USER MOD reduce.3.24.130724 H: found=0, std=0, add=687, rem=0, adj=9 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 Set 1.1: p 11 ASN : amide:sc= -2.7! C(o=-4.4!,f=-1.5!) USER MOD Set 1.2: p 71 ASN : amide:sc= -1.72! K(o=-4.4!,f=-0.074) USER MOD Set 2.1: p 20 LYS NZ :NH3+ -177:sc= 0.489 (180deg=0) USER MOD Set 2.2: p 24 GLN : amide:sc= -0.66 K(o=-0.17,f=-6.3!) USER MOD Set 3.1: p 2 GLN : amide:sc= 0.508 K(o=1.4,f=-6.1!) USER MOD Set 3.2: p 6 LYS NZ :NH3+ 176:sc= 0.942 (180deg=0) USER MOD Single : p 1 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : p 1 MET N :NH3+ 151:sc= 1.35 (180deg=1.07) USER MOD Single : p 10 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : p 16 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 : amide:sc= -0.255 X(o=-0.25,f=-0.0026) USER MOD Single : p 33 ASN : amide:sc= -0.302 K(o=-0.3,f=-1) USER MOD Single : p 34 CYS SG : rot -6:sc= 0.0683 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= -0.161 USER MOD Single : p 42 SER OG : rot 180:sc= 0 USER MOD Single : p 43 ASN : amide:sc= 0 X(o=0,f=0) 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+ 180:sc= 0 (180deg=0) 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 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+ 180:sc= 0 (180deg=0) USER MOD Single : p 77 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : p 79 GLN : amide:sc= 0 X(o=0,f=0) USER MOD ----------------------------------------------------------------- ATOM 1 N MET p 1 -9.885 22.780 2.782 1.00 0.00 N ATOM 2 CA MET p 1 -8.483 22.872 2.296 1.00 0.00 C ATOM 3 C MET p 1 -7.499 22.485 3.395 1.00 0.00 C ATOM 4 O MET p 1 -7.779 22.676 4.582 1.00 0.00 O ATOM 5 CB MET p 1 -8.180 24.293 1.804 1.00 0.00 C ATOM 6 CG MET p 1 -8.793 24.618 0.448 1.00 0.00 C ATOM 7 SD MET p 1 -10.597 24.621 0.480 1.00 0.00 S ATOM 8 CE MET p 1 -10.965 25.023 -1.226 1.00 0.00 C ATOM 0 H1 MET p 1 -10.476 23.465 2.269 1.00 0.00 H new ATOM 0 H2 MET p 1 -10.247 21.819 2.618 1.00 0.00 H new ATOM 0 H3 MET p 1 -9.914 22.992 3.800 1.00 0.00 H new ATOM 0 HA MET p 1 -8.368 22.175 1.466 1.00 0.00 H new ATOM 0 HB2 MET p 1 -8.548 25.008 2.539 1.00 0.00 H new ATOM 0 HB3 MET p 1 -7.100 24.424 1.745 1.00 0.00 H new ATOM 0 HG2 MET p 1 -8.438 25.595 0.118 1.00 0.00 H new ATOM 0 HG3 MET p 1 -8.448 23.889 -0.286 1.00 0.00 H new ATOM 0 HE1 MET p 1 -12.045 25.062 -1.366 1.00 0.00 H new ATOM 0 HE2 MET p 1 -10.532 25.992 -1.473 1.00 0.00 H new ATOM 0 HE3 MET p 1 -10.542 24.260 -1.879 1.00 0.00 H new ATOM 20 N GLN p 2 -6.321 21.959 2.977 1.00 0.00 N ATOM 21 CA GLN p 2 -5.240 21.509 3.848 1.00 0.00 C ATOM 22 C GLN p 2 -5.663 20.459 4.908 1.00 0.00 C ATOM 23 O GLN p 2 -4.824 19.944 5.641 1.00 0.00 O ATOM 24 CB GLN p 2 -4.612 22.732 4.481 1.00 0.00 C ATOM 25 CG GLN p 2 -3.109 22.648 4.592 1.00 0.00 C ATOM 26 CD GLN p 2 -2.576 23.257 5.872 1.00 0.00 C ATOM 27 OE1 GLN p 2 -2.466 22.583 6.896 1.00 0.00 O ATOM 28 NE2 GLN p 2 -2.239 24.541 5.820 1.00 0.00 N ATOM 0 H GLN p 2 -6.104 21.838 1.988 1.00 0.00 H new ATOM 0 HA GLN p 2 -4.513 20.976 3.235 1.00 0.00 H new ATOM 0 HB2 GLN p 2 -4.876 23.611 3.894 1.00 0.00 H new ATOM 0 HB3 GLN p 2 -5.034 22.874 5.476 1.00 0.00 H new ATOM 0 HG2 GLN p 2 -2.804 21.603 4.539 1.00 0.00 H new ATOM 0 HG3 GLN p 2 -2.658 23.156 3.739 1.00 0.00 H new ATOM 0 HE21 GLN p 2 -2.347 25.062 4.950 1.00 0.00 H new ATOM 0 HE22 GLN p 2 -1.872 25.006 6.650 1.00 0.00 H new ATOM 37 N ALA p 3 -6.964 20.201 5.006 1.00 0.00 N ATOM 38 CA ALA p 3 -7.527 19.217 5.938 1.00 0.00 C ATOM 39 C ALA p 3 -7.693 17.871 5.245 1.00 0.00 C ATOM 40 O ALA p 3 -7.434 16.810 5.812 1.00 0.00 O ATOM 41 CB ALA p 3 -8.853 19.710 6.502 1.00 0.00 C ATOM 0 H ALA p 3 -7.668 20.671 4.437 1.00 0.00 H new ATOM 0 HA ALA p 3 -6.837 19.089 6.772 1.00 0.00 H new ATOM 0 HB1 ALA p 3 -9.254 18.967 7.191 1.00 0.00 H new ATOM 0 HB2 ALA p 3 -8.696 20.649 7.033 1.00 0.00 H new ATOM 0 HB3 ALA p 3 -9.559 19.868 5.687 1.00 0.00 H new ATOM 47 N LEU p 4 -8.151 17.983 4.001 1.00 0.00 N ATOM 48 CA LEU p 4 -8.427 16.889 3.098 1.00 0.00 C ATOM 49 C LEU p 4 -7.214 16.650 2.231 1.00 0.00 C ATOM 50 O LEU p 4 -6.721 15.537 2.120 1.00 0.00 O ATOM 51 CB LEU p 4 -9.624 17.262 2.225 1.00 0.00 C ATOM 52 CG LEU p 4 -11.013 16.915 2.767 1.00 0.00 C ATOM 53 CD1 LEU p 4 -11.354 17.719 4.020 1.00 0.00 C