1.00 0.00 O ATOM 0 H GLU p 5 -6.752 19.317 3.480 1.00 0.00 H new ATOM 0 HA GLU p 5 -6.132 17.577 1.253 1.00 0.00 H new ATOM 0 HB2 GLU p 5 -4.921 20.277 1.827 1.00 0.00 H new ATOM 0 HB3 GLU p 5 -5.184 19.498 0.279 1.00 0.00 H new ATOM 0 HG2 GLU p 5 -7.744 19.706 1.428 1.00 0.00 H new ATOM 0 HG3 GLU p 5 -6.953 21.222 1.812 1.00 0.00 H new ATOM 81 N LYS p 6 -4.164 18.158 3.762 1.00 0.00 N ATOM 82 CA LYS p 6 -2.930 17.796 4.485 1.00 0.00 C ATOM 83 C LYS p 6 -3.074 16.409 5.091 1.00 0.00 C ATOM 84 O LYS p 6 -2.092 15.791 5.485 1.00 0.00 O ATOM 85 CB LYS p 6 -2.604 18.792 5.587 1.00 0.00 C ATOM 86 CG LYS p 6 -1.397 19.664 5.283 1.00 0.00 C ATOM 87 CD LYS p 6 -1.139 20.666 6.398 1.00 0.00 C ATOM 88 CE LYS p 6 0.056 21.552 6.085 1.00 0.00 C ATOM 89 NZ LYS p 6 0.312 22.542 7.166 1.00 0.00 N ATOM 0 H LYS p 6 -4.846 18.649 4.341 1.00 0.00 H new ATOM 0 HA LYS p 6 -2.113 17.810 3.763 1.00 0.00 H new ATOM 0 HB2 LYS p 6 -3.471 19.432 5.755 1.00 0.00 H new ATOM 0 HB3 LYS p 6 -2.424 18.249 6.515 1.00 0.00 H new ATOM 0 HG2 LYS p 6 -0.517 19.035 5.147 1.00 0.00 H new ATOM 0 HG3 LYS p 6 -1.557 20.195 4.345 1.00 0.00 H new ATOM 0 HD2 LYS p 6 -2.024 21.285 6.544 1.00 0.00 H new ATOM 0 HD3 LYS p 6 -0.964 20.134 7.333 1.00 0.00 H new ATOM 0 HE2 LYS p 6 0.941 20.931 5.944 1.00 0.00 H new ATOM 0 HE3 LYS p 6 -0.118 22.077 5.146 1.00 0.00 H new ATOM 0 HZ1 LYS p 6 1.135 23.126 6.914 1.00 0.00 H new ATOM 0 HZ2 LYS p 6 -0.523 23.151 7.283 1.00 0.00 H new ATOM 0 HZ3 LYS p 6 0.503 22.041 8.057 1.00 0.00 H new ATOM 103 N GLU p 7 -4.332 15.968 5.177 1.00 0.00 N ATOM 104 CA GLU p 7 -4.715 14.647 5.663 1.00 0.00 C ATOM 105 C GLU p 7 -4.707 13.720 4.458 1.00 0.00 C ATOM 106 O GLU p 7 -4.570 12.507 4.573 1.00 0.00 O ATOM 107 CB GLU p 7 -6.104 14.733 6.308 1.00 0.00 C ATOM 108 CG GLU p 7 -6.954 13.479 6.204 1.00 0.00 C ATOM 109 CD GLU p 7 -7.274 12.867 7.553 1.00 0.00 C ATOM 110 OE1 GLU p 7 -6.482 12.024 8.025 1.00 0.00 O ATOM 111 OE2 GLU p 7 -8.316 13.229 8.137 1.00 0.00 O ATOM 0 H GLU p 7 -5.131 16.539 4.902 1.00 0.00 H new ATOM 0 HA GLU p 7 -4.029 14.269 6.421 1.00 0.00 H new ATOM 0 HB2 GLU p 7 -5.981 14.980 7.362 1.00 0.00 H new ATOM 0 HB3 GLU p 7 -6.648 15.558 5.848 1.00 0.00 H new ATOM 0 HG2 GLU p 7 -7.885 13.719 5.690 1.00 0.00 H new ATOM 0 HG3 GLU p 7 -6.433 12.743 5.592 1.00 0.00 H new ATOM 118 N LEU p 8 -4.891 14.376 3.315 1.00 0.00 N ATOM 119 CA LEU p 8 -4.878 13.785 1.997 1.00 0.00 C ATOM 120 C LEU p 8 -3.457 13.918 1.456 1.00 0.00 C ATOM 121 O LEU p 8 -3.071 13.239 0.512 1.00 0.00 O ATOM 122 CB LEU p 8 -5.906 14.490 1.081 1.00 0.00 C ATOM 123 CG LEU p 8 -6.106 13.920 -0.342 1.00 0.00 C ATOM 124 CD1 LEU p 8 -5.216 14.654 -1.330 1.00 0.00 C ATOM 125 CD2 LEU p 8 -5.819 12.427 -0.383 1.00 0.00 C ATOM 0 H LEU p 8 -5.061 15.382 3.291 1.00 0.00 H new ATOM 0 HA LEU p 8 -5.162 12.733 2.035 1.00 0.00 H new ATOM 0 HB2 LEU p 8 -6.871 14.477 1.587 1.00 0.00 H new ATOM 0 HB3 LEU p 8 -5.610 15.535 0.986 1.00 0.00 H new ATOM 0 HG LEU p 8 -7.149 14.070 -0.622 1.00 0.00 H new ATOM 0 HD11 LEU p 8 -5.366 14.244 -2.329 1.00 0.00 H new ATOM 0 HD12 LEU p 8 -5.470 15.714 -1.331 1.00 0.00 H new ATOM 0 HD13 LEU p 8 -4.172 14.532 -1.040 1.00 0.00 H new ATOM 0 HD21 LEU p 8 -5.968 12.055 -1.397 1.00 0.00 H new ATOM 0 HD22 LEU p 8 -4.788 12.246 -0.078 1.00 0.00 H new ATOM 0 HD23 LEU p 8 -6.495 11.908 0.297 1.00 0.00 H new ATOM 137 N ALA p 9 -2.722 14.848 2.082 1.00 0.00 N ATOM 138 CA ALA p 9 -1.306 15.096 1.797 1.00 0.00 C ATOM 139 C ALA p 9 -0.511 14.216 2.738 1.00 0.00 C ATOM 140 O ALA p 9 0.659 13.903 2.508 1.00 0.00 O ATOM 141 CB ALA p 9 -0.904 16.553 1.970 1.00 0.00 C ATOM 0 H ALA p 9 -3.101 15.455 2.809 1.00 0.00 H new ATOM 0 HA ALA p 9 -1.107 14.863 0.751 1.00 0.00 H new ATOM 0 HB1 ALA p 9 0.156 16.667 1.744 1.00 0.00 H new ATOM 0 HB2 ALA p 9 -1.489 17.175 1.292 1.00 0.00 H new ATOM 0 HB3 ALA p 9 -1.091 16.862 2.998 1.00 0.00 H new ATOM 147 N GLN p 10 -1.210 13.835 3.818 1.00 0.00 N ATOM 148 CA GLN p 10 -0.707 12.929 4.827 1.00 0.00 C ATOM 149 C GLN p 10 -1.111 11.537 4.382 1.00 0.00 C ATOM 150 O GLN p 10 -0.424 10.572 4.659 1.00 0.00 O ATOM 151 CB GLN p 10 -1.290 13.293 6.198 1.00 0.00 C ATOM 152 CG GLN p 10 -1.530 12.129 7.146 1.00 0.00 C ATOM 153 CD GLN p 10 -0.602 12.144 8.344 1.00 0.00 C ATOM 154 OE1 GLN p 10 0.487 11.570 8.307 1.00 0.00 O ATOM 155 NE2 GLN p 10 -1.028 12.804 9.415 1.00 0.00 N ATOM 0 H GLN p 10 -2.158 14.162 4.006 1.00 0.00 H new ATOM 0 HA GLN p 10 0.376 12.988 4.933 1.00 0.00 H new ATOM 0 HB2 GLN p 10 -0.615 13.998 6.683 1.00 0.00 H new ATOM 0 HB3 GLN p 10 -2.236 13.812 6.043 1.00 0.00 H new ATOM 0 HG2 GLN p 10 -2.563 12.156 7.493 1.00 0.00 H new ATOM 0 HG3 GLN p 10 -1.400 11.192 6.604 1.00 0.00 H new ATOM 0 HE21 GLN p 10 -1.938 13.265 9.401 1.00 0.00 H new ATOM 0 HE22 GLN p 10 -0.445 12.850 10.251 1.00 0.00 H new ATOM 164 N ASN p 11 -2.247 11.502 3.666 1.00 0.00 N ATOM 165 CA ASN p 11 -2.806 10.286 3.064 1.00 0.00 C ATOM 166 C ASN p 11 -2.072 10.065 1.764 1.00 0.00 C ATOM 167 O ASN p 11 -2.081 8.974 1.198 1.00 0.00 O ATOM 168 CB ASN p 11 -4.313 10.388 2.798 1.00 0.00 C ATOM 169 CG ASN p 11 -5.029 9.048 2.902 1.00 0.00 C ATOM 170 OD1 ASN p 11 -4.684 8.200 3.729 1.00 0.00 O ATOM 171 ND2 ASN p 11 -6.036 8.854 2.059 1.00 0.00 N ATOM 0 H ASN p 11 -2.810 12.334 3.488 1.00 0.00 H new ATOM 0 HA ASN p 11 -2.678 9.455 3.757 1.00 0.00 H new ATOM 0 HB2 ASN p 11 -4.755 11.086 3.509 1.00 0.00 H new ATOM 0 HB3 ASN p 11 -4.473 10.803 1.803 1.00 0.00 H new ATOM 0 HD21 ASN p 11 -6.557 7.977 2.080 1.00 0.00 H new ATOM 0 HD22 ASN p 11 -6.289 9.582 1.390 1.00 0.00 H new ATOM 178 N GLU p 12 -1.454 11.168 1.309 1.00 0.00 N ATOM 179 CA GLU p 12 -0.612 11.209 0.163 1.00 0.00 C ATOM 180 C GLU p 12 0.738 10.737 0.641 1.00 0.00 C ATOM 181 O GLU p 12 1.486 10.103 -0.074 1.00 0.00 O ATOM 182 CB GLU p 12 -0.524 12.642 -0.282 1.00 0.00 C ATOM 183 CG GLU p 12 0.307 12.850 -1.498 1.00 0.00 C ATOM 184 CD GLU p 12 -0.475 13.383 -2.684 1.00 0.00 C ATOM 185 OE1 GLU p 12 -0.999 12.562 -3.467 1.00 0.00 O ATOM 186 OE2 GLU p 12 -0.564 14.620 -2.829 1.00 0.00 O ATOM 0 H GLU p 12 -1.549 12.075 1.766 1.00 0.00 H new ATOM 0 HA GLU p 12 -0.974 10.597 -0.663 1.00 0.00 H new ATOM 0 HB2 GLU p 12 -1.530 13.014 -0.475 1.00 0.00 H new ATOM 0 HB3 GLU p 12 -0.114 13.240 0.532 1.00 0.00 H new ATOM 0 HG2 GLU p 12 1.113 13.545 -1.263 1.00 0.00 H new ATOM 0 HG3 GLU p 12 0.773 11.904 -1.776 1.00 0.00 H new ATOM 193 N TRP p 13 0.986 11.132 1.887 1.00 0.00 N ATOM 194 CA TRP p 13 2.183 10.780 2.656 1.00 0.00 C ATOM 195 C TRP p 13 2.021 9.368 3.202 1.00 0.00 C ATOM 196 O TRP p 13 2.998 8.737 3.591 1.00 0.00 O ATOM 197 CB TRP p 13 2.422 11.773 3.799 1.00 0.00 C ATOM 198 CG TRP p 13 3.866 11.893 4.200 1.00 0.00 C ATOM 199 CD1 TRP p 13 4.488 11.222 5.214 1.00 0.00 C ATOM 200 CD2 TRP p 13 4.867 12.734 3.602 1.00 0.00 C ATOM 201 NE1 TRP p 13 5.810 11.589 5.284 1.00 0.00 N ATOM 202 CE2 TRP p 13 6.067 12.515 4.307 1.00 0.00 C ATOM 203 CE3 TRP p 13 4.869 13.649 2.542 1.00 0.00 C ATOM 204 CZ2 TRP p 13 7.251 13.174 3.986 1.00 0.00 C ATOM 205 CZ3 TRP p 13 6.045 14.302 2.225 1.00 0.00 C ATOM 206 CH2 TRP p 13 7.222 14.061 2.946 1.00 0.00 C ATOM 0 H TRP p 13 0.341 11.725 2.409 1.00 0.00 H new ATOM 0 HA TRP p 13 3.052 10.825 2.000 1.00 0.00 H new ATOM 0 HB2 TRP p 13 2.054 12.754 3.499 1.00 0.00 H new ATOM 0 HB3 TRP p 13 1.837 11.464 4.666 1.00 0.00 H new ATOM 0 HD1 TRP p 13 4.010 10.506 5.866 1.00 0.00 H new ATOM 0 HE1 TRP p 13 6.490 11.230 5.954 1.00 0.00 H new ATOM 0 HE3 TRP p 13 3.966 13.841 1.981 1.00 0.00 H new ATOM 0 HZ2 TRP p 13 8.160 12.991 4.539 1.00 0.00 H new ATOM 0 HZ3 TRP p 13 6.057 15.009 1.409 1.00 0.00 H new ATOM 0 HH2 TRP p 13 8.125 14.587 2.674 1.00 0.00 H new ATOM 217 N GLU p 14 0.753 8.918 3.256 1.00 0.00 N ATOM 218 CA GLU p 14 0.403 7.536 3.651 1.00 0.00 C ATOM 219 C GLU p 14 0.382 6.751 2.379 1.00 0.00 C ATOM 220 O GLU p 14 0.421 5.524 2.361 1.00 0.00 O ATOM 221 CB GLU p 14 -0.956 7.412 4.330 1.00 0.00 C ATOM 222 CG GLU p 14 -1.083 8.318 5.516 1.00 0.00 C ATOM 223 CD GLU p 14 -1.697 7.644 6.727 1.00 0.00 C ATOM 224 OE1 GLU p 14 -0.940 7.055 7.527 1.00 0.00 O ATOM 225 OE2 GLU p 14 -2.936 7.705 6.876 1.00 0.00 O ATOM 0 H GLU p 14 -0.055 9.497 3.029 1.00 0.00 H new ATOM 0 HA GLU p 14 1.130 7.180 4.381 1.00 0.00 H new ATOM 0 HB2 GLU p 14 -1.742 7.646 3.611 1.00 0.00 H new ATOM 0 HB3 GLU p 14 -1.109 6.380 4.646 1.00 0.00 H new ATOM 0 HG2 GLU p 14 -0.096 8.696 5.782 1.00 0.00 H new ATOM 0 HG3 GLU p 14 -1.692 9.180 5.242 1.00 0.00 H new ATOM 232 N LEU p 15 0.266 7.548 1.321 1.00 0.00 N ATOM 233 CA LEU p 15 0.308 7.091 -0.058 1.00 0.00 C ATOM 234 C LEU p 15 1.778 7.008 -0.454 1.00 0.00 C ATOM 235 O LEU p 15 2.174 6.146 -1.219 1.00 0.00 O ATOM 236 CB LEU p 15 -0.469 8.048 -0.987 1.00 0.00 C ATOM 237 CG LEU p 15 -0.608 7.660 -2.474 1.00 0.00 C ATOM 238 CD1 LEU p 15 0.493 8.323 -3.282 1.00 0.00 C ATOM 239 CD2 LEU p 15 -0.567 6.154 -2.664 1.00 0.00 C ATOM 0 H LEU p 15 0.137 8.556 1.405 1.00 0.00 H new ATOM 0 HA LEU p 15 -0.170 6.116 -0.155 1.00 0.00 H new ATOM 0 HB2 LEU p 15 -1.472 8.169 -0.578 1.00 0.00 H new ATOM 0 HB3 LEU p 15 0.014 9.024 -0.940 1.00 0.00 H new ATOM 0 HG LEU p 15 -1.578 8.010 -2.827 1.00 0.00 H new ATOM 0 HD11 LEU p 15 0.391 8.046 -4.331 1.00 0.00 H new ATOM 0 HD12 LEU p 15 0.415 9.406 -3.183 1.00 0.00 H new ATOM 0 HD13 LEU p 15 1.464 7.994 -2.913 1.00 0.00 H new ATOM 0 HD21 LEU p 15 -0.668 5.918 -3.723 1.00 0.00 H new ATOM 0 HD22 LEU p 15 0.382 5.766 -2.295 1.00 0.00 H new ATOM 0 HD23 LEU p 15 -1.386 5.695 -2.111 1.00 0.00 H new ATOM 251 N GLN p 16 2.548 7.935 0.130 1.00 0.00 N ATOM 252 CA GLN p 16 4.015 8.041 -0.022 1.00 0.00 C ATOM 253 C GLN p 16 4.602 7.043 0.911 1.00 0.00 C ATOM 254 O GLN p 16 5.716 6.576 0.740 1.00 0.00 O ATOM 255 CB GLN p 16 4.548 9.421 0.355 1.00 0.00 C ATOM 256 CG GLN p 16 3.959 10.523 -0.477 1.00 0.00 C ATOM 257 CD GLN p 16 5.004 11.394 -1.146 1.00 0.00 C ATOM 258 OE1 GLN p 16 5.432 11.120 -2.266 1.00 0.00 O ATOM 259 NE2 GLN p 16 5.421 12.452 -0.459 1.00 0.00 N ATOM 0 H GLN p 16 2.162 8.655 0.740 1.00 0.00 H new ATOM 0 HA GLN p 16 4.280 7.869 -1.065 1.00 0.00 H new ATOM 0 HB2 GLN p 16 4.334 9.613 1.406 1.00 0.00 H new ATOM 0 HB3 GLN p 16 5.632 9.429 0.244 1.00 0.00 H new ATOM 0 HG2 GLN p 16 3.316 10.087 -1.242 1.00 0.00 H new ATOM 0 HG3 GLN p 16 3.326 11.147 0.154 1.00 0.00 H new ATOM 0 HE21 GLN p 16 5.039 12.642 0.467 1.00 0.00 H new ATOM 0 HE22 GLN p 16 6.123 13.075 -0.858 1.00 0.00 H new ATOM 268 N ALA p 17 3.801 6.805 1.944 1.00 0.00 N ATOM 269 CA ALA p 17 4.073 5.789 2.962 1.00 0.00 C ATOM 270 C ALA p 17 3.558 4.473 2.423 1.00 0.00 C ATOM 271 O ALA p 17 3.895 3.408 2.926 1.00 0.00 O ATOM 272 CB ALA p 17 3.440 6.099 4.310 1.00 0.00 C ATOM 0 H ALA p 17 2.933 7.317 2.102 1.00 0.00 H new ATOM 0 HA ALA p 17 5.146 5.757 3.151 1.00 0.00 H new ATOM 0 HB1 ALA p 17 3.682 5.305 5.017 1.00 0.00 H new ATOM 0 HB2 ALA p 17 3.826 7.047 4.684 1.00 0.00 H new ATOM 0 HB3 ALA p 17 2.358 6.167 4.197 1.00 0.00 H new ATOM 278 N LEU p 18 2.688 4.602 1.397 1.00 0.00 N ATOM 279 CA LEU p 18 2.146 3.474 0.660 1.00 0.00 C ATOM 280 C LEU p 18 3.096 3.207 -0.500 1.00 0.00 C ATOM 281 O LEU p 18 3.203 2.090 -0.989 1.00 0.00 O ATOM 282 CB LEU p 18 0.721 3.755 0.144 1.00 0.00 C ATOM 283 CG LEU p 18 -0.042 2.582 -0.510 1.00 0.00 C ATOM 284 CD1 LEU p 18 0.122 2.641 -2.017 1.00 0.00 C ATOM 285 CD2 LEU p 18 0.445 1.241 0.016 1.00 0.00 C ATOM 0 H LEU p 18 2.349 5.505 1.066 1.00 0.00 H new ATOM 0 HA LEU p 18 2.066 2.605 1.313 1.00 0.00 H new ATOM 0 HB2 LEU p 18 0.125 4.119 0.981 1.00 0.00 H new ATOM 0 HB3 LEU p 18 0.779 4.566 -0.582 1.00 0.00 H new ATOM 0 HG LEU p 18 -1.097 2.678 -0.254 1.00 0.00 H new ATOM 0 HD11 LEU p 18 -0.418 1.812 -2.474 1.00 0.00 H new ATOM 0 HD12 LEU p 18 -0.278 3.584 -2.390 1.00 0.00 H new ATOM 0 HD13 LEU p 18 1.180 2.570 -2.271 1.00 0.00 H new ATOM 0 HD21 LEU p 18 -0.113 0.437 -0.465 1.00 0.00 H new ATOM 0 HD22 LEU p 18 1.507 1.128 -0.204 1.00 0.00 H new ATOM 0 HD23 LEU p 18 0.291 1.195 1.094 1.00 0.00 H new ATOM 297 N GLU p 19 3.761 4.290 -0.920 1.00 0.00 N ATOM 298 CA GLU p 19 4.795 4.251 -1.978 1.00 0.00 C ATOM 299 C GLU p 19 6.070 3.842 -1.303 1.00 0.00 C ATOM 300 O GLU p 19 6.968 3.280 -1.912 1.00 0.00 O ATOM 301 CB GLU p 19 5.027 5.596 -2.668 1.00 0.00 C ATOM 302 CG GLU p 19 3.773 6.204 -3.231 1.00 0.00 C ATOM 303 CD GLU p 19 3.863 6.492 -4.717 1.00 0.00 C ATOM 304 OE1 GLU p 19 4.315 7.598 -5.082 1.00 0.00 O ATOM 305 OE2 GLU p 19 3.483 5.609 -5.516 1.00 0.00 O ATOM 0 H GLU p 19 3.602 5.223 -0.539 1.00 0.00 H new ATOM 0 HA GLU p 19 4.465 3.562 -2.755 1.00 0.00 H new ATOM 0 HB2 GLU p 19 5.469 6.290 -1.954 1.00 0.00 H new ATOM 0 HB3 GLU p 19 5.750 5.463 -3.473 1.00 0.00 H new ATOM 0 HG2 GLU p 19 2.936 5.530 -3.048 1.00 0.00 H new ATOM 0 HG3 GLU p 19 3.557 7.131 -2.700 1.00 0.00 H new ATOM 312 N LYS p 20 6.111 4.223 -0.027 1.00 0.00 N ATOM 313 CA LYS p 20 7.198 3.885 0.895 1.00 0.00 C ATOM 314 C LYS p 20 6.950 2.498 1.469 1.00 0.00 C ATOM 315 O LYS p 20 7.862 1.853 1.985 1.00 0.00 O ATOM 316 CB LYS p 20 7.294 4.903 2.021 1.00 0.00 C ATOM 317 CG LYS p 20 8.650 5.574 2.141 1.00 0.00 C ATOM 318 CD LYS p 20 9.409 5.090 3.366 1.00 0.00 C ATOM 319 CE LYS p 20 10.755 5.786 3.497 1.00 0.00 C ATOM 320 NZ LYS p 20 11.498 5.339 4.705 1.00 0.00 N ATOM 0 H LYS p 20 5.377 4.785 0.404 1.00 0.00 H new ATOM 0 HA LYS p 20 8.141 3.898 0.348 1.00 0.00 H new ATOM 0 HB2 LYS p 20 6.534 5.670 1.868 1.00 0.00 H new ATOM 0 HB3 LYS p 20 7.062 4.408 2.964 1.00 0.00 H new ATOM 0 HG2 LYS p 20 9.237 5.371 1.245 1.00 0.00 H new ATOM 0 HG3 LYS p 20 8.518 6.654 2.198 1.00 0.00 H new ATOM 0 HD2 LYS p 20 8.814 5.274 4.261 1.00 0.00 H new ATOM 0 HD3 LYS p 20 9.560 4.013 3.300 1.00 0.00 H new ATOM 0 HE2 LYS p 20 11.354 5.587 2.609 1.00 0.00 H new ATOM 0 HE3 LYS p 20 10.603 6.864 3.543 1.00 0.00 H new ATOM 0 HZ1 LYS p 20 12.409 5.838 4.756 1.00 0.00 H new ATOM 0 HZ2 LYS p 20 10.938 5.552 5.555 1.00 0.00 H new ATOM 0 HZ3 LYS p 20 11.667 4.314 4.649 1.00 0.00 H new ATOM 334 N GLU p 21 5.679 2.072 1.371 1.00 0.00 N ATOM 335 CA GLU p 21 5.234 0.754 1.769 1.00 0.00 C ATOM 336 C GLU p 21 5.444 -0.101 0.537 1.00 0.00 C ATOM 337 O GLU p 21 5.721 -1.302 0.609 1.00 0.00 O ATOM 338 CB GLU p 21 3.767 0.792 2.209 1.00 0.00 C ATOM 339 CG GLU p 21 2.995 -0.495 1.998 1.00 0.00 C ATOM 340 CD GLU p 21 2.657 -1.202 3.296 1.00 0.00 C ATOM 341 OE1 GLU p 21 1.603 -0.887 3.886 1.00 0.00 O ATOM 342 OE2 GLU p 21 3.446 -2.072 3.721 1.00 0.00 O ATOM 0 H GLU p 21 4.928 2.657 1.004 1.00 0.00 H new ATOM 0 HA GLU p 21 5.780 0.358 2.625 1.00 0.00 H new ATOM 0 HB2 GLU p 21 3.729 1.050 3.267 1.00 0.00 H new ATOM 0 HB3 GLU p 21 3.263 1.592 1.667 1.00 0.00 H new ATOM 0 HG2 GLU p 21 2.073 -0.275 1.460 1.00 0.00 H new ATOM 0 HG3 GLU p 21 3.580 -1.164 1.368 1.00 0.00 H new ATOM 349 N LEU p 22 5.287 0.587 -0.605 1.00 0.00 N ATOM 350 CA LEU p 22 5.553 0.014 -1.918 1.00 0.00 C ATOM 351 C LEU p 22 7.049 -0.107 -2.033 1.00 0.00 C ATOM 352 O LEU p 22 7.591 -1.128 -2.450 1.00 0.00 O ATOM 353 CB LEU p 22 5.052 0.946 -3.010 1.00 0.00 C ATOM 354 CG LEU p 22 3.979 0.412 -3.945 1.00 0.00 C ATOM 355 CD1 LEU p 22 2.658 0.265 -3.210 1.00 0.00 C ATOM 356 CD2 LEU p 22 3.851 1.371 -5.104 1.00 0.00 C ATOM 0 H LEU p 22 4.971 1.556 -0.635 1.00 0.00 H new ATOM 0 HA LEU p 22 5.052 -0.948 -2.029 1.00 0.00 H new ATOM 0 HB2 LEU p 22 4.666 1.847 -2.533 1.00 0.00 H new ATOM 0 HB3 LEU p 22 5.907 1.247 -3.615 1.00 0.00 H new ATOM 0 HG LEU p 22 4.255 -0.576 -4.313 1.00 0.00 H new ATOM 0 HD11 LEU p 22 1.901 -0.118 -3.895 1.00 0.00 H new ATOM 0 HD12 LEU p 22 2.780 -0.429 -2.378 1.00 0.00 H new ATOM 0 HD13 LEU p 22 2.344 1.237 -2.829 1.00 0.00 H new ATOM 0 HD21 LEU p 22 3.086 1.011 -5.792 1.00 0.00 H new ATOM 0 HD22 LEU p 22 3.569 2.356 -4.732 1.00 0.00 H new ATOM 0 HD23 LEU p 22 4.805 1.440 -5.627 1.00 0.00 H new ATOM 368 N ALA p 23 7.685 0.987 -1.607 1.00 0.00 N ATOM 369 CA ALA p 23 9.156 1.089 -1.559 1.00 0.00 C ATOM 370 C ALA p 23 9.723 0.203 -0.449 1.00 0.00 C ATOM 371 O ALA p 23 10.922 -0.050 -0.408 1.00 0.00 O ATOM 372 CB ALA p 23 9.623 2.526 -1.365 1.00 0.00 C ATOM 0 H ALA p 23 7.203 1.826 -1.286 1.00 0.00 H new ATOM 0 HA ALA p 23 9.531 0.743 -2.522 1.00 0.00 H new ATOM 0 HB1 ALA p 23 10.712 2.554 -1.336 1.00 0.00 H new ATOM 0 HB2 ALA p 23 9.267 3.139 -2.193 1.00 0.00 H new ATOM 0 HB3 ALA p 23 9.225 2.915 -0.428 1.00 0.00 H new ATOM 378 N GLN p 24 8.821 -0.260 0.437 1.00 0.00 N ATOM 379 CA GLN p 24 9.136 -1.142 1.548 1.00 0.00 C ATOM 380 C GLN p 24 9.196 -2.584 1.042 1.00 0.00 C ATOM 381 O GLN p 24 9.899 -3.415 1.588 1.00 0.00 O ATOM 382 CB GLN p 24 8.038 -0.982 2.597 1.00 0.00 C ATOM 383 CG GLN p 24 7.923 -2.126 3.573 1.00 0.00 C ATOM 384 CD GLN p 24 8.155 -1.713 5.013 1.00 0.00 C ATOM 385 OE1 GLN p 24 7.220 -1.336 5.720 1.00 0.00 O ATOM 386 NE2 GLN p 24 9.405 -1.782 5.456 1.00 0.00 N ATOM 0 H GLN p 24 7.831 -0.018 0.388 1.00 0.00 H new ATOM 0 HA GLN p 24 10.102 -0.893 1.988 1.00 0.00 H new ATOM 0 HB2 GLN p 24 8.220 -0.064 3.155 1.00 0.00 H new ATOM 0 HB3 GLN p 24 7.082 -0.861 2.087 1.00 0.00 H new ATOM 0 HG2 GLN p 24 6.932 -2.571 3.485 1.00 0.00 H new ATOM 0 HG3 GLN p 24 8.644 -2.898 3.303 1.00 0.00 H new ATOM 0 HE21 GLN p 24 10.149 -2.100 4.835 1.00 0.00 H new ATOM 0 HE22 GLN p 24 9.621 -1.517 6.417 1.00 0.00 H new ATOM 395 N LEU p 25 8.427 -2.805 -0.021 1.00 0.00 N ATOM 396 CA LEU p 25 8.274 -4.068 -0.733 1.00 0.00 C ATOM 397 C LEU p 25 9.477 -4.256 -1.637 1.00 0.00 C ATOM 398 O LEU p 25 10.002 -5.349 -1.795 1.00 0.00 O ATOM 399 CB LEU p 25 6.993 -3.962 -1.564 1.00 0.00 C ATOM 400 CG LEU p 25 6.265 -5.252 -1.928 