ATOM 54 CD2 LEU p 4 -12.029 17.180 1.681 1.00 0.00 C ATOM 0 H LEU p 4 -8.347 18.892 3.581 1.00 0.00 H new ATOM 0 HA LEU p 4 -8.654 15.982 3.658 1.00 0.00 H new ATOM 0 HB2 LEU p 4 -9.590 18.336 2.044 1.00 0.00 H new ATOM 0 HB3 LEU p 4 -9.505 16.772 1.259 1.00 0.00 H new ATOM 0 HG LEU p 4 -11.026 15.863 3.053 1.00 0.00 H new ATOM 0 HD11 LEU p 4 -12.348 17.442 4.371 1.00 0.00 H new ATOM 0 HD12 LEU p 4 -10.622 17.507 4.799 1.00 0.00 H new ATOM 0 HD13 LEU p 4 -11.336 18.783 3.785 1.00 0.00 H new ATOM 0 HD21 LEU p 4 -13.026 16.938 2.049 1.00 0.00 H new ATOM 0 HD22 LEU p 4 -11.992 18.232 1.397 1.00 0.00 H new ATOM 0 HD23 LEU p 4 -11.803 16.561 0.812 1.00 0.00 H new ATOM 66 N GLU p 5 -6.773 17.751 1.616 1.00 0.00 N ATOM 67 CA GLU p 5 -5.583 17.800 0.739 1.00 0.00 C ATOM 68 C GLU p 5 -4.340 17.323 1.477 1.00 0.00 C ATOM 69 O GLU p 5 -3.413 16.779 0.876 1.00 0.00 O ATOM 70 CB GLU p 5 -5.331 19.226 0.226 1.00 0.00 C ATOM 71 CG GLU p 5 -6.595 20.035 -0.030 1.00 0.00 C ATOM 72 CD GLU p 5 -6.644 20.618 -1.429 1.00 0.00 C ATOM 73 OE1 GLU p 5 -6.142 21.745 -1.621 1.00 0.00 O ATOM 74 OE2 GLU p 5 -7.184 19.947 -2.333 1.00 0.00 O ATOM 0 H GLU p 5 -7.237 18.654 1.711 1.00 0.00 H new ATOM 0 HA GLU p 5 -5.783 17.140 -0.105 1.00 0.00 H new ATOM 0 HB2 GLU p 5 -4.715 19.757 0.952 1.00 0.00 H new ATOM 0 HB3 GLU p 5 -4.756 19.170 -0.699 1.00 0.00 H new ATOM 0 HG2 GLU p 5 -7.466 19.398 0.125 1.00 0.00 H new ATOM 0 HG3 GLU p 5 -6.658 20.843 0.698 1.00 0.00 H new ATOM 81 N LYS p 6 -4.348 17.562 2.787 1.00 0.00 N ATOM 82 CA LYS p 6 -3.264 17.148 3.680 1.00 0.00 C ATOM 83 C LYS p 6 -3.507 15.734 4.169 1.00 0.00 C ATOM 84 O LYS p 6 -2.577 15.044 4.545 1.00 0.00 O ATOM 85 CB LYS p 6 -3.116 18.078 4.872 1.00 0.00 C ATOM 86 CG LYS p 6 -1.829 18.885 4.855 1.00 0.00 C ATOM 87 CD LYS p 6 -1.613 19.622 6.166 1.00 0.00 C ATOM 88 CE LYS p 6 -0.358 20.479 6.122 1.00 0.00 C ATOM 89 NZ LYS p 6 -0.120 21.185 7.411 1.00 0.00 N ATOM 0 H LYS p 6 -5.108 18.049 3.262 1.00 0.00 H new ATOM 0 HA LYS p 6 -2.338 17.192 3.107 1.00 0.00 H new ATOM 0 HB2 LYS p 6 -3.964 18.762 4.896 1.00 0.00 H new ATOM 0 HB3 LYS p 6 -3.155 17.490 5.789 1.00 0.00 H new ATOM 0 HG2 LYS p 6 -0.985 18.221 4.667 1.00 0.00 H new ATOM 0 HG3 LYS p 6 -1.859 19.602 4.035 1.00 0.00 H new ATOM 0 HD2 LYS p 6 -2.477 20.251 6.378 1.00 0.00 H new ATOM 0 HD3 LYS p 6 -1.535 18.902 6.981 1.00 0.00 H new ATOM 0 HE2 LYS p 6 0.502 19.851 5.888 1.00 0.00 H new ATOM 0 HE3 LYS p 6 -0.446 21.211 5.319 1.00 0.00 H new ATOM 0 HZ1 LYS p 6 0.780 21.704 7.362 1.00 0.00 H new ATOM 0 HZ2 LYS p 6 -0.896 21.854 7.589 1.00 0.00 H new ATOM 0 HZ3 LYS p 6 -0.077 20.491 8.184 1.00 0.00 H new ATOM 103 N GLU p 7 -4.783 15.336 4.135 1.00 0.00 N ATOM 104 CA GLU p 7 -5.248 14.001 4.510 1.00 0.00 C ATOM 105 C GLU p 7 -5.048 13.105 3.290 1.00 0.00 C ATOM 106 O GLU p 7 -5.020 11.881 3.364 1.00 0.00 O ATOM 107 CB GLU p 7 -6.722 14.097 4.927 1.00 0.00 C ATOM 108 CG GLU p 7 -7.569 12.873 4.625 1.00 0.00 C ATOM 109 CD GLU p 7 -8.239 12.297 5.856 1.00 0.00 C ATOM 110 OE1 GLU p 7 -9.364 12.735 6.179 1.00 0.00 O ATOM 111 OE2 GLU p 7 -7.640 11.409 6.498 1.00 0.00 O ATOM 0 H GLU p 7 -5.540 15.952 3.837 1.00 0.00 H new ATOM 0 HA GLU p 7 -4.698 13.583 5.353 1.00 0.00 H new ATOM 0 HB2 GLU p 7 -6.766 14.292 5.998 1.00 0.00 H new ATOM 0 HB3 GLU p 7 -7.167 14.957 4.428 1.00 0.00 H new ATOM 0 HG2 GLU p 7 -8.332 13.138 3.893 1.00 0.00 H new ATOM 0 HG3 GLU p 7 -6.942 12.108 4.168 1.00 0.00 H new ATOM 118 N LEU p 8 -4.925 13.824 2.184 1.00 0.00 N ATOM 119 CA LEU p 8 -4.667 13.343 0.850 1.00 0.00 C ATOM 120 C LEU p 8 -3.163 13.298 0.710 1.00 0.00 C ATOM 121 O LEU p 8 -2.611 12.468 0.003 1.00 0.00 O ATOM 122 CB LEU p 8 -5.248 14.359 -0.136 1.00 0.00 C ATOM 123 CG LEU p 8 -5.588 13.900 -1.554 1.00 0.00 C ATOM 124 CD1 LEU p 8 -6.070 15.110 -2.313 1.00 0.00 C ATOM 125 CD2 LEU p 8 -4.389 13.287 -2.268 1.00 0.00 C ATOM 0 H LEU p 8 -5.011 14.840 2.207 1.00 0.00 H new ATOM 0 HA LEU p 8 -5.108 12.365 0.659 1.00 0.00 H new ATOM 0 HB2 LEU p 8 -6.158 14.765 0.306 1.00 0.00 H new ATOM 0 HB3 LEU p 8 -4.539 15.183 -0.217 1.00 0.00 H new ATOM 0 HG LEU p 8 -6.352 13.124 -1.505 1.00 0.00 H new ATOM 0 HD11 LEU p 8 -6.323 14.822 -3.333 1.00 0.00 H new ATOM 0 HD12 LEU p 8 -6.952 15.520 -1.822 1.00 0.00 H new ATOM 0 HD13 LEU p 8 -5.283 15.864 -2.333 1.00 0.00 H new ATOM 0 HD21 LEU p 8 -4.682 12.977 -3.271 1.00 0.00 H new ATOM 0 HD22 LEU p 8 -3.589 14.025 -2.335 1.00 0.00 H new ATOM 0 HD23 LEU p 8 -4.037 12.420 -1.709 1.00 0.00 H new ATOM 137 N ALA p 9 -2.548 14.284 1.380 1.00 0.00 N ATOM 138 CA ALA p 9 -1.093 14.426 1.483 1.00 0.00 C ATOM 139 C ALA p 9 -0.584 13.434 2.522 1.00 0.00 C ATOM 140 O ALA p 9 0.586 13.043 2.525 1.00 0.00 O ATOM 141 CB ALA p 9 -0.676 15.843 1.844 1.00 0.00 C ATOM 0 H ALA p 9 -3.059 15.016 1.873 1.00 0.00 H new ATOM 0 HA ALA p 9 -0.652 14.215 0.509 1.00 0.00 H new ATOM 0 HB1 ALA p 9 0.411 15.897 1.908 1.00 0.00 H new ATOM 0 HB2 ALA p 9 -1.029 16.533 1.077 1.00 0.00 H new ATOM 0 HB3 ALA p 9 -1.111 16.116 2.806 1.00 0.00 H new ATOM 147 N GLN p 10 -1.517 13.046 3.409 1.00 0.00 N ATOM 148 CA GLN p 10 -1.295 12.040 4.437 1.00 0.00 C ATOM 149 C GLN p 10 -1.546 10.725 3.783 1.00 0.00 C ATOM 150 O GLN p 10 -0.907 9.740 4.065 1.00 0.00 O ATOM 151 CB GLN p 10 -2.285 12.182 5.566 1.00 0.00 C ATOM 152 CG GLN p 10 -2.040 13.379 6.429 1.00 0.00 C ATOM 153 CD GLN p 10 -1.522 13.029 7.809 1.00 0.00 C ATOM 154 OE1 GLN p 10 -0.315 12.941 8.028 1.00 0.00 O ATOM 155 NE2 GLN p 10 -2.437 12.825 8.750 1.00 0.00 N ATOM 0 H GLN p 10 -2.460 13.436 3.423 1.00 0.00 H new ATOM 0 HA GLN p 10 -0.289 12.140 4.845 1.00 0.00 H new ATOM 0 HB2 GLN p 10 -3.291 12.243 5.151 1.00 0.00 H new ATOM 0 HB3 GLN p 10 -2.250 11.285 6.184 1.00 0.00 H new ATOM 0 HG2 GLN p 10 -1.322 14.033 5.935 1.00 0.00 H new ATOM 0 HG3 GLN p 10 -2.968 13.942 6.529 1.00 0.00 H new ATOM 0 HE21 GLN p 10 -3.428 12.909 8.524 1.00 0.00 H new ATOM 0 HE22 GLN p 10 -2.148 12.585 9.698 1.00 0.00 H new ATOM 164 N ASN p 11 -2.559 10.792 2.926 1.00 0.00 N ATOM 165 CA ASN p 11 -3.008 9.685 2.066 1.00 0.00 C ATOM 166 C ASN p 11 -1.991 9.497 0.957 1.00 0.00 C ATOM 167 O ASN p 11 -1.943 8.453 0.313 1.00 0.00 O ATOM 168 CB ASN p 11 -4.390 9.949 1.462 1.00 0.00 C ATOM 169 CG ASN p 11 -5.227 8.687 1.306 1.00 0.00 C ATOM 170 OD1 ASN p 11 -5.107 7.736 2.083 1.00 0.00 O ATOM 171 ND2 ASN p 11 -6.090 8.677 0.296 1.00 0.00 N ATOM 0 H ASN p 11 -3.112 11.640 2.801 1.00 0.00 H new ATOM 0 HA ASN p 11 -3.090 8.785 2.675 1.00 0.00 H new ATOM 0 HB2 ASN p 11 -4.926 10.657 2.094 1.00 0.00 H new ATOM 0 HB3 ASN p 11 -4.269 10.420 0.486 1.00 0.00 H new ATOM 0 HD21 ASN p 11 -6.684 7.862 0.141 1.00 0.00 H new ATOM 0 HD22 ASN p 11 -6.159 9.484 -0.324 1.00 0.00 H new ATOM 178 N GLU p 12 -1.212 10.570 0.745 1.00 0.00 N ATOM 179 CA GLU p 12 -0.118 10.625 -0.175 1.00 0.00 C ATOM 180 C GLU p 12 1.072 10.065 0.567 1.00 0.00 C ATOM 181 O GLU p 12 1.996 9.494 -0.001 1.00 0.00 O ATOM 182 CB GLU p 12 0.119 12.074 -0.500 1.00 0.00 C ATOM 183 CG GLU p 12 1.250 12.305 -1.439 1.00 0.00 C ATOM 184 CD GLU p 12 0.836 12.978 -2.733 1.00 0.00 C ATOM 185 OE1 GLU p 12 0.849 14.225 -2.784 1.00 0.00 O ATOM 186 OE2 GLU p 12 0.500 12.257 -3.695 1.00 0.00 O ATOM 0 H GLU p 12 -1.353 11.449 1.243 1.00 0.00 H new ATOM 0 HA GLU p 12 -0.299 10.070 -1.095 1.00 0.00 H new ATOM 0 HB2 GLU p 12 -0.790 12.493 -0.932 1.00 0.00 H new ATOM 0 HB3 GLU p 12 0.311 12.617 0.425 1.00 0.00 H new ATOM 0 HG2 GLU p 12 2.003 12.919 -0.944 1.00 0.00 H new ATOM 0 HG3 GLU p 12 1.720 11.349 -1.670 1.00 0.00 H new ATOM 193 N TRP p 13 0.992 10.334 1.864 1.00 0.00 N ATOM 194 CA TRP p 13 1.950 9.878 2.869 1.00 0.00 C ATOM 195 C TRP p 13 1.632 8.425 3.232 1.00 0.00 C ATOM 196 O TRP p 13 2.486 7.699 3.731 1.00 0.00 O ATOM 197 CB TRP p 13 1.915 10.769 4.113 1.00 0.00 C ATOM 198 CG TRP p 13 3.207 10.780 4.883 1.00 0.00 C ATOM 199 CD1 TRP p 13 4.240 11.659 4.729 1.00 0.00 C ATOM 200 CD2 TRP p 13 3.606 9.870 5.921 1.00 0.00 C ATOM 201 NE1 TRP p 13 5.254 11.356 5.604 1.00 0.00 N ATOM 202 CE2 TRP p 13 4.890 10.264 6.347 1.00 0.00 C ATOM 203 CE3 TRP p 13 3.005 8.763 6.535 1.00 0.00 C ATOM 204 CZ2 TRP p 13 5.580 9.592 7.353 1.00 0.00 C ATOM 205 CZ3 TRP p 13 3.693 8.098 7.533 1.00 0.00 C ATOM 206 CH2 TRP p 13 4.968 8.515 7.933 1.00 0.00 C ATOM 0 H TRP p 13 0.236 10.893 2.260 1.00 0.00 H new ATOM 0 HA TRP p 13 2.957 9.940 2.457 1.00 0.00 H new ATOM 0 HB2 TRP p 13 1.672 11.788 3.813 1.00 0.00 H new ATOM 0 HB3 TRP p 13 1.113 10.431 4.770 1.00 0.00 H new ATOM 0 HD1 TRP p 13 4.257 12.475 4.021 1.00 0.00 H new ATOM 0 HE1 TRP p 13 