1.00 0.00 C ATOM 401 CD1 LEU p 25 4.986 -4.878 -2.634 1.00 0.00 C ATOM 402 CD2 LEU p 25 7.113 -6.134 -2.825 1.00 0.00 C ATOM 0 H LEU p 25 7.861 -2.062 -0.432 1.00 0.00 H new ATOM 0 HA LEU p 25 8.210 -4.917 -0.052 1.00 0.00 H new ATOM 0 HB2 LEU p 25 6.294 -3.327 -1.020 1.00 0.00 H new ATOM 0 HB3 LEU p 25 7.239 -3.445 -2.491 1.00 0.00 H new ATOM 0 HG LEU p 25 6.057 -5.819 -1.020 1.00 0.00 H new ATOM 0 HD11 LEU p 25 4.443 -5.783 -2.907 1.00 0.00 H new ATOM 0 HD12 LEU p 25 4.369 -4.270 -1.972 1.00 0.00 H new ATOM 0 HD13 LEU p 25 5.220 -4.310 -3.534 1.00 0.00 H new ATOM 0 HD21 LEU p 25 6.564 -7.044 -3.065 1.00 0.00 H new ATOM 0 HD22 LEU p 25 7.347 -5.599 -3.745 1.00 0.00 H new ATOM 0 HD23 LEU p 25 8.038 -6.393 -2.311 1.00 0.00 H new ATOM 414 N GLU p 26 9.837 -3.133 -2.245 1.00 0.00 N ATOM 415 CA GLU p 26 10.995 -2.957 -3.101 1.00 0.00 C ATOM 416 C GLU p 26 12.204 -2.924 -2.205 1.00 0.00 C ATOM 417 O GLU p 26 13.327 -3.115 -2.642 1.00 0.00 O ATOM 418 CB GLU p 26 10.893 -1.650 -3.872 1.00 0.00 C ATOM 419 CG GLU p 26 9.548 -1.447 -4.529 1.00 0.00 C ATOM 420 CD GLU p 26 9.652 -1.088 -5.998 1.00 0.00 C ATOM 421 OE1 GLU p 26 9.664 -2.014 -6.838 1.00 0.00 O ATOM 422 OE2 GLU p 26 9.724 0.119 -6.311 1.00 0.00 O ATOM 0 H GLU p 26 9.296 -2.274 -2.146 1.00 0.00 H new ATOM 0 HA GLU p 26 11.061 -3.769 -3.826 1.00 0.00 H new ATOM 0 HB2 GLU p 26 11.087 -0.820 -3.193 1.00 0.00 H new ATOM 0 HB3 GLU p 26 11.670 -1.625 -4.636 1.00 0.00 H new ATOM 0 HG2 GLU p 26 8.958 -2.358 -4.425 1.00 0.00 H new ATOM 0 HG3 GLU p 26 9.010 -0.657 -4.005 1.00 0.00 H new ATOM 429 N LYS p 27 11.907 -2.586 -0.944 1.00 0.00 N ATOM 430 CA LYS p 27 12.883 -2.594 0.153 1.00 0.00 C ATOM 431 C LYS p 27 12.979 -4.011 0.681 1.00 0.00 C ATOM 432 O LYS p 27 14.052 -4.468 1.084 1.00 0.00 O ATOM 433 CB LYS p 27 12.493 -1.641 1.277 1.00 0.00 C ATOM 434 CG LYS p 27 13.342 -0.379 1.347 1.00 0.00 C ATOM 435 CD LYS p 27 14.524 -0.546 2.293 1.00 0.00 C ATOM 436 CE LYS p 27 15.378 0.714 2.357 1.00 0.00 C ATOM 437 NZ LYS p 27 14.716 1.805 3.129 1.00 0.00 N ATOM 0 H LYS p 27 10.973 -2.296 -0.654 1.00 0.00 H new ATOM 0 HA LYS p 27 13.846 -2.252 -0.227 1.00 0.00 H new ATOM 0 HB2 LYS p 27 11.448 -1.356 1.151 1.00 0.00 H new ATOM 0 HB3 LYS p 27 12.567 -2.169 2.228 1.00 0.00 H new ATOM 0 HG2 LYS p 27 13.706 -0.130 0.350 1.00 0.00 H new ATOM 0 HG3 LYS p 27 12.725 0.456 1.679 1.00 0.00 H new ATOM 0 HD2 LYS p 27 14.160 -0.789 3.291 1.00 0.00 H new ATOM 0 HD3 LYS p 27 15.137 -1.385 1.964 1.00 0.00 H new ATOM 0 HE2 LYS p 27 16.338 0.477 2.816 1.00 0.00 H new ATOM 0 HE3 LYS p 27 15.586 1.062 1.345 1.00 0.00 H new ATOM 0 HZ1 LYS p 27 15.333 2.642 3.146 1.00 0.00 H new ATOM 0 HZ2 LYS p 27 13.812 2.051 2.677 1.00 0.00 H new ATOM 0 HZ3 LYS p 27 14.541 1.484 4.103 1.00 0.00 H new ATOM 451 N GLU p 28 11.821 -4.699 0.673 1.00 0.00 N ATOM 452 CA GLU p 28 11.764 -6.128 1.051 1.00 0.00 C ATOM 453 C GLU p 28 12.422 -6.873 -0.073 1.00 0.00 C ATOM 454 O GLU p 28 13.106 -7.882 0.113 1.00 0.00 O ATOM 455 CB GLU p 28 10.339 -6.660 1.216 1.00 0.00 C ATOM 456 CG GLU p 28 9.534 -5.936 2.257 1.00 0.00 C ATOM 457 CD GLU p 28 9.203 -6.795 3.462 1.00 0.00 C ATOM 458 OE1 GLU p 28 10.013 -6.820 4.413 1.00 0.00 O ATOM 459 OE2 GLU p 28 8.135 -7.443 3.454 1.00 0.00 O ATOM 0 H GLU p 28 10.921 -4.296 0.412 1.00 0.00 H new ATOM 0 HA GLU p 28 12.253 -6.259 2.016 1.00 0.00 H new ATOM 0 HB2 GLU p 28 9.823 -6.590 0.259 1.00 0.00 H new ATOM 0 HB3 GLU p 28 10.385 -7.717 1.477 1.00 0.00 H new ATOM 0 HG2 GLU p 28 10.087 -5.056 2.587 1.00 0.00 H new ATOM 0 HG3 GLU p 28 8.607 -5.580 1.807 1.00 0.00 H new ATOM 466 N LEU p 29 12.171 -6.317 -1.258 1.00 0.00 N ATOM 467 CA LEU p 29 12.761 -6.811 -2.505 1.00 0.00 C ATOM 468 C LEU p 29 14.238 -6.497 -2.534 1.00 0.00 C ATOM 469 O LEU p 29 15.073 -7.354 -2.840 1.00 0.00 O ATOM 470 CB LEU p 29 12.103 -6.138 -3.695 1.00 0.00 C ATOM 471 CG LEU p 29 11.303 -7.028 -4.625 1.00 0.00 C ATOM 472 CD1 LEU p 29 10.056 -7.522 -3.920 1.00 0.00 C ATOM 473 CD2 LEU p 29 10.955 -6.232 -5.860 1.00 0.00 C ATOM 0 H LEU p 29 11.555 -5.514 -1.382 1.00 0.00 H new ATOM 0 HA LEU p 29 12.607 -7.889 -2.557 1.00 0.00 H new ATOM 0 HB2 LEU p 29 11.442 -5.356 -3.321 1.00 0.00 H new ATOM 0 HB3 LEU p 29 12.880 -5.646 -4.280 1.00 0.00 H new ATOM 0 HG LEU p 29 11.886 -7.902 -4.914 1.00 0.00 H new ATOM 0 HD11 LEU p 29 9.486 -8.161 -4.594 1.00 0.00 H new ATOM 0 HD12 LEU p 29 10.340 -8.091 -3.034 1.00 0.00 H new ATOM 0 HD13 LEU p 29 9.444 -6.670 -3.623 1.00 0.00 H new ATOM 0 HD21 LEU p 29 10.378 -6.855 -6.544 1.00 0.00 H new ATOM 0 HD22 LEU p 29 10.364 -5.361 -5.577 1.00 0.00 H new ATOM 0 HD23 LEU p 29 11.871 -5.905 -6.352 1.00 0.00 H new ATOM 485 N GLN p 30 14.529 -5.240 -2.210 1.00 0.00 N ATOM 486 CA GLN p 30 15.925 -4.740 -2.165 1.00 0.00 C ATOM 487 C GLN p 30 16.777 -5.545 -1.177 1.00 0.00 C ATOM 488 O GLN p 30 17.949 -5.834 -1.431 1.00 0.00 O ATOM 489 CB GLN p 30 15.945 -3.225 -1.849 1.00 0.00 C ATOM 490 CG GLN p 30 16.572 -2.796 -0.516 1.00 0.00 C ATOM 491 CD GLN p 30 18.047 -2.460 -0.643 1.00 0.00 C ATOM 492 OE1 GLN p 30 18.906 -3.447 -0.418 1.00 0.00 O flip ATOM 493 NE2 GLN p 30 18.411 -1.320 -0.933 1.00 0.00 N flip ATOM 0 H GLN p 30 13.826 -4.540 -1.973 1.00 0.00 H new ATOM 0 HA GLN p 30 16.373 -4.880 -3.149 1.00 0.00 H new ATOM 0 HB2 GLN p 30 16.480 -2.719 -2.653 1.00 0.00 H new ATOM 0 HB3 GLN p 30 14.918 -2.861 -1.872 1.00 0.00 H new ATOM 0 HG2 GLN p 30 16.038 -1.928 -0.131 1.00 0.00 H new ATOM 0 HG3 GLN p 30 16.447 -3.596 0.214 1.00 0.00 H new ATOM 0 HE21 GLN p 30 17.718 -0.590 -1.098 1.00 0.00 H new ATOM 0 HE22 GLN p 30 19.405 -1.106 -1.008 1.00 0.00 H new ATOM 502 N ALA p 31 16.148 -5.889 -0.064 1.00 0.00 N ATOM 503 CA ALA p 31 16.778 -6.675 1.009 1.00 0.00 C ATOM 504 C ALA p 31 16.881 -8.168 0.652 1.00 0.00 C ATOM 505 O ALA p 31 17.494 -8.948 1.389 1.00 0.00 O ATOM 506 CB ALA p 31 16.005 -6.494 2.308 1.00 0.00 C ATOM 0 H ALA p 31 15.180 -5.634 0.131 1.00 0.00 H new ATOM 0 HA ALA p 31 17.795 -6.303 1.135 1.00 0.00 H new ATOM 0 HB1 ALA p 31 16.478 -7.079 3.097 1.00 0.00 H new ATOM 0 HB2 ALA p 31 16.005 -5.440 2.588 1.00 0.00 H new ATOM 0 HB3 ALA p 31 14.978 -6.833 2.171 1.00 0.00 H new ATOM 512 N TRP p 32 16.284 -8.548 -0.487 1.00 0.00 N ATOM 513 CA TRP p 32 16.301 -9.934 -0.965 1.00 0.00 C ATOM 514 C TRP p 32 17.494 -10.167 -1.902 1.00 0.00 C ATOM 515 O TRP p 32 18.228 -11.147 -1.748 1.00 0.00 O ATOM 516 CB TRP p 32 14.973 -10.257 -1.675 1.00 0.00 C ATOM 517 CG TRP p 32 14.709 -11.729 -1.864 1.00 0.00 C ATOM 518 CD1 TRP p 32 14.286 -12.615 -0.914 1.00 0.00 C ATOM 519 CD2 TRP p 32 14.846 -12.483 -3.082 1.00 0.00 C ATOM 520 NE1 TRP p 32 14.153 -13.868 -1.460 1.00 0.00 N ATOM 521 CE2 TRP p 32 14.489 -13.813 -2.788 1.00 0.00 C ATOM 522 CE3 TRP p 32 15.232 -12.165 -4.391 1.00 0.00 C ATOM 523 CZ2 TRP p 32 14.509 -14.820 -3.749 1.00 0.00 C ATOM 524 CZ3 TRP p 32 15.251 -13.168 -5.343 1.00 0.00 C ATOM 525 CH2 TRP p 32 14.889 -14.480 -5.018 1.00 0.00 C ATOM 0 H TRP p 32 15.779 -7.906 -1.098 1.00 0.00 H new ATOM 0 HA TRP p 32 16.412 -10.603 -0.111 1.00 0.00 H new ATOM 0 HB2 TRP p 32 14.154 -9.824 -1.101 1.00 0.00 H new ATOM 0 HB3 TRP p 32 14.970 -9.772 -2.651 1.00 0.00 H new ATOM 0 HD1 TRP p 32 14.085 -12.366 0.118 1.00 0.00 H new ATOM 0 HE1 TRP p 32 13.853 -14.704 -0.959 1.00 0.00 H new ATOM 0 HE3 TRP p 32 15.510 -11.154 -4.652 1.00 0.00 H new ATOM 0 HZ2 TRP p 32 14.234 -15.835 -3.501 1.00 0.00 H new ATOM 0 HZ3 TRP p 32 15.550 -12.935 -6.354 1.00 0.00 H new ATOM 0 HH2 TRP p 32 14.910 -15.240 -5.785 1.00 0.00 H new ATOM 536 N ASN p 33 17.681 -9.245 -2.876 1.00 0.00 N ATOM 537 CA ASN p 33 18.783 -9.295 -3.869 1.00 0.00 C ATOM 538 C ASN p 33 18.713 -10.549 -4.758 1.00 0.00 C ATOM 539 O ASN p 33 18.182 -11.587 -4.350 1.00 0.00 O ATOM 540 CB ASN p 33 20.160 -9.211 -3.178 1.00 0.00 C ATOM 541 CG ASN p 33 21.225 -8.588 -4.063 1.00 0.00 C ATOM 542 OD1 ASN p 33 21.911 -9.284 -4.812 1.00 0.00 O ATOM 543 ND2 ASN p 33 21.368 -7.271 -3.980 1.00 0.00 N ATOM 0 H ASN p 33 17.067 -8.439 -2.996 1.00 0.00 H new ATOM 0 HA ASN p 33 18.658 -8.425 -4.514 1.00 0.00 H new ATOM 0 HB2 ASN p 33 20.067 -8.626 -2.263 1.00 0.00 H new ATOM 0 HB3 ASN p 33 20.477 -10.212 -2.886 1.00 0.00 H new ATOM 0 HD21 ASN p 33 22.068 -6.797 -4.551 1.00 0.00 H new ATOM 0 HD22 ASN p 33 20.778 -6.733 -3.346 1.00 0.00 H new ATOM 550 N CYS p 34 19.259 -10.430 -5.974 1.00 0.00 N ATOM 551 CA CYS p 34 19.277 -11.533 -6.940 1.00 0.00 C ATOM 552 C CYS p 34 20.570 -12.347 -6.829 1.00 0.00 C ATOM 553 O CYS p 34 20.544 -13.576 -6.936 1.00 0.00 O ATOM 554 CB CYS p 34 19.121 -10.994 -8.364 1.00 0.00 C ATOM 555 SG CYS p 34 17.594 -10.065 -8.638 1.00 0.00 S ATOM 0 H CYS p 34 19.697 -9.574 -6.313 1.00 0.00 H new ATOM 0 HA CYS p 34 18.439 -12.191 -6.711 1.00 0.00 H new ATOM 0 HB2 CYS p 34 19.971 -10.351 -8.593 1.00 0.00 H new ATOM 0 HB3 CYS p 34 19.156 -11.829 -9.063 1.00 0.00 H new ATOM 0 HG CYS p 34 17.554 -9.649 -9.869 1.00 0.00 H new ATOM 561 N ILE p 35 21.692 -11.647 -6.615 1.00 0.00 N ATOM 562 CA ILE p 35 23.003 -12.286 -6.482 1.00 0.00 C ATOM 563 C ILE p 35 23.374 -12.449 -4.996 1.00 0.00 C ATOM 564 O ILE p 35 23.007 -11.613 -4.165 1.00 0.00 O ATOM 565 CB ILE p 35 24.105 -11.491 -7.275 1.00 0.00 C ATOM 566 CG1 ILE p 35 25.425 -12.281 -7.363 1.00 0.00 C ATOM 567 CG2 ILE p 35 24.358 -10.100 -6.686 1.00 0.00 C ATOM 568 CD1 ILE p 35 25.488 -13.244 -8.531 1.00 0.00 C ATOM 0 H ILE p 35 21.715 -10.631 -6.530 1.00 0.00 H new ATOM 0 HA ILE p 35 22.948 -13.281 -6.923 1.00 0.00 H new ATOM 0 HB ILE p 35 23.715 -11.358 -8.284 1.00 0.00 H new ATOM 0 HG12 ILE p 35 26.254 -11.577 -7.440 1.00 0.00 H new ATOM 0 HG13 ILE p 35 25.566 -12.839 -6.437 1.00 0.00 H new ATOM 0 HG21 ILE p 35 25.127 -9.592 -7.269 1.00 0.00 H new ATOM 0 HG22 ILE p 35 23.436 -9.519 -6.716 1.00 0.00 H new ATOM 0 HG23 ILE p 35 24.691 -10.198 -5.653 1.00 0.00 H new ATOM 0 HD11 ILE p 35 26.447 -13.762 -8.524 1.00 0.00 H new ATOM 0 HD12 ILE p 35 24.682 -13.973 -8.446 1.00 0.00 H new ATOM 0 HD13 ILE p 35 25.381 -12.691 -9.464 1.00 0.00 H new ATOM 580 N CYS p 36 24.096 -13.530 -4.688 1.00 0.00 N ATOM 581 CA CYS p 36 24.520 -13.818 -3.316 1.00 0.00 C ATOM 582 C CYS p 36 25.960 -13.367 -3.080 1.00 0.00 C ATOM 583 O CYS p 36 26.879 -13.793 -3.790 1.00 0.00 O ATOM 584 CB CYS p 36 24.380 -15.314 -3.021 1.00 0.00 C ATOM 585 SG CYS p 36 22.692 -15.943 -3.179 1.00 0.00 S ATOM 0 H CYS p 36 24.400 -14.222 -5.373 1.00 0.00 H new ATOM 0 HA CYS p 36 23.874 -13.260 -2.638 1.00 0.00 H new ATOM 0 HB2 CYS p 36 25.028 -15.869 -3.699 1.00 0.00 H new ATOM 0 HB3 CYS p 36 24.736 -15.509 -2.009 1.00 0.00 H new ATOM 0 HG CYS p 36 22.676 -17.215 -2.913 1.00 0.00 H new ATOM 591 N ASP p 37 26.141 -12.494 -2.083 1.00 0.00 N ATOM 592 CA ASP p 37 27.462 -11.967 -1.727 1.00 0.00 C ATOM 593 C ASP p 37 27.671 -11.988 -0.212 1.00 0.00 C ATOM 594 O ASP p 37 28.725 -12.416 0.267 1.00 0.00 O ATOM 595 CB ASP p 37 27.642 -10.539 -2.263 1.00 0.00 C ATOM 596 CG ASP p 37 27.752 -10.491 -3.776 1.00 0.00 C ATOM 597 OD1 ASP p 37 26.704 -10.365 -4.444 1.00 0.00 O ATOM 598 OD2 ASP p 37 28.885 -10.581 -4.291 1.00 0.00 O ATOM 0 H ASP p 37 25.382 -12.135 -1.504 1.00 0.00 H new ATOM 0 HA ASP p 37 28.211 -12.611 -2.188 1.00 0.00 H new ATOM 0 HB2 ASP p 37 26.798 -9.927 -1.945 1.00 0.00 H new ATOM 0 HB3 ASP p 37 28.538 -10.101 -1.824 1.00 0.00 H new ATOM 603 N ILE p 38 26.657 -11.523 0.533 1.00 0.00 N ATOM 604 CA ILE p 38 26.712 -11.483 1.997 1.00 0.00 C ATOM 605 C ILE p 38 25.343 -11.849 2.601 1.00 0.00 C ATOM 606 O ILE p 38 24.300 -11.553 2.013 1.00 0.00 O ATOM 607 CB ILE p 38 27.217 -10.084 2.512 1.00 0.00 C ATOM 608 CG1 ILE p 38 27.528 -10.112 4.021 1.00 0.00 C ATOM 609 CG2 ILE p 38 26.232 -8.955 2.194 1.00 0.00 C ATOM 610 CD1 ILE p 38 28.927 -10.594 4.353 1.00 0.00 C ATOM 0 H ILE p 38 25.785 -11.168 0.140 1.00 0.00 H new ATOM 0 HA ILE p 38 27.435 -12.228 2.331 1.00 0.00 H new ATOM 0 HB ILE p 38 28.142 -9.878 1.973 1.00 0.00 H new ATOM 0 HG12 ILE p 38 27.394 -9.110 4.428 1.00 0.00 H new ATOM 0 HG13 ILE p 38 26.805 -10.758 4.519 1.00 0.00 H new ATOM 0 HG21 ILE p 38 26.627 -8.011 2.570 1.00 0.00 H new ATOM 0 HG22 ILE p 38 26.093 -8.886 1.115 1.00 0.00 H new ATOM 0 HG23 ILE p 38 25.274 -9.163 2.670 1.00 0.00 H new ATOM 0 HD11 ILE p 38 29.068 -10.585 5.434 1.00 0.00 H new ATOM 0 HD12 ILE p 38 29.061 -11.609 3.978 1.00 0.00 H new ATOM 0 HD13 ILE p 38 29.659 -9.935 3.886 1.00 0.00 H new ATOM 622 N GLU p 39 25.375 -12.494 3.787 1.00 0.00 N ATOM 623 CA GLU p 39 24.163 -12.930 4.527 1.00 0.00 C ATOM 624 C GLU p 39 23.355 -13.973 3.747 1.00 0.00 C ATOM 625 O GLU p 39 23.045 -13.777 2.569 1.00 0.00 O ATOM 626 CB GLU p 39 23.260 -11.738 4.897 1.00 0.00 C ATOM 627 CG GLU p 39 23.839 -10.841 5.980 1.00 0.00 C ATOM 628 CD GLU p 39 22.929 -9.678 6.323 1.00 0.00 C ATOM 629 OE1 GLU p 39 23.059 -8.614 5.683 1.00 0.00 O ATOM 630 OE2 GLU p 39 22.086 -9.832 7.233 1.00 0.00 O ATOM 0 H GLU p 39 26.245 -12.730 4.264 1.00 0.00 H new ATOM 0 HA GLU p 39 24.520 -13.394 5.447 1.00 0.00 H new ATOM 0 HB2 GLU p 39 23.078 -11.141 4.003 1.00 0.00 H new ATOM 0 HB3 GLU p 39 22.294 -12.116 5.230 1.00 0.00 H new ATOM 0 HG2 GLU p 39 24.020 -11.432 6.878 1.00 0.00 H new ATOM 0 HG3 GLU p 39 24.804 -10.457 5.651 1.00 0.00 H new ATOM 637 N ASN p 40 23.020 -15.078 4.425 1.00 0.00 N ATOM 638 CA ASN p 40 22.252 -16.169 3.817 1.00 0.00 C ATOM 639 C ASN p 40 21.068 -16.582 4.695 1.00 0.00 C ATOM 640 O ASN p 40 20.015 -16.971 4.178 1.00 0.00 O ATOM 641 CB ASN p 40 23.153 -17.383 3.566 1.00 0.00 C ATOM 642 CG ASN p 40 24.154 -17.148 2.449 1.00 0.00 C ATOM 643 OD1 ASN p 40 23.876 -17.426 1.283 1.00 0.00 O ATOM 644 ND2 ASN p 40 25.328 -16.636 2.804 1.00 0.00 N ATOM 0 H ASN p 40 23.271 -15.239 5.400 1.00 0.00 H new ATOM 0 HA ASN p 40 21.862 -15.803 2.867 1.00 0.00 H new ATOM 0 HB2 ASN p 40 23.689 -17.629 4.483 1.00 0.00 H new ATOM 0 HB3 ASN p 40 22.534 -18.245 3.318 1.00 0.00 H new ATOM 0 HD21 ASN p 40 26.042 -16.458 2.097 1.00 0.00 H new ATOM 0 HD22 ASN p 40 25.515 -16.421 3.783 1.00 0.00 H new ATOM 651 N CYS p 41 21.249 -16.494 6.020 1.00 0.00 N ATOM 652 CA CYS p 41 20.206 -16.863 6.985 1.00 0.00 C ATOM 653 C CYS p 41 19.285 -15.678 7.324 1.00 0.00 C ATOM 654 O CYS p 41 18.338 -15.824 8.105 1.00 0.00 O ATOM 655 CB CYS p 41 20.852 -17.406 8.264 1.00 0.00 C ATOM 656 SG CYS p 41 21.874 -18.877 8.004 1.00 0.00 S ATOM 0 H CYS p 41 22.115 -16.168 6.449 1.00 0.00 H new ATOM 0 HA CYS p 41 19.589 -17.635 6.525 1.00 0.00 H new ATOM 0 HB2 CYS p 41 21.466 -16.623 8.709 1.00 0.00 H new ATOM 0 HB3 CYS p 41 20.068 -17.643 8.983 1.00 0.00 H new ATOM 0 HG CYS p 41 22.379 -19.261 9.139 1.00 0.00 H new ATOM 662 N SER p 42 19.561 -14.512 6.719 1.00 0.00 N ATOM 663 CA SER p 42 18.767 -13.299 6.950 1.00 0.00 C ATOM 664 C SER p 42 17.613 -13.178 5.949 1.00 0.00 C ATOM 665 O SER p 42 16.582 -12.572 6.258 1.00 0.00 O ATOM 666 CB SER p 42 19.658 -12.059 6.858 1.00 0.00 C ATOM 667 OG SER p 42 20.728 -12.130 7.783 1.00 0.00 O ATOM 0 H SER p 42 20.332 -14.386 6.063 1.00 0.00 H new ATOM 0 HA SER p 42 18.341 -13.372 7.951 1.00 0.00 H new ATOM 0 HB2 SER p 42 20.053 -11.966 5.846 1.00 0.00 H new ATOM 0 HB3 SER p 42 19.064 -11.166 7.052 1.00 0.00 H new ATOM 0 HG SER p 42 21.293 -11.335 7.691 1.00 0.00 H new ATOM 673 N ASN p 43 17.798 -13.755 4.755 1.00 0.00 N ATOM 674 CA ASN p 43 16.779 -13.719 3.699 1.00 0.00 C ATOM 675 C ASN p 43 15.883 -14.964 3.745 1.00 0.00 C ATOM 676 O ASN p 43 16.280 -16.006 4.273 1.00 0.00 O ATOM 677 CB ASN p 43 17.436 -13.570 2.309 1.00 0.00 C ATOM 678 CG ASN p 43 18.515 -14.607 2.021 1.00 0.00 C ATOM 679 OD1 ASN p 43 19.755 -14.284 2.368 1.00 0.00 O flip ATOM 680 ND2 ASN p 43 18.232 -15.683 1.493 1.00 0.00 N flip ATOM 0 H ASN p 43 18.649 -14.255 4.496 1.00 0.00 H new ATOM 0 HA ASN p 43 16.148 -12.848 3.876 1.00 0.00 H new ATOM 0 HB2 ASN p 43 16.663 -13.642 1.543 1.00 0.00 H new ATOM 0 HB3 ASN p 43 17.872 -12.574 2.229 1.00 0.00 H new ATOM 0 HD21 ASN p 43 17.265 -15.890 1.243 1.00 0.00 H new ATOM 0 HD22 ASN p 43 18.965 -16.368 1.306 1.00 0.00 H new ATOM 687 N MET p 44 14.664 -14.835 3.179 1.00 0.00 N ATOM 688 CA MET p 44 13.656 -15.923 3.123 1.00 0.00 C ATOM 689 C MET p 44 13.192 -16.355 4.519 1.00 0.00 C ATOM 690 O MET p 44 13.980 -16.882 5.315 1.00 0.00 O ATOM 691 CB MET p 44 14.177 -17.146 2.341 1.00 0.00 C ATOM 692 CG MET p 44 14.277 -16.922 0.840 1.00 0.00 C ATOM 693 SD MET p 44 14.884 -18.376 -0.038 1.00 0.00 S ATOM 694 CE MET p 44 14.827 -17.799 -1.733 1.00 0.00 C ATOM 0 H MET p 44 14.347 -13.969 2.744 1.00 0.00 H new ATOM 0 HA MET p 44 12.797 -15.512 2.592 1.00 0.00 H new ATOM 0 HB2 MET p 44 15.161 -17.418 2.724 1.00 0.00 H new ATOM 0 HB3 MET p 44 13.517 -17.993 2.529 1.00 0.00 H new ATOM 0 HG2 MET p 44 13.296 -16.650 0.451 1.00 0.00 H new ATOM 0 HG3 MET p 44 14.942 -16.080 0.645 1.00 0.00 H new ATOM 0 HE1 MET p 44 15.174 -18.590 -2.398 1.00 0.00 H new ATOM 0 HE2 MET p 44 13.803 -17.530 -1.992 1.00 0.00 H new ATOM 0 HE3 MET p 44 15.470 -16.925 -1.842 1.00 0.00 H new ATOM 704 N ALA p 45 11.905 -16.113 4.805 1.00 0.00 N ATOM 705 CA ALA p 45 11.301 -16.475 6.092 1.00 0.00 C ATOM 706 C ALA p 45 9.918 -17.136 5.907 1.00 0.00 C ATOM 707 O ALA p 45 9.693 -18.211 6.473 1.00 0.00 O ATOM 708 CB ALA p 45 11.204 -15.258 7.014 1.00 0.00 C ATOM 0 H ALA p 45 11.259 -15.664 4.156 1.00 0.00 H new ATOM 0 HA ALA p 45 11.955 -17.209 6.563 1.00 0.00 H new ATOM 0 HB1 ALA p 45 10.753 -15.554 7.961 1.00 0.00 H new ATOM 0 HB2 ALA p 45 12.202 -14.859 7.196 1.00 0.00 H new ATOM 0 HB3 ALA p 45 10.588 -14.492 6.542 1.00 0.00 H new ATOM 714 N PRO p 46 8.956 -16.529 5.125 1.00 0.00 N ATOM 715 CA PRO p 46 7.620 -17.121 4.910 1.00 0.00 C ATOM 716 C PRO p 46 7.631 -18.230 3.853 1.00 0.00 C ATOM 717 O PRO p 46 8.592 -18.354 3.086 1.00 0.00 O ATOM 718 CB PRO p 46 6.762 -15.934 4.427 1.00 0.00 C ATOM 719 CG PRO p 46 7.648 -14.727 4.464 1.00 0.00 C ATOM 720 CD PRO p 46 9.055 -15.237 4.405 1.00 0.00 C ATOM 0 HA PRO p 46 7.244 -17.594 5.817 1.00 0.00 H new ATOM 0 HB2 PRO p 46 6.388 -16.110 3.418 1.00 0.00 H new ATOM 0 HB3 PRO p 46 5.892 -15.797 5.070 1.00 0.00 H new ATOM 0 HG2 PRO p 46 7.439 -14.065 3.624 1.00 0.00 H new ATOM 0 HG3 PRO p 46 7.481 -14.150 5.374 1.00 0.00 H new ATOM 0 HD2 PRO p 46 9.396 -15.369 3.378 1.00 0.00 H new ATOM 0 HD3 PRO p 46 9.755 -14.555 4.888 1.00 0.00 H new ATOM 728 N LEU p 47 6.557 -19.031 3.822 1.00 0.00 N ATOM 729 CA LEU p 47 6.428 -20.132 2.862 1.00 0.00 C ATOM 730 C LEU p 47 5.699 -19.695 1.589 1.00 0.00 C ATOM 731 O LEU p 47 5.682 -20.425 0.592 1.00 0.00 O ATOM 732 CB LEU p 47 5.678 -21.302 3.507 1.00 0.00 C ATOM 733 CG LEU p 47 6.431 -22.047 4.618 1.00 0.00 C ATOM 734 CD1 LEU p 47 5.449 -22.721 5.564 1.00 0.00 C ATOM 735 CD2 LEU p 47 7.385 -23.078 4.028 1.00 0.00 C ATOM 0 H LEU p 47 5.763 -18.935 4.454 1.00 0.00 H new ATOM 0 HA LEU p 47 7.434 -20.445 2.582 1.00 0.00 H new ATOM 0 HB2 LEU p 47 4.741 -20.926 3.918 1.00 0.00 H new ATOM 0 HB3 LEU p 47 5.419 -22.018 2.727 1.00 0.00 H new ATOM 0 HG LEU p 47 7.016 -21.319 5.179 1.00 0.00 H new ATOM 0 HD11 LEU p 47 5.998 -23.245 6.346 1.00 0.00 H new ATOM 0 HD12 LEU p 47 4.804 -21.968 6.016 1.00 0.00 H new ATOM 0 HD13 LEU p 47 4.840 -23.434 5.009 1.00 0.00 H new ATOM 0 HD21 LEU p 47 7.907 -23.593 4.834 1.00 0.00 H new ATOM 0 HD22 LEU p 47 6.820 -23.802 3.440 1.00 0.00 H new ATOM 0 HD23 LEU p 47 8.111 -22.577 3.387 1.00 0.00 H new ATOM 747 N TYR p 48 5.107 -18.503 1.638 1.00 0.00 N ATOM 748 CA TYR p 48 4.357 -17.949 0.511 1.00 0.00 C ATOM 749 C TYR p 48 4.944 -16.605 0.086 1.00 0.00 C ATOM 750 O TYR p 48 4.969 -15.649 0.870 1.00 0.00 O ATOM 751 CB TYR p 48 2.872 -17.786 0.887 1.00 0.00 C ATOM 752 CG TYR p 48 2.258 -18.994 1.575 1.00 0.00 C ATOM 753 CD1 TYR p 48 2.453 -19.210 2.936 1.00 0.00 C ATOM 754 CD2 TYR p 48 1.492 -19.913 0.869 1.00 0.00 C ATOM 755 CE1 TYR p 48 1.907 -20.305 3.571 1.00 0.00 C ATOM 756 CE2 TYR p 48 0.939 -21.012 1.499 1.00 0.00 C ATOM 757 CZ TYR p 48 1.149 -21.204 2.849 1.00 0.00 C ATOM 758 OH TYR p 48 0.599 -22.296 3.480 1.00 0.00 O ATOM 0 H TYR p 48 5.133 -17.895 2.457 1.00 0.00 H new ATOM 0 HA TYR p 48 4.433 -18.641 -0.328 1.00 0.00 H new ATOM 0 HB2 TYR p 48 2.769 -16.920 1.541 1.00 0.00 H new ATOM 0 HB3 TYR p 48 2.303 -17.571 -0.018 1.00 0.00 H new ATOM 0 HD1 TYR p 48 3.043 -18.507 3.505 1.00 0.00 H new ATOM 0 HD2 TYR p 48 1.326 -19.767 -0.188 1.00 0.00 H new ATOM 0 HE1 TYR p 48 2.072 -20.458 4.627 1.00 0.00 H new ATOM 0 HE2 TYR p 48 0.345 -21.717 0.937 1.00 0.00 H new ATOM 0 HH TYR p 48 0.094 -22.829 2.831 1.00 0.00 H new ATOM 768 N SER p 49 5.425 -16.547 -1.160 1.00 0.00 N ATOM 769 CA SER p 49 6.022 -15.327 -1.715 1.00 0.00 C ATOM 770 C SER p 49 5.422 -14.981 -3.078 1.00 0.00 C ATOM 771 O SER p 49 5.490 -13.833 -3.517 1.00 0.00 O ATOM 772 CB SER p 49 7.537 -15.494 -1.846 1.00 0.00 C ATOM 773 OG SER p 49 8.137 -15.716 -0.583 1.00 0.00 O ATOM 0 H SER p 49 5.412 -17.335 -1.807 1.00 0.00 H new ATOM 0 HA SER p 49 5.803 -14.509 -1.029 1.00 0.00 H new ATOM 0 HB2 SER p 49 7.758 -16.331 -2.509 1.00 0.00 H new ATOM 0 HB3 SER p 49 7.966 -14.603 -2.304 1.00 0.00 H new ATOM 0 HG SER p 49 9.105 -15.821 -0.695 1.00 0.00 H new ATOM 779 N ASP p 50 4.856 -15.990 -3.745 1.00 0.00 N ATOM 780 CA ASP p 50 4.236 -15.814 -5.062 1.00 0.00 C ATOM 781 C ASP p 50 2.718 -15.659 -4.930 1.00 0.00 C ATOM 782 O ASP p 50 2.100 -14.854 -5.632 1.00 0.00 O ATOM 783 CB ASP p 50 4.578 -17.003 -5.970 1.00 0.00 C ATOM 784 CG ASP p 50 4.546 -16.644 -7.446 1.00 0.00 C ATOM 785 OD1 ASP p 50 5.592 -16.211 -7.975 1.00 0.00 O ATOM 786 OD2 ASP p 50 3.476 -16.797 -8.072 1.00 0.00 O ATOM 0 H ASP p 50 4.814 -16.946 -3.391 1.00 0.00 H new ATOM 0 HA ASP p 50 4.632 -14.904 -5.512 1.00 0.00 H new ATOM 0 HB2 ASP p 50 5.569 -17.377 -5.713 1.00 0.00 H new ATOM 0 HB3 ASP p 50 3.873 -17.813 -5.782 1.00 0.00 H new ATOM 791 N GLN p 51 2.140 -16.450 -4.019 1.00 0.00 N ATOM 792 CA GLN p 51 0.700 -16.448 -3.753 1.00 0.00 C ATOM 793 C GLN p 51 0.338 -15.472 -2.621 1.00 0.00 C ATOM 794 O GLN p 51 -0.843 -15.238 -2.353 1.00 0.00 O ATOM 795 CB GLN p 51 0.250 -17.871 -3.392 1.00 0.00 C ATOM 796 CG GLN p 51 -1.170 -18.206 -3.826 1.00 0.00 C ATOM 797 CD GLN p 51 -1.515 -19.667 -3.612 1.00 0.00 C ATOM 798 OE1 GLN p 51 -1.316 -20.500 -4.495 1.00 0.00 O ATOM 799 NE2 GLN p 51 -2.034 -19.984 -2.432 1.00 0.00 N ATOM 0 H GLN p 51 2.661 -17.112 -3.444 1.00 0.00 H new ATOM 0 HA GLN p 51 0.182 -16.114 -4.652 1.00 0.00 H new ATOM 0 HB2 GLN p 51 0.936 -18.584 -3.850 1.00 0.00 H new ATOM 0 HB3 GLN p 51 0.328 -18.002 -2.313 1.00 0.00 H new ATOM 0 HG2 GLN p 51 -1.872 -17.585 -3.269 1.00 0.00 H new ATOM 0 HG3 GLN p 51 -1.292 -17.958 -4.880 1.00 0.00 H new ATOM 0 HE21 GLN p 51 -2.182 -19.260 -1.729 1.00 0.00 H new ATOM 0 HE22 GLN p 51 -2.285 -20.951 -2.229 1.00 0.00 H new ATOM 808 N ALA p 52 1.363 -14.930 -1.951 1.00 0.00 N ATOM 809 CA ALA p 52 1.169 -14.002 -0.833 1.00 0.00 C ATOM 810 C ALA p 52 1.539 -12.550 -1.175 1.00 0.00 C ATOM 811 O ALA p 52 1.191 -11.634 -0.436 1.00 0.00 O ATOM 812 CB ALA p 52 1.994 -14.479 0.353 1.00 0.00 C ATOM 0 H ALA p 52 2.341 -15.121 -2.167 1.00 0.00 H new ATOM 0 HA ALA p 52 0.106 -14.000 -0.594 1.00 0.00 H new ATOM 0 HB1 ALA p 52 1.857 -13.795 1.190 1.00 0.00 H new ATOM 0 HB2 ALA p 52 1.670 -15.478 0.644 1.00 0.00 H new ATOM 0 HB3 ALA p 52 3.048 -14.506 0.076 1.00 0.00 H new ATOM 818 N LEU p 53 2.269 -12.362 -2.270 1.00 0.00 N ATOM 819 CA LEU p 53 2.722 -11.056 -2.712 1.00 0.00 C ATOM 820 C LEU p 53 1.809 -10.471 -3.772 1.00 0.00 C ATOM 821 O LEU p 53 1.059 -9.536 -3.519 1.00 0.00 O ATOM 822 CB LEU p 53 4.156 -11.172 -3.242 1.00 0.00 C ATOM 823 CG LEU p 53 5.268 -10.805 -2.257 1.00 0.00 C ATOM 824 CD1 LEU p 53 6.626 -11.077 -2.876 1.00 0.00 C ATOM 825 CD2 LEU p 53 5.155 -9.349 -1.850 1.00 0.00 C ATOM 0 H LEU p 53 2.564 -13.124 -2.880 1.00 0.00 H new ATOM 0 HA LEU p 53 2.698 -10.377 -1.860 1.00 0.00 H new ATOM 0 HB2 LEU p 53 4.317 -12.197 -3.575 1.00 0.00 H new ATOM 0 HB3 LEU p 53 4.250 -10.533 -4.120 1.00 0.00 H new ATOM 0 HG LEU p 53 5.161 -11.422 -1.365 1.00 0.00 H new ATOM 0 HD11 LEU p 53 7.409 -10.812 -2.166 1.00 0.00 H new ATOM 0 HD12 LEU p 53 6.706 -12.135 -3.127 1.00 0.00 H new ATOM 0 HD13 LEU p 53 6.740 -10.480 -3.781 1.00 0.00 H new ATOM 0 HD21 LEU p 53 5.953 -9.104 -1.149 1.00 0.00 H new ATOM 0 HD22 LEU p 53 5.241 -8.716 -2.734 1.00 0.00 H new ATOM 0 HD23 LEU p 53 4.189 -9.178 -1.374 1.00 0.00 H new ATOM 837 N LYS p 54 1.864 -11.091 -4.951 1.00 0.00 N ATOM 838 CA LYS p 54 1.063 -10.698 -6.131 1.00 0.00 C ATOM 839 C LYS p 54 -0.443 -10.811 -5.871 1.00 0.00 C ATOM 840 O LYS p 54 -1.251 -10.328 -6.659 1.00 0.00 O ATOM 841 CB LYS p 54 1.444 -11.563 -7.336 1.00 0.00 C ATOM 842 CG LYS p 54 2.796 -11.214 -7.941 1.00 0.00 C ATOM 843 CD LYS p 54 3.125 -12.109 -9.128 1.00 0.00 C ATOM 844 CE LYS p 54 4.473 -11.759 -9.742 1.00 0.00 C ATOM 845 NZ LYS p 54 5.612 -12.188 -8.882 1.00 0.00 N ATOM 0 H LYS p 54 2.471 -11.892 -5.125 1.00 0.00 H new ATOM 0 HA LYS p 54 1.286 -9.652 -6.340 1.00 0.00 H new ATOM 0 HB2 LYS p 54 1.452 -12.610 -7.032 1.00 0.00 H new ATOM 0 HB3 LYS p 54 0.676 -11.460 -8.103 1.00 0.00 H new ATOM 0 HG2 LYS p 54 2.795 -10.172 -8.260 1.00 0.00 H new ATOM 0 HG3 LYS p 54 3.572 -11.315 -7.182 1.00 0.00 H new ATOM 0 HD2 LYS p 54 3.131 -13.151 -8.807 1.00 0.00 H new ATOM 0 HD3 LYS p 54 2.345 -12.012 -9.883 1.00 0.00 H new ATOM 0 HE2 LYS p 54 4.559 -12.234 -10.719 1.00 0.00 H new ATOM 0 HE3 LYS p 54 4.528 -10.683 -9.904 1.00 0.00 H new ATOM 0 HZ1 LYS p 54 6.509 -11.944 -9.348 1.00 0.00 H new ATOM 0 HZ2 LYS p 54 5.556 -11.703 -7.964 1.00 0.00 H new ATOM 0 HZ3 LYS p 54 5.567 -13.216 -8.734 1.00 0.00 H new ATOM 859 N LYS p 55 -0.781 -11.476 -4.768 1.00 0.00 N ATOM 860 CA LYS p 55 -2.142 -11.681 -4.325 1.00 0.00 C ATOM 861 C LYS p 55 -2.511 -10.624 -3.306 1.00 0.00 C ATOM 862 O LYS p 55 -3.614 -10.082 -3.337 1.00 0.00 O ATOM 863 CB LYS p 55 -2.309 -13.077 -3.737 1.00 0.00 C ATOM 864 CG LYS p 55 -2.801 -14.114 -4.735 1.00 0.00 C ATOM 865 CD LYS p 55 -3.588 -15.218 -4.046 1.00 0.00 C ATOM 866 CE LYS p 55 -3.957 -16.339 -5.009 1.00 0.00 C ATOM 867 NZ LYS p 55 -4.999 -15.919 -5.992 1.00 0.00 N ATOM 0 H LYS p 55 -0.090 -11.896 -4.146 1.00 0.00 H new ATOM 0 HA LYS p 55 -2.811 -11.594 -5.181 1.00 0.00 H new ATOM 0 HB2 LYS p 55 -1.353 -13.405 -3.329 1.00 0.00 H new ATOM 0 HB3 LYS p 55 -3.011 -13.028 -2.904 1.00 0.00 H new ATOM 0 HG2 LYS p 55 -3.428 -13.631 -5.484 1.00 0.00 H new ATOM 0 HG3 LYS p 55 -1.950 -14.546 -5.262 1.00 0.00 H new ATOM 0 HD2 LYS p 55 -2.999 -15.625 -3.224 1.00 0.00 H new ATOM 0 HD3 LYS p 55 -4.496 -14.800 -3.611 1.00 0.00 H new ATOM 0 HE2 LYS p 55 -3.065 -16.664 -5.545 1.00 0.00 H new ATOM 0 HE3 LYS p 55 -4.319 -17.197 -4.443 1.00 0.00 H new ATOM 0 HZ1 LYS p 55 -5.218 -16.713 -6.626 1.00 0.00 H new ATOM 0 HZ2 LYS p 55 -5.860 -15.634 -5.484 1.00 0.00 H new ATOM 0 HZ3 LYS p 55 -4.645 -15.117 -6.551 1.00 0.00 H new ATOM 881 N LYS p 56 -1.559 -10.342 -2.399 1.00 0.00 N ATOM 882 CA LYS p 56 -1.750 -9.294 -1.365 1.00 0.00 C ATOM 883 C LYS p 56 -1.595 -7.903 -1.995 1.00 0.00 C ATOM 884 O LYS p 56 -1.928 -6.879 -1.396 1.00 0.00 O ATOM 885 CB LYS p 56 -0.761 -9.458 -0.215 1.00 0.00 C ATOM 886 CG LYS p 56 -1.227 -10.434 0.854 1.00 0.00 C ATOM 887 CD LYS p 56 -0.255 -10.482 2.023 1.00 0.00 C ATOM 888 CE LYS p 56 -0.717 -11.456 3.094 1.00 0.00 C ATOM 889 NZ LYS p 56 0.235 -11.519 4.238 1.00 0.00 N ATOM 0 H LYS p 56 -0.657 -10.816 -2.356 1.00 0.00 H new ATOM 0 HA LYS p 56 -2.756 -9.400 -0.960 1.00 0.00 H new ATOM 0 HB2 LYS p 56 0.194 -9.798 -0.614 1.00 0.00 H new ATOM 0 HB3 LYS p 56 -0.586 -8.485 0.244 1.00 0.00 H new ATOM 0 HG2 LYS p 56 -2.214 -10.141 1.211 1.00 0.00 H new ATOM 0 HG3 LYS p 56 -1.328 -11.429 0.421 1.00 0.00 H new ATOM 0 HD2 LYS p 56 0.732 -10.775 1.665 1.00 0.00 H new ATOM 0 HD3 LYS p 56 -0.154 -9.486 2.455 1.00 0.00 H new ATOM 0 HE2 LYS p 56 -1.700 -11.157 3.457 1.00 0.00 H new ATOM 0 HE3 LYS p 56 -0.827 -12.449 2.658 1.00 0.00 H new ATOM 0 HZ1 LYS p 56 -0.117 -12.195 4.946 1.00 0.00 H new ATOM 0 HZ2 LYS p 56 1.167 -11.829 3.897 1.00 0.00 H new ATOM 0 HZ3 LYS p 56 0.321 -10.577 4.671 1.00 0.00 H new ATOM 903 N LEU p 57 -1.072 -7.930 -3.219 1.00 0.00 N ATOM 904 CA LEU p 57 -0.839 -6.781 -4.070 1.00 0.00 C ATOM 905 C LEU p 57 -2.046 -6.636 -4.944 1.00 0.00 C ATOM 906 O LEU p 57 -2.573 -5.548 -5.131 1.00 0.00 O ATOM 907 CB LEU p 57 0.390 -7.014 -4.943 1.00 0.00 C ATOM 908 CG LEU p 57 1.691 -6.341 -4.514 1.00 0.00 C ATOM 909 CD1 LEU p 57 2.136 -6.811 -3.135 1.00 0.00 C ATOM 910 CD2 LEU p 57 2.747 -6.658 -5.549 1.00 0.00 C ATOM 0 H LEU p 57 -0.787 -8.804 -3.661 1.00 0.00 H new ATOM 0 HA LEU p 57 -0.669 -5.886 -3.471 1.00 0.00 H new ATOM 0 HB2 LEU p 57 0.567 -8.088 -4.996 1.00 0.00 H new ATOM 0 HB3 LEU p 57 0.154 -6.680 -5.953 1.00 0.00 H new ATOM 0 HG LEU p 57 1.536 -5.264 -4.446 1.00 0.00 H new ATOM 0 HD11 LEU p 57 3.065 -6.311 -2.863 1.00 0.00 H new ATOM 0 HD12 LEU p 57 1.366 -6.570 -2.402 1.00 0.00 H new ATOM 0 HD13 LEU p 57 2.296 -7.889 -3.152 1.00 0.00 H new ATOM 0 HD21 LEU p 57 3.688 -6.187 -5.265 1.00 0.00 H new ATOM 0 HD22 LEU p 57 2.885 -7.738 -5.609 1.00 0.00 H new ATOM 0 HD23 LEU p 57 2.430 -6.278 -6.520 1.00 0.00 H new ATOM 922 N ALA p 58 -2.460 -7.792 -5.485 1.00 0.00 N ATOM 923 CA ALA p 58 -3.680 -7.878 -6.318 1.00 0.00 C ATOM 924 C ALA p 58 -4.917 -7.564 -5.473 1.00 0.00 C ATOM 925 O ALA p 58 -5.996 -7.283 -6.000 1.00 0.00 O ATOM 926 CB ALA p 58 -3.827 -9.247 -6.959 1.00 0.00 C ATOM 0 H ALA p 58 -1.973 -8.680 -5.364 1.00 0.00 H new ATOM 0 HA ALA p 58 -3.587 -7.142 -7.117 1.00 0.00 H new ATOM 0 HB1 ALA p 58 -4.734 -9.271 -7.562 1.00 0.00 H new ATOM 0 HB2 ALA p 58 -2.964 -9.446 -7.594 1.00 0.00 H new ATOM 0 HB3 ALA p 58 -3.889 -10.008 -6.181 1.00 0.00 H new ATOM 932 N GLN p 59 -4.720 -7.629 -4.152 1.00 0.00 N ATOM 933 CA GLN p 59 -5.717 -7.328 -3.165 1.00 0.00 C ATOM 934 C GLN p 59 -5.553 -5.870 -2.737 1.00 0.00 C ATOM 935 O GLN p 59 -6.501 -5.232 -2.311 1.00 0.00 O ATOM 936 CB GLN p 59 -5.506 -8.284 -1.990 1.00 0.00 C ATOM 937 CG GLN p 59 -6.183 -7.860 -0.713 1.00 0.00 C ATOM 938 CD GLN p 59 -7.085 -8.932 -0.132 1.00 0.00 C ATOM 939 OE1 GLN p 59 -6.647 -9.761 0.666 1.00 0.00 O ATOM 940 NE2 GLN p 59 -8.350 -8.920 -0.532 1.00 0.00 N ATOM 0 H GLN p 59 -3.826 -7.904 -3.745 1.00 0.00 H new ATOM 0 HA GLN p 59 -6.728 -7.456 -3.553 1.00 0.00 H new ATOM 0 HB2 GLN p 59 -5.872 -9.271 -2.271 1.00 0.00 H new ATOM 0 HB3 GLN p 59 -4.436 -8.382 -1.805 1.00 0.00 H new ATOM 0 HG2 GLN p 59 -5.424 -7.595 0.023 1.00 0.00 H new ATOM 0 HG3 GLN p 59 -6.771 -6.962 -0.902 1.00 0.00 H new ATOM 0 HE21 GLN p 59 -8.669 -8.213 -1.195 1.00 0.00 H new ATOM 0 HE22 GLN p 59 -9.004 -9.617 -0.176 1.00 0.00 H new ATOM 949 N LEU p 60 -4.313 -5.391 -2.866 1.00 0.00 N ATOM 950 CA LEU p 60 -3.922 -4.017 -2.532 1.00 0.00 C ATOM 951 C LEU p 60 -4.122 -3.107 -3.749 1.00 0.00 C ATOM 952 O LEU p 60 -4.071 -1.889 -3.650 1.00 0.00 O ATOM 953 CB LEU p 60 -2.450 -3.996 -2.069 1.00 0.00 C ATOM 954 CG LEU p 60 -1.906 -2.674 -1.482 1.00 0.00 C ATOM 955 CD1 LEU p 60 -1.215 -1.876 -2.572 1.00 0.00 C ATOM 956 CD2 LEU p 60 -3.017 -1.852 -0.842 1.00 0.00 C ATOM 0 H LEU p 60 -3.538 -5.957 -3.212 1.00 0.00 H new ATOM 0 HA LEU p 60 -4.548 -3.647 -1.720 1.00 0.00 H new ATOM 0 HB2 LEU p 60 -2.322 -4.775 -1.318 1.00 0.00 H new ATOM 0 HB3 LEU p 60 -1.826 -4.268 -2.920 1.00 0.00 H new ATOM 0 HG LEU p 60 -1.185 -2.916 -0.701 1.00 0.00 H new ATOM 0 HD11 LEU p 60 -0.833 -0.945 -2.154 1.00 0.00 H new ATOM 0 HD12 LEU p 60 -0.388 -2.457 -2.980 1.00 0.00 H new ATOM 0 HD13 LEU p 60 -1.927 -1.652 -3.366 1.00 0.00 H new ATOM 0 HD21 LEU p 60 -2.601 -0.929 -0.439 1.00 0.00 H new ATOM 0 HD22 LEU p 60 -3.771 -1.613 -1.592 1.00 0.00 H new ATOM 0 HD23 LEU p 60 -3.476 -2.425 -0.036 1.00 0.00 H new ATOM 968 N LYS p 61 -4.327 -3.765 -4.876 1.00 0.00 N ATOM 969 CA LYS p 61 -4.577 -3.177 -6.178 1.00 0.00 C ATOM 970 C LYS p 61 -6.076 -3.129 -6.352 1.00 0.00 C ATOM 971 O LYS p 61 -6.637 -2.237 -6.994 1.00 0.00 O ATOM 972 CB LYS p 61 -3.927 -4.037 -7.259 1.00 0.00 C ATOM 973 CG LYS p 61 -2.551 -3.551 -7.676 1.00 0.00 C ATOM 974 CD LYS p 61 -2.151 -4.099 -9.035 1.00 0.00 C ATOM 975 CE LYS p 61 -0.790 -3.577 -9.467 1.00 0.00 C ATOM 976 NZ LYS p 61 -0.387 -4.109 -10.799 1.00 0.00 N ATOM 0 H LYS p 61 -4.323 -4.785 -4.908 1.00 0.00 H new ATOM 0 HA LYS p 61 -4.155 -2.175 -6.258 1.00 0.00 H new ATOM 0 HB2 LYS p 61 -3.847 -5.062 -6.897 1.00 0.00 H new ATOM 0 HB3 LYS p 61 -4.576 -4.058 -8.134 1.00 0.00 H new ATOM 0 HG2 LYS p 61 -2.543 -2.461 -7.706 1.00 0.00 H new ATOM 0 HG3 LYS p 61 -1.816 -3.854 -6.930 1.00 0.00 H new ATOM 0 HD2 LYS p 61 -2.129 -5.188 -8.997 1.00 0.00 H new ATOM 0 HD3 LYS p 61 -2.901 -3.821 -9.776 1.00 0.00 H new ATOM 0 HE2 LYS p 61 -0.814 -2.488 -9.503 1.00 0.00 H new ATOM 0 HE3 LYS p 61 -0.042 -3.855 -8.724 1.00 0.00 H new ATOM 0 HZ1 LYS p 61 0.546 -3.729 -11.057 1.00 0.00 H new ATOM 0 HZ2 LYS p 61 -0.339 -5.147 -10.758 1.00 0.00 H new ATOM 0 HZ3 LYS p 61 -1.087 -3.823 -11.513 1.00 0.00 H new ATOM 990 N TRP p 62 -6.698 -4.143 -5.742 1.00 0.00 N ATOM 991 CA TRP p 62 -8.139 -4.286 -5.680 1.00 0.00 C ATOM 992 C TRP p 62 -8.632 -3.389 -4.566 1.00 0.00 C ATOM 993 O TRP p 62 -9.749 -2.874 -4.610 1.00 0.00 O ATOM 994 CB TRP p 62 -8.533 -5.738 -5.409 1.00 0.00 C ATOM 995 CG TRP p 62 -9.593 -6.260 -6.338 1.00 0.00 C ATOM 996 CD1 TRP p 62 -9.405 -6.744 -7.602 1.00 0.00 C ATOM 997 CD2 TRP p 62 -11.004 -6.355 -6.079 1.00 0.00 C ATOM 998 NE1 TRP p 62 -10.607 -7.132 -8.144 1.00 0.00 N ATOM 999 CE2 TRP p 62 -11.602 -6.904 -7.230 1.00 0.00 C ATOM 1000 CE3 TRP p 62 -11.822 -6.031 -4.988 1.00 0.00 C ATOM 1001 CZ2 TRP p 62 -12.973 -7.135 -7.321 1.00 0.00 C ATOM 1002 CZ3 TRP p 62 -13.181 -6.261 -5.081 1.00 0.00 C ATOM 1003 CH2 TRP p 62 -13.745 -6.810 -6.240 1.00 0.00 C ATOM 0 H TRP p 62 -6.196 -4.896 -5.272 1.00 0.00 H new ATOM 0 HA TRP p 62 -8.588 -4.004 -6.632 1.00 0.00 H new ATOM 0 HB2 TRP p 62 -7.647 -6.367 -5.493 1.00 0.00 H new ATOM 0 HB3 TRP p 62 -8.888 -5.823 -4.382 1.00 0.00 H new ATOM 0 HD1 TRP p 62 -8.450 -6.812 -8.103 1.00 0.00 H new ATOM 0 HE1 TRP p 62 -10.737 -7.526 -9.076 1.00 0.00 H new ATOM 0 HE3 TRP p 62 -11.397 -5.609 -4.090 1.00 0.00 H new ATOM 0 HZ2 TRP p 62 -13.411 -7.556 -8.214 1.00 0.00 H new ATOM 0 HZ3 TRP p 62 -13.820 -6.013 -4.246 1.00 0.00 H new ATOM 0 HH2 TRP p 62 -14.811 -6.980 -6.281 1.00 0.00 H new ATOM 1014 N LYS p 63 -7.756 -3.222 -3.559 1.00 0.00 N ATOM 1015 CA LYS p 63 -8.036 -2.327 -2.427 1.00 0.00 C ATOM 1016 C LYS p 63 -7.571 -0.899 -2.731 1.00 0.00 C ATOM 1017 O LYS p 63 -7.938 0.033 -2.025 1.00 0.00 O ATOM 1018 CB LYS p 63 -7.370 -2.818 -1.148 1.00 0.00 C ATOM 1019 CG LYS p 63 -8.220 -3.787 -0.347 1.00 0.00 C ATOM 1020 CD LYS p 63 -7.640 -4.020 1.041 1.00 0.00 C ATOM 1021 CE LYS p 63 -8.513 -4.952 1.870 1.00 0.00 C ATOM 1022 NZ LYS p 63 -8.421 -6.366 1.409 1.00 0.00 N ATOM 0 H LYS p 63 -6.853 -3.694 -3.508 1.00 0.00 H new ATOM 0 HA LYS p 63 -9.116 -2.328 -2.278 1.00 0.00 H new ATOM 0 HB2 LYS p 63 -6.427 -3.302 -1.403 1.00 0.00 H new ATOM 0 HB3 LYS p 63 -7.128 -1.959 -0.522 1.00 0.00 H new ATOM 0 HG2 LYS p 63 -9.234 -3.396 -0.258 1.00 0.00 H new ATOM 0 HG3 LYS p 63 -8.290 -4.737 -0.878 1.00 0.00 H new ATOM 0 HD2 LYS p 63 -6.640 -4.444 0.950 1.00 0.00 H new