6.136 11.862 5.687 1.00 0.00 H new ATOM 0 HE3 TRP p 13 2.021 8.435 6.234 1.00 0.00 H new ATOM 0 HZ2 TRP p 13 6.564 9.910 7.664 1.00 0.00 H new ATOM 0 HZ3 TRP p 13 3.239 7.243 8.012 1.00 0.00 H new ATOM 0 HH2 TRP p 13 5.479 7.975 8.716 1.00 0.00 H new ATOM 217 N GLU p 14 0.360 8.053 2.993 1.00 0.00 N ATOM 218 CA GLU p 14 -0.141 6.674 3.184 1.00 0.00 C ATOM 219 C GLU p 14 0.014 5.986 1.864 1.00 0.00 C ATOM 220 O GLU p 14 -0.076 4.769 1.750 1.00 0.00 O ATOM 221 CB GLU p 14 -1.605 6.613 3.605 1.00 0.00 C ATOM 222 CG GLU p 14 -1.903 7.489 4.788 1.00 0.00 C ATOM 223 CD GLU p 14 -2.780 6.819 5.828 1.00 0.00 C ATOM 224 OE1 GLU p 14 -4.019 6.935 5.724 1.00 0.00 O ATOM 225 OE2 GLU p 14 -2.227 6.178 6.747 1.00 0.00 O ATOM 0 H GLU p 14 -0.354 8.702 2.661 1.00 0.00 H new ATOM 0 HA GLU p 14 0.425 6.202 3.987 1.00 0.00 H new ATOM 0 HB2 GLU p 14 -2.233 6.915 2.767 1.00 0.00 H new ATOM 0 HB3 GLU p 14 -1.867 5.583 3.845 1.00 0.00 H new ATOM 0 HG2 GLU p 14 -0.964 7.789 5.254 1.00 0.00 H new ATOM 0 HG3 GLU p 14 -2.393 8.399 4.442 1.00 0.00 H new ATOM 232 N LEU p 15 0.173 6.857 0.872 1.00 0.00 N ATOM 233 CA LEU p 15 0.454 6.494 -0.512 1.00 0.00 C ATOM 234 C LEU p 15 1.953 6.274 -0.591 1.00 0.00 C ATOM 235 O LEU p 15 2.438 5.453 -1.350 1.00 0.00 O ATOM 236 CB LEU p 15 0.018 7.605 -1.489 1.00 0.00 C ATOM 237 CG LEU p 15 0.181 7.345 -3.003 1.00 0.00 C ATOM 238 CD1 LEU p 15 1.503 7.912 -3.485 1.00 0.00 C ATOM 239 CD2 LEU p 15 0.093 5.864 -3.325 1.00 0.00 C ATOM 0 H LEU p 15 0.108 7.865 1.014 1.00 0.00 H new ATOM 0 HA LEU p 15 -0.102 5.601 -0.798 1.00 0.00 H new ATOM 0 HB2 LEU p 15 -1.033 7.823 -1.299 1.00 0.00 H new ATOM 0 HB3 LEU p 15 0.580 8.506 -1.243 1.00 0.00 H new ATOM 0 HG LEU p 15 -0.636 7.845 -3.523 1.00 0.00 H new ATOM 0 HD11 LEU p 15 1.611 7.725 -4.553 1.00 0.00 H new ATOM 0 HD12 LEU p 15 1.527 8.986 -3.300 1.00 0.00 H new ATOM 0 HD13 LEU p 15 2.322 7.433 -2.948 1.00 0.00 H new ATOM 0 HD21 LEU p 15 0.212 5.717 -4.399 1.00 0.00 H new ATOM 0 HD22 LEU p 15 0.882 5.329 -2.796 1.00 0.00 H new ATOM 0 HD23 LEU p 15 -0.878 5.481 -3.012 1.00 0.00 H new ATOM 251 N GLN p 16 2.633 7.040 0.259 1.00 0.00 N ATOM 252 CA GLN p 16 4.051 7.030 0.463 1.00 0.00 C ATOM 253 C GLN p 16 4.365 5.877 1.384 1.00 0.00 C ATOM 254 O GLN p 16 5.427 5.285 1.326 1.00 0.00 O ATOM 255 CB GLN p 16 4.390 8.332 1.140 1.00 0.00 C ATOM 256 CG GLN p 16 5.846 8.543 1.356 1.00 0.00 C ATOM 257 CD GLN p 16 6.407 9.727 0.594 1.00 0.00 C ATOM 258 OE1 GLN p 16 6.856 9.590 -0.545 1.00 0.00 O ATOM 259 NE2 GLN p 16 6.388 10.897 1.221 1.00 0.00 N ATOM 0 H GLN p 16 2.164 7.722 0.854 1.00 0.00 H new ATOM 0 HA GLN p 16 4.614 6.922 -0.464 1.00 0.00 H new ATOM 0 HB2 GLN p 16 4.000 9.154 0.539 1.00 0.00 H new ATOM 0 HB3 GLN p 16 3.881 8.372 2.103 1.00 0.00 H new ATOM 0 HG2 GLN p 16 6.030 8.687 2.421 1.00 0.00 H new ATOM 0 HG3 GLN p 16 6.383 7.642 1.058 1.00 0.00 H new ATOM 0 HE21 GLN p 16 6.006 10.964 2.165 1.00 0.00 H new ATOM 0 HE22 GLN p 16 6.755 11.729 0.759 1.00 0.00 H new ATOM 268 N ALA p 17 3.406 5.682 2.281 1.00 0.00 N ATOM 269 CA ALA p 17 3.392 4.580 3.249 1.00 0.00 C ATOM 270 C ALA p 17 2.850 3.350 2.547 1.00 0.00 C ATOM 271 O ALA p 17 3.001 2.229 3.024 1.00 0.00 O ATOM 272 CB ALA p 17 2.565 4.898 4.487 1.00 0.00 C ATOM 0 H ALA p 17 2.596 6.297 2.362 1.00 0.00 H new ATOM 0 HA ALA p 17 4.409 4.410 3.602 1.00 0.00 H new ATOM 0 HB1 ALA p 17 2.589 4.048 5.169 1.00 0.00 H new ATOM 0 HB2 ALA p 17 2.978 5.775 4.985 1.00 0.00 H new ATOM 0 HB3 ALA p 17 1.534 5.099 4.194 1.00 0.00 H new ATOM 278 N LEU p 18 2.193 3.620 1.404 1.00 0.00 N ATOM 279 CA LEU p 18 1.654 2.604 0.509 1.00 0.00 C ATOM 280 C LEU p 18 2.780 2.159 -0.368 1.00 0.00 C ATOM 281 O LEU p 18 2.877 1.008 -0.758 1.00 0.00 O ATOM 282 CB LEU p 18 0.578 3.209 -0.361 1.00 0.00 C ATOM 283 CG LEU p 18 -0.498 2.273 -0.835 1.00 0.00 C ATOM 284 CD1 LEU p 18 -1.453 2.033 0.304 1.00 0.00 C ATOM 285 CD2 LEU p 18 -1.191 2.890 -2.022 1.00 0.00 C ATOM 0 H LEU p 18 2.024 4.572 1.079 1.00 0.00 H new ATOM 0 HA LEU p 18 1.229 1.776 1.077 1.00 0.00 H new ATOM 0 HB2 LEU p 18 0.106 4.021 0.193 1.00 0.00 H new ATOM 0 HB3 LEU p 18 1.054 3.654 -1.235 1.00 0.00 H new ATOM 0 HG LEU p 18 -0.083 1.315 -1.147 1.00 0.00 H new ATOM 0 HD11 LEU p 18 -2.243 1.355 -0.020 1.00 0.00 H new ATOM 0 HD12 LEU p 18 -0.915 1.590 1.142 1.00 0.00 H new ATOM 0 HD13 LEU p 18 -1.893 2.980 0.615 1.00 0.00 H new ATOM 0 HD21 LEU p 18 -1.974 2.219 -2.375 1.00 0.00 H new ATOM 0 HD22 LEU p 18 -1.633 3.843 -1.731 1.00 0.00 H new ATOM 0 HD23 LEU p 18 -0.468 3.055 -2.820 1.00 0.00 H new ATOM 297 N GLU p 19 3.574 3.172 -0.701 1.00 0.00 N ATOM 298 CA GLU p 19 4.826 3.020 -1.472 1.00 0.00 C ATOM 299 C GLU p 19 5.844 2.447 -0.525 1.00 0.00 C ATOM 300 O GLU p 19 6.624 1.588 -0.852 1.00 0.00 O ATOM 301 CB GLU p 19 5.372 4.345 -2.019 1.00 0.00 C ATOM 302 CG GLU p 19 4.405 5.081 -2.905 1.00 0.00 C ATOM 303 CD GLU p 19 4.884 5.212 -4.338 1.00 0.00 C ATOM 304 OE1 GLU p 19 4.643 4.280 -5.132 1.00 0.00 O ATOM 305 OE2 GLU p 19 5.499 6.249 -4.664 1.00 0.00 O ATOM 0 H GLU p 19 3.373 4.138 -0.445 1.00 0.00 H new ATOM 0 HA GLU p 19 4.624 2.385 -2.334 1.00 0.00 H new ATOM 0 HB2 GLU p 19 5.645 4.988 -1.182 1.00 0.00 H new ATOM 0 HB3 GLU p 19 6.285 4.147 -2.580 1.00 0.00 H new ATOM 0 HG2 GLU p 19 3.447 4.561 -2.896 1.00 0.00 H new ATOM 0 HG3 GLU p 19 4.232 6.076 -2.495 1.00 0.00 H new ATOM 312 N LYS p 20 5.786 2.957 0.680 1.00 0.00 N ATOM 313 CA LYS p 20 6.635 2.477 1.779 1.00 0.00 C ATOM 314 C LYS p 20 6.149 1.091 2.191 1.00 0.00 C ATOM 315 O LYS p 20 6.772 0.384 2.978 1.00 0.00 O ATOM 316 CB LYS p 20 6.597 3.426 2.966 1.00 0.00 C ATOM 317 CG LYS p 20 7.964 3.888 3.441 1.00 0.00 C ATOM 318 CD LYS p 20 8.250 3.432 4.862 1.00 0.00 C ATOM 319 CE LYS p 20 9.576 3.979 5.363 1.00 0.00 C ATOM 320 NZ LYS p 20 9.874 3.528 6.750 1.00 0.00 N ATOM 0 H LYS p 20 5.156 3.715 0.942 1.00 0.00 H new ATOM 0 HA LYS p 20 7.669 2.429 1.439 1.00 0.00 H new ATOM 0 HB2 LYS p 20 6.004 4.300 2.698 1.00 0.00 H new ATOM 0 HB3 LYS p 20 6.085 2.934 3.793 1.00 0.00 H new ATOM 0 HG2 LYS p 20 8.732 3.499 2.773 1.00 0.00 H new ATOM 0 HG3 LYS p 20 8.018 4.975 3.390 1.00 0.00 H new ATOM 0 HD2 LYS p 20 7.446 3.762 5.520 1.00 0.00 H new ATOM 0 HD3 LYS p 20 8.266 2.343 4.900 1.00 0.00 H new ATOM 0 HE2 LYS p 20 10.376 3.657 4.697 1.00 0.00 H new ATOM 0 HE3 LYS p 20 9.554 5.068 5.332 1.00 0.00 H new ATOM 0 HZ1 LYS p 20 10.761 3.963 7.073 1.00 0.00 H new ATOM 0 HZ2 LYS p 20 9.098 3.813 7.382 1.00 0.00 H new ATOM 0 HZ3 LYS p 20 9.971 2.493 6.765 1.00 0.00 H new ATOM 334 N GLU p 21 4.979 0.765 1.679 1.00 0.00 N ATOM 335 CA GLU p 21 4.379 -0.544 1.841 1.00 0.00 C ATOM 336 C GLU p 21 4.699 -1.330 0.578 1.00 0.00 C ATOM 337 O GLU p 21 4.912 -2.545 0.602 1.00 0.00 O ATOM 338 CB GLU p 21 2.867 -0.403 2.075 1.00 0.00 C ATOM 339 CG GLU p 21 2.002 -1.503 1.475 1.00 0.00 C ATOM 340 CD GLU p 21 1.262 -2.310 2.524 1.00 0.00 C ATOM 341 OE1 GLU p 21 1.818 -3.323 2.995 1.00 0.00 O ATOM 342 OE2 GLU p 21 0.125 -1.928 2.873 1.00 0.00 O ATOM 0 H GLU p 21 4.411 1.411 1.131 1.00 0.00 H new ATOM 0 HA GLU p 21 4.775 -1.070 2.710 1.00 0.00 H new ATOM 0 HB2 GLU p 21 2.686 -0.368 3.149 1.00 0.00 H new ATOM 0 HB3 GLU p 21 2.542 0.554 1.666 1.00 0.00 H new ATOM 0 HG2 GLU p 21 1.280 -1.058 0.790 1.00 0.00 H new ATOM 0 HG3 GLU p 21 2.630 -2.171 0.886 1.00 0.00 H new ATOM 349 N LEU p 22 4.725 -0.574 -0.522 1.00 0.00 N ATOM 350 CA LEU p 22 5.005 -1.094 -1.840 1.00 0.00 C ATOM 351 C LEU p 22 6.484 -1.045 -2.183 1.00 0.00 C ATOM 352 O LEU p 22 7.073 -2.061 -2.537 1.00 0.00 O ATOM 353 CB LEU p 22 4.240 -0.261 -2.866 1.00 0.00 C ATOM 354 CG LEU p 22 3.525 -1.013 -3.978 1.00 0.00 C ATOM 355 CD1 LEU p 22 2.793 -0.004 -4.831 1.00 0.00 C ATOM 356 CD2 LEU p 22 4.512 -1.809 -4.814 1.00 0.00 C ATOM 0 H LEU p 22 4.548 0.430 -0.510 1.00 0.00 H new ATOM 0 HA LEU p 22 4.694 -2.139 -1.857 1.00 0.00 H new ATOM 0 HB2 LEU p 22 3.501 0.336 -2.332 1.00 0.00 H new ATOM 0 HB3 LEU p 22 4.941 0.436 -3.326 1.00 0.00 H new ATOM 0 HG LEU p 22 2.818 -1.724 -3.550 1.00 0.00 H new ATOM 0 HD11 LEU p 22 2.271 -0.520 -5.637 1.00 0.00 H new ATOM 0 HD12 LEU p 22 2.071 0.535 -4.218 1.00 0.00 H new ATOM 0 HD13 LEU p 22 3.508 0.701 -5.254 1.00 0.00 H new ATOM 0 HD21 LEU p 22 3.977 -2.338 -5.603 1.00 0.00 H new ATOM 0 HD22 LEU p 22 5.240 -1.132 -5.261 1.00 0.00 H new ATOM 0 HD23 LEU p 22 5.028 -2.529 -4.179 1.00 0.00 H new ATOM 368 N ALA p 23 7.069 0.142 -2.042 1.00 0.00 N ATOM 369 CA ALA p 23 8.482 0.367 -2.405 1.00 0.00 C ATOM 370 C ALA p 23 9.472 0.090 -1.276 1.00 0.00 C ATOM 371 O ALA p 23 10.672 -0.001 -1.538 1.00 0.00 O ATOM 372 CB ALA p 23 8.674 1.779 -2.947 1.00 0.00 C ATOM 0 H ALA p 23 6.593 0.968 -1.680 1.00 0.00 H new ATOM 0 HA ALA p 23 8.708 -0.364 -3.182 1.00 0.00 H new ATOM 0 HB1 ALA p 23 9.721 1.929 -3.210 1.00 0.00 H new ATOM 0 HB2 ALA p 23 8.054 1.916 -3.833 1.00 0.00 H new ATOM 0 HB3 ALA p 23 8.384 2.503 -2.186 1.00 0.00 H new ATOM 378 N GLN p 24 8.989 -0.067 -0.034 1.00 0.00 N ATOM 379 CA GLN p 24 9.869 -0.342 1.099 1.00 0.00 C ATOM 380 C GLN p 24 10.103 -1.846 1.203 1.00 0.00 C ATOM 381 O GLN p 24 11.124 -2.296 1.698 1.00 0.00 O ATOM 382 CB GLN p 24 9.268 0.233 2.377 1.00 0.00 C ATOM 383 CG GLN p 24 9.569 -0.547 3.647 1.00 0.00 C ATOM 384 CD GLN p 24 10.389 0.239 4.651 1.00 0.00 C ATOM 385 OE1 GLN p 24 9.844 0.917 5.520 1.00 0.00 O ATOM 386 NE2 GLN p 24 11.710 0.150 4.536 1.00 0.00 N ATOM 0 H GLN p 24 7.999 -0.008 0.205 1.00 0.00 H new ATOM 0 HA GLN p 24 10.835 0.140 0.949 1.00 0.00 H new ATOM 0 HB2 GLN p 24 9.631 1.253 2.502 1.00 0.00 H new ATOM 0 HB3 GLN p 24 8.186 0.293 2.255 1.00 0.00 H new ATOM 0 HG2 GLN p 24 8.630 -0.849 4.111 1.00 0.00 H new ATOM 0 HG3 GLN p 24 10.104 -1.460 3.386 1.00 0.00 H new ATOM 0 HE21 GLN p 24 12.120 -0.424 3.800 1.00 0.00 H new ATOM 0 HE22 GLN p 24 12.314 0.656 5.184 1.00 0.00 H new ATOM 395 N LEU p 25 9.122 -2.574 0.688 1.00 0.00 N ATOM 396 CA LEU p 25 9.090 -4.023 0.619 1.00 0.00 C ATOM 397 C LEU p 25 10.116 -4.445 -0.406 1.00 0.00 C ATOM 398 O LEU p 25 10.897 -5.338 -0.173 1.00 0.00 O ATOM 399 CB LEU p 25 7.681 -4.459 0.189 1.00 0.00 C ATOM 400 CG LEU p 25 7.184 -5.826 0.666 1.00 0.00 C ATOM 401 CD1 LEU p 25 5.796 -6.054 0.110 1.00 0.00 C ATOM 402 CD2 LEU p 25 8.115 -6.944 0.229 1.00 0.00 C ATOM 0 H LEU p 25 8.287 -2.146 0.288 1.00 0.00 H new ATOM 0 HA LEU p 25 9.318 -4.483 1.581 1.00 0.00 H new ATOM 0 HB2 LEU p 25 6.975 -3.705 0.538 1.00 0.00 H new ATOM 0 HB3 LEU p 25 7.645 -4.450 -0.900 1.00 0.00 H new ATOM 0 HG LEU p 25 7.162 -5.833 1.756 1.00 0.00 H new ATOM 0 HD11 LEU p 25 5.427 -7.025 0.441 1.00 0.00 H new ATOM 0 HD12 LEU p 25 5.128 -5.270 0.467 1.00 0.00 H new ATOM 0 HD13 LEU p 25 5.832 -6.031 -0.979 1.00 0.00 H new ATOM 0 HD21 LEU p 25 7.729 -7.899 0.586 1.00 0.00 H new ATOM 0 HD22 LEU p 25 8.177 -6.962 -0.859 1.00 0.00 H new ATOM 0 HD23 LEU p 25 9.108 -6.775 0.646 1.00 0.00 H new ATOM 414 N GLU p 26 10.052 -3.749 -1.540 1.00 0.00 N ATOM 415 CA GLU p 26 10.976 -3.856 -2.666 1.00 0.00 C ATOM 416 C GLU p 26 12.299 -3.289 -2.212 1.00 0.00 C ATOM 417 O GLU p 26 13.363 -3.589 -2.727 1.00 0.00 O ATOM 418 CB GLU p 26 10.442 -3.049 -3.844 1.00 0.00 C ATOM 419 CG GLU p 26 8.990 -3.331 -4.151 1.00 0.00 C ATOM 420 CD GLU p 26 8.752 -3.721 -5.596 1.00 0.00 C ATOM 421 OE1 GLU p 26 8.514 -2.817 -6.424 1.00 0.00 O ATOM 422 OE2 GLU p 26 8.804 -4.931 -5.900 1.00 0.00 O ATOM 0 H GLU p 26 9.317 -3.061 -1.706 1.00 0.00 H new ATOM 0 HA GLU p 26 11.089 -4.893 -2.983 1.00 0.00 H new ATOM 0 HB2 GLU p 26 10.562 -1.987 -3.632 1.00 0.00 H new ATOM 0 HB3 GLU p 26 11.042 -3.267 -4.727 1.00 0.00 H new ATOM 0 HG2 GLU p 26 8.637 -4.132 -3.502 1.00 0.00 H new ATOM 0 HG3 GLU p 26 8.397 -2.447 -3.917 1.00 0.00 H new ATOM 429 N LYS p 27 12.183 -2.409 -1.237 1.00 0.00 N ATOM 430 CA LYS p 27 13.372 -1.843 -0.582 1.00 0.00 C ATOM 431 C LYS p 27 13.913 -2.909 0.359 1.00 0.00 C ATOM 432 O LYS p 27 15.091 -2.909 0.725 1.00 0.00 O ATOM 433 CB LYS p 27 13.089 -0.550 0.179 1.00 0.00 C ATOM 434 CG LYS p 27 13.383 0.720 -0.612 1.00 0.00 C ATOM 435 CD LYS p 27 14.834 1.160 -0.464 1.00 0.00 C ATOM 436 CE LYS p 27 15.112 2.436 -1.243 1.00 0.00 C ATOM 437 NZ LYS p 27 16.543 2.837 -1.159 1.00 0.00 N ATOM 0 H LYS p 27 11.293 -2.066 -0.876 1.00 0.00 H new ATOM 0 HA LYS p 27 14.099 -1.571 -1.347 1.00 0.00 H new ATOM 0 HB2 LYS p 27 12.042 -0.542 0.481 1.00 0.00 H new ATOM 0 HB3 LYS p 27 13.684 -0.542 1.092 1.00 0.00 H new ATOM 0 HG2 LYS p 27 13.161 0.551 -1.666 1.00 0.00 H new ATOM 0 HG3 LYS p 27 12.725 1.520 -0.272 1.00 0.00 H new ATOM 0 HD2 LYS p 27 15.061 1.319 0.590 1.00 0.00 H new ATOM 0 HD3 LYS p 27 15.494 0.367 -0.816 1.00 0.00 H new ATOM 0 HE2 LYS p 27 14.836 2.291 -2.288 1.00 0.00 H new ATOM 0 HE3 LYS p 27 14.486 3.241 -0.857 1.00 0.00 H new ATOM 0 HZ1 LYS p 27 16.691 3.711 -1.703 1.00 0.00 H new ATOM 0 HZ2 LYS p 27 16.800 3.000 -0.165 1.00 0.00 H new ATOM 0 