ATOM 0 HD3 LYS p 63 -7.536 -3.065 1.556 1.00 0.00 H new ATOM 0 HE2 LYS p 63 -8.214 -4.892 2.916 1.00 0.00 H new ATOM 0 HE3 LYS p 63 -9.550 -4.620 1.815 1.00 0.00 H new ATOM 0 HZ1 LYS p 63 -9.031 -6.965 2.001 1.00 0.00 H new ATOM 0 HZ2 LYS p 63 -8.731 -6.429 0.418 1.00 0.00 H new ATOM 0 HZ3 LYS p 63 -7.437 -6.693 1.485 1.00 0.00 H new ATOM 1036 N LEU p 64 -6.749 -0.763 -3.782 1.00 0.00 N ATOM 1037 CA LEU p 64 -6.199 0.513 -4.243 1.00 0.00 C ATOM 1038 C LEU p 64 -7.147 1.195 -5.211 1.00 0.00 C ATOM 1039 O LEU p 64 -7.147 2.402 -5.357 1.00 0.00 O ATOM 1040 CB LEU p 64 -4.840 0.249 -4.914 1.00 0.00 C ATOM 1041 CG LEU p 64 -4.450 1.138 -6.099 1.00 0.00 C ATOM 1042 CD1 LEU p 64 -4.083 2.508 -5.597 1.00 0.00 C ATOM 1043 CD2 LEU p 64 -3.312 0.517 -6.886 1.00 0.00 C ATOM 0 H LEU p 64 -6.444 -1.557 -4.345 1.00 0.00 H new ATOM 0 HA LEU p 64 -6.067 1.179 -3.391 1.00 0.00 H new ATOM 0 HB2 LEU p 64 -4.065 0.344 -4.153 1.00 0.00 H new ATOM 0 HB3 LEU p 64 -4.828 -0.787 -5.253 1.00 0.00 H new ATOM 0 HG LEU p 64 -5.300 1.229 -6.775 1.00 0.00 H new ATOM 0 HD11 LEU p 64 -3.805 3.142 -6.439 1.00 0.00 H new ATOM 0 HD12 LEU p 64 -4.936 2.946 -5.079 1.00 0.00 H new ATOM 0 HD13 LEU p 64 -3.241 2.430 -4.909 1.00 0.00 H new ATOM 0 HD21 LEU p 64 -3.052 1.165 -7.723 1.00 0.00 H new ATOM 0 HD22 LEU p 64 -2.445 0.396 -6.237 1.00 0.00 H new ATOM 0 HD23 LEU p 64 -3.621 -0.457 -7.265 1.00 0.00 H new ATOM 1055 N GLN p 65 -7.878 0.354 -5.883 1.00 0.00 N ATOM 1056 CA GLN p 65 -8.901 0.688 -6.843 1.00 0.00 C ATOM 1057 C GLN p 65 -10.185 0.890 -6.055 1.00 0.00 C ATOM 1058 O GLN p 65 -11.143 1.481 -6.525 1.00 0.00 O ATOM 1059 CB GLN p 65 -9.006 -0.483 -7.832 1.00 0.00 C ATOM 1060 CG GLN p 65 -10.363 -0.647 -8.486 1.00 0.00 C ATOM 1061 CD GLN p 65 -10.285 -0.824 -9.989 1.00 0.00 C ATOM 1062 OE1 GLN p 65 -10.311 0.149 -10.743 1.00 0.00 O ATOM 1063 NE2 GLN p 65 -10.190 -2.072 -10.433 1.00 0.00 N ATOM 0 H GLN p 65 -7.771 -0.654 -5.770 1.00 0.00 H new ATOM 0 HA GLN p 65 -8.687 1.593 -7.411 1.00 0.00 H new ATOM 0 HB2 GLN p 65 -8.257 -0.349 -8.612 1.00 0.00 H new ATOM 0 HB3 GLN p 65 -8.758 -1.406 -7.307 1.00 0.00 H new ATOM 0 HG2 GLN p 65 -10.867 -1.510 -8.051 1.00 0.00 H new ATOM 0 HG3 GLN p 65 -10.975 0.226 -8.261 1.00 0.00 H new ATOM 0 HE21 GLN p 65 -10.172 -2.849 -9.772 1.00 0.00 H new ATOM 0 HE22 GLN p 65 -10.135 -2.254 -11.435 1.00 0.00 H new ATOM 1072 N ALA p 66 -10.135 0.343 -4.848 1.00 0.00 N ATOM 1073 CA ALA p 66 -11.204 0.417 -3.860 1.00 0.00 C ATOM 1074 C ALA p 66 -10.905 1.571 -2.929 1.00 0.00 C ATOM 1075 O ALA p 66 -11.789 2.087 -2.252 1.00 0.00 O ATOM 1076 CB ALA p 66 -11.339 -0.881 -3.079 1.00 0.00 C ATOM 0 H ALA p 66 -9.324 -0.181 -4.519 1.00 0.00 H new ATOM 0 HA ALA p 66 -12.155 0.576 -4.369 1.00 0.00 H new ATOM 0 HB1 ALA p 66 -12.146 -0.786 -2.353 1.00 0.00 H new ATOM 0 HB2 ALA p 66 -11.563 -1.697 -3.766 1.00 0.00 H new ATOM 0 HB3 ALA p 66 -10.405 -1.091 -2.558 1.00 0.00 H new ATOM 1082 N LEU p 67 -9.612 1.936 -2.906 1.00 0.00 N ATOM 1083 CA LEU p 67 -9.107 3.048 -2.142 1.00 0.00 C ATOM 1084 C LEU p 67 -9.144 4.252 -3.063 1.00 0.00 C ATOM 1085 O LEU p 67 -9.498 5.345 -2.653 1.00 0.00 O ATOM 1086 CB LEU p 67 -7.680 2.743 -1.626 1.00 0.00 C ATOM 1087 CG LEU p 67 -6.522 3.581 -2.206 1.00 0.00 C ATOM 1088 CD1 LEU p 67 -6.475 4.951 -1.568 1.00 0.00 C ATOM 1089 CD2 LEU p 67 -5.195 2.878 -2.035 1.00 0.00 C ATOM 0 H LEU p 67 -8.890 1.446 -3.434 1.00 0.00 H new ATOM 0 HA LEU p 67 -9.710 3.241 -1.255 1.00 0.00 H new ATOM 0 HB2 LEU p 67 -7.679 2.870 -0.543 1.00 0.00 H new ATOM 0 HB3 LEU p 67 -7.468 1.692 -1.824 1.00 0.00 H new ATOM 0 HG LEU p 67 -6.708 3.701 -3.273 1.00 0.00 H new ATOM 0 HD11 LEU p 67 -5.650 5.522 -1.994 1.00 0.00 H new ATOM 0 HD12 LEU p 67 -7.413 5.473 -1.757 1.00 0.00 H new ATOM 0 HD13 LEU p 67 -6.328 4.847 -0.493 1.00 0.00 H new ATOM 0 HD21 LEU p 67 -4.400 3.495 -2.454 1.00 0.00 H new ATOM 0 HD22 LEU p 67 -5.005 2.712 -0.975 1.00 0.00 H new ATOM 0 HD23 LEU p 67 -5.222 1.919 -2.553 1.00 0.00 H new ATOM 1101 N LYS p 68 -8.726 3.998 -4.311 1.00 0.00 N ATOM 1102 CA LYS p 68 -8.742 4.996 -5.382 1.00 0.00 C ATOM 1103 C LYS p 68 -10.162 5.239 -5.827 1.00 0.00 C ATOM 1104 O LYS p 68 -10.468 6.307 -6.338 1.00 0.00 O ATOM 1105 CB LYS p 68 -7.866 4.615 -6.577 1.00 0.00 C ATOM 1106 CG LYS p 68 -6.471 5.211 -6.505 1.00 0.00 C ATOM 1107 CD LYS p 68 -5.704 5.012 -7.804 1.00 0.00 C ATOM 1108 CE LYS p 68 -4.367 5.737 -7.778 1.00 0.00 C ATOM 1109 NZ LYS p 68 -3.583 5.503 -9.023 1.00 0.00 N ATOM 0 H LYS p 68 -8.366 3.090 -4.604 1.00 0.00 H new ATOM 0 HA LYS p 68 -8.316 5.912 -4.972 1.00 0.00 H new ATOM 0 HB2 LYS p 68 -7.789 3.529 -6.632 1.00 0.00 H new ATOM 0 HB3 LYS p 68 -8.350 4.947 -7.496 1.00 0.00 H new ATOM 0 HG2 LYS p 68 -6.542 6.276 -6.284 1.00 0.00 H new ATOM 0 HG3 LYS p 68 -5.921 4.751 -5.684 1.00 0.00 H new ATOM 0 HD2 LYS p 68 -5.539 3.948 -7.971 1.00 0.00 H new ATOM 0 HD3 LYS p 68 -6.301 5.377 -8.640 1.00 0.00 H new ATOM 0 HE2 LYS p 68 -4.536 6.806 -7.651 1.00 0.00 H new ATOM 0 HE3 LYS p 68 -3.789 5.402 -6.917 1.00 0.00 H new ATOM 0 HZ1 LYS p 68 -2.679 6.014 -8.965 1.00 0.00 H new ATOM 0 HZ2 LYS p 68 -3.399 4.485 -9.131 1.00 0.00 H new ATOM 0 HZ3 LYS p 68 -4.123 5.846 -9.843 1.00 0.00 H new ATOM 1123 N LYS p 69 -11.020 4.217 -5.661 1.00 0.00 N ATOM 1124 CA LYS p 69 -12.451 4.377 -5.935 1.00 0.00 C ATOM 1125 C LYS p 69 -13.064 5.067 -4.728 1.00 0.00 C ATOM 1126 O LYS p 69 -14.160 5.621 -4.794 1.00 0.00 O ATOM 1127 CB LYS p 69 -13.143 3.041 -6.171 1.00 0.00 C ATOM 1128 CG LYS p 69 -13.617 2.829 -7.602 1.00 0.00 C ATOM 1129 CD LYS p 69 -15.060 3.283 -7.793 1.00 0.00 C ATOM 1130 CE LYS p 69 -15.541 3.063 -9.222 1.00 0.00 C ATOM 1131 NZ LYS p 69 -15.782 1.623 -9.520 1.00 0.00 N ATOM 0 H LYS p 69 -10.749 3.286 -5.343 1.00 0.00 H new ATOM 0 HA LYS p 69 -12.581 4.963 -6.845 1.00 0.00 H new ATOM 0 HB2 LYS p 69 -12.457 2.237 -5.904 1.00 0.00 H new ATOM 0 HB3 LYS p 69 -13.999 2.965 -5.501 1.00 0.00 H new ATOM 0 HG2 LYS p 69 -12.969 3.379 -8.285 1.00 0.00 H new ATOM 0 HG3 LYS p 69 -13.530 1.774 -7.861 1.00 0.00 H new ATOM 0 HD2 LYS p 69 -15.706 2.738 -7.105 1.00 0.00 H new ATOM 0 HD3 LYS p 69 -15.144 4.340 -7.540 1.00 0.00 H new ATOM 0 HE2 LYS p 69 -16.461 3.625 -9.384 1.00 0.00 H new ATOM 0 HE3 LYS p 69 -14.800 3.457 -9.918 1.00 0.00 H new ATOM 0 HZ1 LYS p 69 -16.108 1.522 -10.502 1.00 0.00 H new ATOM 0 HZ2 LYS p 69 -14.899 1.089 -9.391 1.00 0.00 H new ATOM 0 HZ3 LYS p 69 -16.508 1.252 -8.875 1.00 0.00 H new ATOM 1145 N LYS p 70 -12.307 4.983 -3.623 1.00 0.00 N ATOM 1146 CA LYS p 70 -12.640 5.612 -2.357 1.00 0.00 C ATOM 1147 C LYS p 70 -11.971 6.976 -2.295 1.00 0.00 C ATOM 1148 O LYS p 70 -12.417 7.864 -1.578 1.00 0.00 O ATOM 1149 CB LYS p 70 -12.173 4.752 -1.194 1.00 0.00 C ATOM 1150 CG LYS p 70 -13.294 4.021 -0.470 1.00 0.00 C ATOM 1151 CD LYS p 70 -13.811 4.811 0.722 1.00 0.00 C ATOM 1152 CE LYS p 70 -14.956 4.088 1.415 1.00 0.00 C ATOM 1153 NZ LYS p 70 -15.469 4.855 2.584 1.00 0.00 N ATOM 0 H LYS p 70 -11.430 4.463 -3.595 1.00 0.00 H new ATOM 0 HA LYS p 70 -13.722 5.725 -2.284 1.00 0.00 H new ATOM 0 HB2 LYS p 70 -11.456 4.019 -1.564 1.00 0.00 H new ATOM 0 HB3 LYS p 70 -11.645 5.383 -0.479 1.00 0.00 H new ATOM 0 HG2 LYS p 70 -14.113 3.834 -1.164 1.00 0.00 H new ATOM 0 HG3 LYS p 70 -12.935 3.049 -0.133 1.00 0.00 H new ATOM 0 HD2 LYS p 70 -13.000 4.974 1.431 1.00 0.00 H new ATOM 0 HD3 LYS p 70 -14.147 5.794 0.391 1.00 0.00 H new ATOM 0 HE2 LYS p 70 -15.766 3.925 0.704 1.00 0.00 H new ATOM 0 HE3 LYS p 70 -14.619 3.105 1.745 1.00 0.00 H new ATOM 0 HZ1 LYS p 70 -16.248 4.329 3.029 1.00 0.00 H new ATOM 0 HZ2 LYS p 70 -14.703 4.989 3.274 1.00 0.00 H new ATOM 0 HZ3 LYS p 70 -15.815 5.783 2.266 1.00 0.00 H new ATOM 1167 N ASN p 71 -10.863 7.084 -3.047 1.00 0.00 N ATOM 1168 CA ASN p 71 -10.081 8.320 -3.179 1.00 0.00 C ATOM 1169 C ASN p 71 -10.654 9.136 -4.330 1.00 0.00 C ATOM 1170 O ASN p 71 -10.354 10.314 -4.478 1.00 0.00 O ATOM 1171 CB ASN p 71 -8.599 8.029 -3.431 1.00 0.00 C ATOM 1172 CG ASN p 71 -7.690 9.063 -2.797 1.00 0.00 C ATOM 1173 OD1 ASN p 71 -7.268 8.919 -1.651 1.00 0.00 O ATOM 1174 ND2 ASN p 71 -7.383 10.117 -3.545 1.00 0.00 N ATOM 0 H ASN p 71 -10.483 6.306 -3.585 1.00 0.00 H new ATOM 0 HA ASN p 71 -10.147 8.878 -2.245 1.00 0.00 H new ATOM 0 HB2 ASN p 71 -8.353 7.043 -3.037 1.00 0.00 H new ATOM 0 HB3 ASN p 71 -8.415 7.998 -4.505 1.00 0.00 H new ATOM 0 HD21 ASN p 71 -6.775 10.847 -3.173 1.00 0.00 H new ATOM 0 HD22 ASN p 71 -7.755 10.197 -4.491 1.00 0.00 H new ATOM 1181 N ALA p 72 -11.453 8.440 -5.148 1.00 0.00 N ATOM 1182 CA ALA p 72 -12.188 9.006 -6.272 1.00 0.00 C ATOM 1183 C ALA p 72 -13.547 9.366 -5.733 1.00 0.00 C ATOM 1184 O ALA p 72 -14.270 10.175 -6.301 1.00 0.00 O ATOM 1185 CB ALA p 72 -12.316 8.033 -7.434 1.00 0.00 C ATOM 0 H ALA p 72 -11.606 7.438 -5.038 1.00 0.00 H new ATOM 0 HA ALA p 72 -11.659 9.871 -6.672 1.00 0.00 H new ATOM 0 HB1 ALA p 72 -12.872 8.505 -8.244 1.00 0.00 H new ATOM 0 HB2 ALA p 72 -11.323 7.757 -7.788 1.00 0.00 H new ATOM 0 HB3 ALA p 72 -12.845 7.139 -7.104 1.00 0.00 H new ATOM 1191 N GLN p 73 -13.860 8.694 -4.609 1.00 0.00 N ATOM 1192 CA GLN p 73 -15.044 8.885 -3.837 1.00 0.00 C ATOM 1193 C GLN p 73 -14.775 10.050 -2.913 1.00 0.00 C ATOM 1194 O GLN p 73 -15.648 10.843 -2.597 1.00 0.00 O ATOM 1195 CB GLN p 73 -15.241 7.625 -3.035 1.00 0.00 C ATOM 1196 CG GLN p 73 -16.498 7.602 -2.241 1.00 0.00 C ATOM 1197 CD GLN p 73 -17.496 6.563 -2.712 1.00 0.00 C ATOM 1198 OE1 GLN p 73 -18.335 6.835 -3.571 1.00 0.00 O ATOM 1199 NE2 GLN p 73 -17.411 5.362 -2.151 1.00 0.00 N ATOM 0 H GLN p 73 -13.249 7.976 -4.220 1.00 0.00 H new ATOM 0 HA GLN p 73 -15.927 9.086 -4.444 1.00 0.00 H new ATOM 0 HB2 GLN p 73 -15.236 6.771 -3.713 1.00 0.00 H new ATOM 0 HB3 GLN p 73 -14.395 7.501 -2.359 1.00 0.00 H new ATOM 0 HG2 GLN p 73 -16.254 7.411 -1.196 1.00 0.00 H new ATOM 0 HG3 GLN p 73 -16.964 8.587 -2.285 1.00 0.00 H new ATOM 0 HE21 GLN p 73 -16.700 5.179 -1.443 1.00 0.00 H new ATOM 0 HE22 GLN p 73 -18.056 4.623 -2.429 1.00 0.00 H new ATOM 1208 N LEU p 74 -13.521 10.053 -2.468 1.00 0.00 N ATOM 1209 CA LEU p 74 -12.950 11.088 -1.621 1.00 0.00 C ATOM 1210 C LEU p 74 -12.615 12.282 -2.489 1.00 0.00 C ATOM 1211 O LEU p 74 -12.643 13.401 -2.045 1.00 0.00 O ATOM 1212 CB LEU p 74 -11.692 10.574 -0.928 1.00 0.00 C ATOM 1213 CG LEU p 74 -11.343 11.204 0.422 1.00 0.00 C ATOM 1214 CD1 LEU p 74 -12.248 10.685 1.538 1.00 0.00 C ATOM 1215 CD2 LEU p 74 -9.895 10.902 0.730 1.00 0.00 C ATOM 0 H LEU p 74 -12.858 9.312 -2.695 1.00 0.00 H new ATOM 0 HA LEU p 74 -13.667 11.373 -0.851 1.00 0.00 H new ATOM 0 HB2 LEU p 74 -11.798 9.499 -0.784 1.00 0.00 H new ATOM 0 HB3 LEU p 74 -10.848 10.723 -1.601 1.00 0.00 H new ATOM 0 HG LEU p 74 -11.499 12.281 0.363 1.00 0.00 H new ATOM 0 HD11 LEU p 74 -11.969 11.155 2.481 1.00 0.00 H new ATOM 0 HD12 LEU p 74 -13.286 10.924 1.306 1.00 0.00 H new ATOM 0 HD13 LEU p 74 -12.136 9.604 1.625 1.00 0.00 H new ATOM 0 HD21 LEU p 74 -9.627 11.344 1.690 1.00 0.00 H new ATOM 0 HD22 LEU p 74 -9.750 9.823 0.774 1.00 0.00 H new ATOM 0 HD23 LEU p 74 -9.262 11.322 -0.052 1.00 0.00 H new ATOM 1227 N LYS p 75 -12.333 11.998 -3.757 1.00 0.00 N ATOM 1228 CA LYS p 75 -12.042 13.020 -4.759 1.00 0.00 C ATOM 1229 C LYS p 75 -13.373 13.513 -5.266 1.00 0.00 C ATOM 1230 O LYS p 75 -13.495 14.605 -5.829 1.00 0.00 O ATOM 1231 CB LYS p 75 -11.219 12.458 -5.911 1.00 0.00 C ATOM 1232 CG LYS p 75 -9.857 13.115 -6.085 1.00 0.00 C ATOM 1233 CD LYS p 75 -9.770 13.888 -7.390 1.00 0.00 C ATOM 1234 CE LYS p 75 -8.398 14.516 -7.572 1.00 0.00 C ATOM 1235 NZ LYS p 75 -8.297 15.269 -8.853 1.00 0.00 N ATOM 0 H LYS p 75 -12.300 11.046 -4.121 1.00 0.00 H new ATOM 0 HA LYS p 75 -11.454 13.825 -4.318 1.00 0.00 H new ATOM 0 HB2 LYS p 75 -11.076 11.389 -5.753 1.00 0.00 H new ATOM 0 HB3 LYS p 75 -11.785 12.571 -6.836 1.00 0.00 H new ATOM 0 HG2 LYS p 75 -9.668 13.789 -5.249 1.00 0.00 H new ATOM 0 HG3 LYS p 75 -9.079 12.352 -6.061 1.00 0.00 H new ATOM 0 HD2 LYS p 75 -9.980 13.220 -8.225 1.00 0.00 H new ATOM 0 HD3 LYS p 75 -10.533 14.666 -7.405 1.00 0.00 H new ATOM 0 HE2 LYS p 75 -8.193 15.188 -6.739 1.00 0.00 H new ATOM 0 HE3 LYS p 75 -7.636 13.737 -7.548 1.00 0.00 H new ATOM 0 HZ1 LYS p 75 -7.346 15.682 -8.939 1.00 0.00 H new ATOM 0 HZ2 LYS p 75 -8.467 14.623 -9.650 1.00 0.00 H new ATOM 0 HZ3 LYS p 75 -9.007 16.029 -8.866 1.00 0.00 H new ATOM 1249 N LYS p 76 -14.371 12.651 -5.037 1.00 0.00 N ATOM 1250 CA LYS p 76 -15.756 12.952 -5.368 1.00 0.00 C ATOM 1251 C LYS p 76 -16.381 13.634 -4.176 1.00 0.00 C ATOM 1252 O LYS p 76 -17.271 14.479 -4.318 1.00 0.00 O ATOM 1253 CB LYS p 76 -16.532 11.690 -5.722 1.00 0.00 C ATOM 1254 CG LYS p 76 -16.811 11.530 -7.209 1.00 0.00 C ATOM 1255 CD LYS p 76 -18.175 12.090 -7.595 1.00 0.00 C ATOM 1256 CE LYS p 76 -18.434 11.965 -9.090 1.00 0.00 C ATOM 1257 NZ LYS p 76 -17.622 12.933 -9.885 1.00 0.00 N ATOM 0 H LYS p 76 -14.235 11.731 -4.619 1.00 0.00 H new ATOM 0 HA LYS p 76 -15.787 13.602 -6.243 1.00 0.00 H new ATOM 0 HB2 LYS p 76 -15.973 10.822 -5.373 1.00 0.00 H new ATOM 0 HB3 LYS p 76 -17.480 11.696 -5.184 1.00 0.00 H new ATOM 0 HG2 LYS p 76 -16.035 12.039 -7.781 1.00 0.00 H new ATOM 0 HG3 LYS p 76 -16.763 10.474 -7.476 1.00 0.00 H new ATOM 0 HD2 LYS p 76 -18.954 11.561 -7.046 1.00 0.00 H new ATOM 0 HD3 LYS p 76 -18.234 13.138 -7.302 1.00 0.00 H new ATOM 0 HE2 LYS p 76 -18.205 10.950 -9.413 1.00 0.00 H new ATOM 0 HE3 LYS p 76 -19.493 12.132 -9.289 1.00 0.00 H new ATOM 0 HZ1 LYS p 76 -17.843 12.824 -10.895 1.00 0.00 H new ATOM 0 HZ2 LYS p 76 -17.846 13.903 -9.584 1.00 0.00 H new ATOM 0 HZ3 LYS p 76 -16.611 12.747 -9.730 1.00 0.00 H new ATOM 1271 N LYS p 77 -15.894 13.245 -2.991 1.00 0.00 N ATOM 1272 CA LYS p 77 -16.341 13.849 -1.746 1.00 0.00 C ATOM 1273 C LYS p 77 -15.515 15.091 -1.437 1.00 0.00 C ATOM 1274 O LYS p 77 -15.935 15.944 -0.649 1.00 0.00 O ATOM 1275 CB LYS p 77 -16.251 12.851 -0.597 1.00 0.00 C ATOM 1276 CG LYS p 77 -17.592 12.257 -0.182 1.00 0.00 C ATOM 1277 CD LYS p 77 -18.275 13.091 0.897 1.00 0.00 C ATOM 1278 CE LYS p 77 -19.635 12.522 1.276 1.00 0.00 C ATOM 1279 NZ LYS p 77 -19.518 11.282 2.096 1.00 0.00 N ATOM 0 H LYS p 77 -15.191 12.515 -2.876 1.00 0.00 H new ATOM 0 HA LYS p 77 -17.385 14.141 -1.861 1.00 0.00 H new ATOM 0 HB2 LYS p 77 -15.581 12.041 -0.885 1.00 0.00 H new ATOM 0 HB3 LYS p 77 -15.802 13.345 0.265 1.00 0.00 H new ATOM 0 HG2 LYS p 77 -18.243 12.187 -1.053 1.00 0.00 H new ATOM 0 HG3 LYS p 77 -17.441 11.242 0.185 1.00 0.00 H new ATOM 0 HD2 LYS p 77 -17.639 13.132 1.781 1.00 0.00 H new ATOM 0 HD3 LYS p 77 -18.395 14.115 0.543 1.00 0.00 H new ATOM 0 HE2 LYS p 77 -20.198 13.271 1.832 1.00 0.00 H new ATOM 0 HE3 LYS p 77 -20.201 12.305 0.370 1.00 0.00 H new ATOM 0 HZ1 LYS p 77 -20.468 10.930 2.331 1.00 0.00 H new ATOM 0 HZ2 LYS p 77 -19.003 10.557 1.557 1.00 0.00 H new ATOM 0 HZ3 LYS p 77 -19.001 11.493 2.973 1.00 0.00 H new ATOM 1293 N LEU p 78 -14.331 15.181 -2.070 1.00 0.00 N ATOM 1294 CA LEU p 78 -13.431 16.331 -1.899 1.00 0.00 C ATOM 1295 C LEU p 78 -14.085 17.651 -2.311 1.00 0.00 C ATOM 1296 O LEU p 78 -14.232 18.572 -1.503 1.00 0.00 O ATOM 1297 CB LEU p 78 -12.172 16.116 -2.744 1.00 0.00 C ATOM 1298 CG LEU p 78 -10.877 15.852 -1.980 1.00 0.00 C ATOM 1299 CD1 LEU p 78 -9.802 15.385 -2.943 1.00 0.00 C ATOM 1300 CD2 LEU p 78 -10.431 17.105 -1.250 1.00 0.00 C ATOM 0 H LEU p 78 -13.976 14.467 -2.706 1.00 0.00 H new ATOM 0 HA LEU p 78 -13.185 16.398 -0.839 1.00 0.00 H new ATOM 0 HB2 LEU p 78 -12.350 15.275 -3.414 1.00 0.00 H new ATOM 0 HB3 LEU p 78 -12.026 16.997 -3.369 1.00 0.00 H new ATOM 0 HG LEU p 78 -11.052 15.071 -1.240 1.00 0.00 H new ATOM 0 HD11 LEU p 78 -8.879 15.197 -2.395 1.00 0.00 H new ATOM 0 HD12 LEU p 78 -10.126 14.467 -3.433 1.00 0.00 H new ATOM 0 HD13 LEU p 78 -9.627 16.155 -3.695 1.00 0.00 H new ATOM 0 HD21 LEU p 78 -9.506 16.902 -0.710 1.00 0.00 H new ATOM 0 HD22 LEU p 78 -10.262 17.905 -1.971 1.00 0.00 H new ATOM 0 HD23 LEU p 78 -11.204 17.410 -0.545 1.00 0.00 H new ATOM 1312 N GLN p 79 -14.463 17.706 -3.578 1.00 0.00 N ATOM 1313 CA GLN p 79 -15.115 18.862 -4.176 1.00 0.00 C ATOM 1314 C GLN p 79 -16.636 18.750 -4.117 1.00 0.00 C ATOM 1315 O GLN p 79 -17.332 19.718 -3.800 1.00 0.00 O ATOM 1316 CB GLN p 79 -14.649 19.043 -5.633 1.00 0.00 C ATOM 1317 CG GLN p 79 -14.452 17.750 -6.433 1.00 0.00 C ATOM 1318 CD GLN p 79 -15.475 17.590 -7.539 1.00 0.00 C ATOM 1319 OE1 GLN p 79 -16.600 16.958 -7.219 1.00 0.00 O flip ATOM 1320 NE2 GLN p 79 -15.259 18.028 -8.670 1.00 0.00 N flip ATOM 0 H GLN p 79 -14.323 16.936 -4.232 1.00 0.00 H new ATOM 0 HA GLN p 79 -14.827 19.739 -3.596 1.00 0.00 H new ATOM 0 HB2 GLN p 79 -15.378 19.663 -6.154 1.00 0.00 H new ATOM 0 HB3 GLN p 79 -13.708 19.593 -5.629 1.00 0.00 H new ATOM 0 HG2 GLN p 79 -13.451 17.743 -6.865 1.00 0.00 H new ATOM 0 HG3 GLN p 79 -14.515 16.896 -5.758 1.00 0.00 H new ATOM 0 HE21 GLN p 79 -14.382 18.507 -8.872 1.00 0.00 H new ATOM 0 HE22 GLN p 79 -15.958 17.912 -9.404 1.00 0.00 H new ATOM 1329 N ALA p 80 -17.129 17.545 -4.424 1.00 0.00 N ATOM 1330 CA ALA p 80 -18.573 17.209 -4.434 1.00 0.00 C ATOM 1331 C ALA p 80 -19.357 18.050 -5.450 1.00 0.00 C ATOM 1332 O ALA p 80 -19.464 19.281 -5.255 1.00 0.00 O ATOM 1333 CB ALA p 80 -19.189 17.331 -3.036 1.00 0.00 C ATOM 1334 OXT ALA p 80 -19.857 17.466 -6.435 1.00 0.00 O ATOM 0 H ALA p 80 -16.533 16.757 -4.678 1.00 0.00 H new ATOM 0 HA ALA p 80 -18.647 16.168 -4.747 1.00 0.00 H new ATOM 0 HB1 ALA p 80 -20.248 17.077 -3.082 1.00 0.00 H new ATOM 0 HB2 ALA p 80 -18.682 16.649 -2.354 1.00 0.00 H new ATOM 0 HB3 ALA p 80 -19.076 18.354 -2.677 1.00 0.00 H new TER 1340 ALA p 80