HZ3 LYS p 27 17.139 2.080 -1.551 1.00 0.00 H new ATOM 451 N GLU p 28 12.997 -3.804 0.758 1.00 0.00 N ATOM 452 CA GLU p 28 13.349 -4.969 1.590 1.00 0.00 C ATOM 453 C GLU p 28 13.585 -6.171 0.693 1.00 0.00 C ATOM 454 O GLU p 28 14.499 -6.972 0.909 1.00 0.00 O ATOM 455 CB GLU p 28 12.241 -5.336 2.584 1.00 0.00 C ATOM 456 CG GLU p 28 11.774 -4.186 3.435 1.00 0.00 C ATOM 457 CD GLU p 28 12.123 -4.348 4.902 1.00 0.00 C ATOM 458 OE1 GLU p 28 13.221 -3.908 5.303 1.00 0.00 O ATOM 459 OE2 GLU p 28 11.298 -4.912 5.651 1.00 0.00 O ATOM 0 H GLU p 28 12.007 -3.745 0.519 1.00 0.00 H new ATOM 0 HA GLU p 28 14.244 -4.702 2.152 1.00 0.00 H new ATOM 0 HB2 GLU p 28 11.390 -5.735 2.032 1.00 0.00 H new ATOM 0 HB3 GLU p 28 12.601 -6.133 3.235 1.00 0.00 H new ATOM 0 HG2 GLU p 28 12.218 -3.263 3.062 1.00 0.00 H new ATOM 0 HG3 GLU p 28 10.694 -4.083 3.334 1.00 0.00 H new ATOM 466 N LEU p 29 12.720 -6.265 -0.314 1.00 0.00 N ATOM 467 CA LEU p 29 12.733 -7.351 -1.284 1.00 0.00 C ATOM 468 C LEU p 29 13.717 -7.150 -2.427 1.00 0.00 C ATOM 469 O LEU p 29 14.577 -8.004 -2.666 1.00 0.00 O ATOM 470 CB LEU p 29 11.331 -7.517 -1.876 1.00 0.00 C ATOM 471 CG LEU p 29 10.781 -8.935 -1.971 1.00 0.00 C ATOM 472 CD1 LEU p 29 9.404 -8.872 -2.588 1.00 0.00 C ATOM 473 CD2 LEU p 29 11.696 -9.822 -2.798 1.00 0.00 C ATOM 0 H LEU p 29 11.983 -5.580 -0.479 1.00 0.00 H new ATOM 0 HA LEU p 29 13.054 -8.239 -0.739 1.00 0.00 H new ATOM 0 HB2 LEU p 29 10.639 -6.925 -1.277 1.00 0.00 H new ATOM 0 HB3 LEU p 29 11.334 -7.087 -2.878 1.00 0.00 H new ATOM 0 HG LEU p 29 10.723 -9.370 -0.973 1.00 0.00 H new ATOM 0 HD11 LEU p 29 8.993 -9.879 -2.664 1.00 0.00 H new ATOM 0 HD12 LEU p 29 8.753 -8.261 -1.963 1.00 0.00 H new ATOM 0 HD13 LEU p 29 9.471 -8.431 -3.583 1.00 0.00 H new ATOM 0 HD21 LEU p 29 11.279 -10.828 -2.849 1.00 0.00 H new ATOM 0 HD22 LEU p 29 11.785 -9.415 -3.805 1.00 0.00 H new ATOM 0 HD23 LEU p 29 12.682 -9.861 -2.334 1.00 0.00 H new ATOM 485 N GLN p 30 13.586 -6.024 -3.122 1.00 0.00 N ATOM 486 CA GLN p 30 14.432 -5.743 -4.304 1.00 0.00 C ATOM 487 C GLN p 30 15.868 -5.346 -3.944 1.00 0.00 C ATOM 488 O GLN p 30 16.824 -5.814 -4.568 1.00 0.00 O ATOM 489 CB GLN p 30 13.728 -4.695 -5.196 1.00 0.00 C ATOM 490 CG GLN p 30 14.532 -3.444 -5.554 1.00 0.00 C ATOM 491 CD GLN p 30 15.327 -3.606 -6.836 1.00 0.00 C ATOM 492 OE1 GLN p 30 14.830 -3.324 -7.926 1.00 0.00 O ATOM 493 NE2 GLN p 30 16.570 -4.056 -6.710 1.00 0.00 N ATOM 0 H GLN p 30 12.913 -5.291 -2.900 1.00 0.00 H new ATOM 0 HA GLN p 30 14.543 -6.668 -4.869 1.00 0.00 H new ATOM 0 HB2 GLN p 30 13.429 -5.184 -6.123 1.00 0.00 H new ATOM 0 HB3 GLN p 30 12.814 -4.379 -4.693 1.00 0.00 H new ATOM 0 HG2 GLN p 30 13.853 -2.598 -5.657 1.00 0.00 H new ATOM 0 HG3 GLN p 30 15.213 -3.208 -4.736 1.00 0.00 H new ATOM 0 HE21 GLN p 30 16.941 -4.277 -5.786 1.00 0.00 H new ATOM 0 HE22 GLN p 30 17.154 -4.180 -7.537 1.00 0.00 H new ATOM 502 N ALA p 31 15.994 -4.489 -2.945 1.00 0.00 N ATOM 503 CA ALA p 31 17.303 -3.993 -2.479 1.00 0.00 C ATOM 504 C ALA p 31 18.187 -5.099 -1.879 1.00 0.00 C ATOM 505 O ALA p 31 19.417 -4.993 -1.906 1.00 0.00 O ATOM 506 CB ALA p 31 17.116 -2.867 -1.476 1.00 0.00 C ATOM 0 H ALA p 31 15.201 -4.111 -2.427 1.00 0.00 H new ATOM 0 HA ALA p 31 17.825 -3.616 -3.359 1.00 0.00 H new ATOM 0 HB1 ALA p 31 18.091 -2.512 -1.142 1.00 0.00 H new ATOM 0 HB2 ALA p 31 16.573 -2.047 -1.946 1.00 0.00 H new ATOM 0 HB3 ALA p 31 16.550 -3.233 -0.619 1.00 0.00 H new ATOM 512 N TRP p 32 17.552 -6.153 -1.346 1.00 0.00 N ATOM 513 CA TRP p 32 18.275 -7.286 -0.754 1.00 0.00 C ATOM 514 C TRP p 32 18.477 -8.408 -1.773 1.00 0.00 C ATOM 515 O TRP p 32 19.537 -9.039 -1.804 1.00 0.00 O ATOM 516 CB TRP p 32 17.522 -7.821 0.469 1.00 0.00 C ATOM 517 CG TRP p 32 17.706 -6.982 1.703 1.00 0.00 C ATOM 518 CD1 TRP p 32 17.042 -5.829 2.011 1.00 0.00 C ATOM 519 CD2 TRP p 32 18.609 -7.229 2.793 1.00 0.00 C ATOM 520 NE1 TRP p 32 17.473 -5.344 3.222 1.00 0.00 N ATOM 521 CE2 TRP p 32 18.433 -6.184 3.722 1.00 0.00 C ATOM 522 CE3 TRP p 32 19.547 -8.230 3.077 1.00 0.00 C ATOM 523 CZ2 TRP p 32 19.159 -6.112 4.909 1.00 0.00 C ATOM 524 CZ3 TRP p 32 20.265 -8.155 4.257 1.00 0.00 C ATOM 525 CH2 TRP p 32 20.068 -7.103 5.159 1.00 0.00 C ATOM 0 H TRP p 32 16.537 -6.244 -1.313 1.00 0.00 H new ATOM 0 HA TRP p 32 19.256 -6.927 -0.441 1.00 0.00 H new ATOM 0 HB2 TRP p 32 16.459 -7.879 0.234 1.00 0.00 H new ATOM 0 HB3 TRP p 32 17.858 -8.837 0.677 1.00 0.00 H new ATOM 0 HD1 TRP p 32 16.288 -5.366 1.392 1.00 0.00 H new ATOM 0 HE1 TRP p 32 17.133 -4.496 3.675 1.00 0.00 H new ATOM 0 HE3 TRP p 32 19.707 -9.045 2.387 1.00 0.00 H new ATOM 0 HZ2 TRP p 32 19.009 -5.302 5.607 1.00 0.00 H new ATOM 0 HZ3 TRP p 32 20.990 -8.922 4.486 1.00 0.00 H new ATOM 0 HH2 TRP p 32 20.646 -7.073 6.071 1.00 0.00 H new ATOM 536 N ASN p 33 17.445 -8.639 -2.614 1.00 0.00 N ATOM 537 CA ASN p 33 17.444 -9.678 -3.674 1.00 0.00 C ATOM 538 C ASN p 33 17.466 -11.104 -3.095 1.00 0.00 C ATOM 539 O ASN p 33 16.477 -11.834 -3.211 1.00 0.00 O ATOM 540 CB ASN p 33 18.603 -9.481 -4.680 1.00 0.00 C ATOM 541 CG ASN p 33 18.486 -8.187 -5.464 1.00 0.00 C ATOM 542 OD1 ASN p 33 19.039 -7.159 -5.072 1.00 0.00 O ATOM 543 ND2 ASN p 33 17.760 -8.233 -6.575 1.00 0.00 N ATOM 0 H ASN p 33 16.577 -8.104 -2.577 1.00 0.00 H new ATOM 0 HA ASN p 33 16.505 -9.556 -4.215 1.00 0.00 H new ATOM 0 HB2 ASN p 33 19.551 -9.490 -4.142 1.00 0.00 H new ATOM 0 HB3 ASN p 33 18.622 -10.321 -5.374 1.00 0.00 H new ATOM 0 HD21 ASN p 33 17.642 -7.394 -7.142 1.00 0.00 H new ATOM 0 HD22 ASN p 33 17.320 -9.108 -6.861 1.00 0.00 H new ATOM 550 N CYS p 34 18.597 -11.493 -2.477 1.00 0.00 N ATOM 551 CA CYS p 34 18.753 -12.827 -1.883 1.00 0.00 C ATOM 552 C CYS p 34 19.602 -12.768 -0.612 1.00 0.00 C ATOM 553 O CYS p 34 20.402 -11.845 -0.432 1.00 0.00 O ATOM 554 CB CYS p 34 19.396 -13.792 -2.889 1.00 0.00 C ATOM 555 SG CYS p 34 18.451 -14.005 -4.416 1.00 0.00 S ATOM 0 H CYS p 34 19.418 -10.896 -2.378 1.00 0.00 H new ATOM 0 HA CYS p 34 17.760 -13.191 -1.621 1.00 0.00 H new ATOM 0 HB2 CYS p 34 20.393 -13.428 -3.139 1.00 0.00 H new ATOM 0 HB3 CYS p 34 19.522 -14.765 -2.414 1.00 0.00 H new ATOM 0 HG CYS p 34 17.317 -13.377 -4.316 1.00 0.00 H new ATOM 561 N ILE p 35 19.416 -13.765 0.261 1.00 0.00 N ATOM 562 CA ILE p 35 20.161 -13.854 1.525 1.00 0.00 C ATOM 563 C ILE p 35 21.364 -14.794 1.395 1.00 0.00 C ATOM 564 O ILE p 35 21.376 -15.680 0.534 1.00 0.00 O ATOM 565 CB ILE p 35 19.263 -14.305 2.721 1.00 0.00 C ATOM 566 CG1 ILE p 35 18.325 -15.477 2.356 1.00 0.00 C ATOM 567 CG2 ILE p 35 18.450 -13.127 3.236 1.00 0.00 C ATOM 568 CD1 ILE p 35 18.939 -16.847 2.574 1.00 0.00 C ATOM 0 H ILE p 35 18.753 -14.526 0.115 1.00 0.00 H new ATOM 0 HA ILE p 35 20.516 -12.846 1.740 1.00 0.00 H new ATOM 0 HB ILE p 35 19.932 -14.664 3.503 1.00 0.00 H new ATOM 0 HG12 ILE p 35 17.414 -15.399 2.950 1.00 0.00 H new ATOM 0 HG13 ILE p 35 18.032 -15.383 1.310 1.00 0.00 H new ATOM 0 HG21 ILE p 35 17.827 -13.451 4.070 1.00 0.00 H new ATOM 0 HG22 ILE p 35 19.124 -12.339 3.572 1.00 0.00 H new ATOM 0 HG23 ILE p 35 17.815 -12.745 2.436 1.00 0.00 H new ATOM 0 HD11 ILE p 35 18.219 -17.617 2.295 1.00 0.00 H new ATOM 0 HD12 ILE p 35 19.834 -16.947 1.959 1.00 0.00 H new ATOM 0 HD13 ILE p 35 19.206 -16.963 3.624 1.00 0.00 H new ATOM 580 N CYS p 36 22.366 -14.590 2.257 1.00 0.00 N ATOM 581 CA CYS p 36 23.581 -15.407 2.243 1.00 0.00 C ATOM 582 C CYS p 36 23.728 -16.220 3.533 1.00 0.00 C ATOM 583 O CYS p 36 24.048 -17.411 3.481 1.00 0.00 O ATOM 584 CB CYS p 36 24.813 -14.517 2.034 1.00 0.00 C ATOM 585 SG CYS p 36 26.361 -15.428 1.824 1.00 0.00 S ATOM 0 H CYS p 36 22.358 -13.864 2.974 1.00 0.00 H new ATOM 0 HA CYS p 36 23.501 -16.111 1.414 1.00 0.00 H new ATOM 0 HB2 CYS p 36 24.651 -13.892 1.156 1.00 0.00 H new ATOM 0 HB3 CYS p 36 24.912 -13.847 2.888 1.00 0.00 H new ATOM 0 HG CYS p 36 27.339 -14.589 1.653 1.00 0.00 H new ATOM 591 N ASP p 37 23.492 -15.571 4.681 1.00 0.00 N ATOM 592 CA ASP p 37 23.605 -16.230 5.984 1.00 0.00 C ATOM 593 C ASP p 37 22.235 -16.412 6.633 1.00 0.00 C ATOM 594 O ASP p 37 21.493 -15.444 6.823 1.00 0.00 O ATOM 595 CB ASP p 37 24.523 -15.427 6.915 1.00 0.00 C ATOM 596 CG ASP p 37 25.979 -15.488 6.497 1.00 0.00 C ATOM 597 OD1 ASP p 37 26.692 -16.403 6.960 1.00 0.00 O ATOM 598 OD2 ASP p 37 26.407 -14.621 5.706 1.00 0.00 O ATOM 0 H ASP p 37 23.221 -14.589 4.731 1.00 0.00 H new ATOM 0 HA ASP p 37 24.039 -17.216 5.820 1.00 0.00 H new ATOM 0 HB2 ASP p 37 24.197 -14.387 6.931 1.00 0.00 H new ATOM 0 HB3 ASP p 37 24.425 -15.807 7.932 1.00 0.00 H new ATOM 603 N ILE p 38 21.912 -17.669 6.961 1.00 0.00 N ATOM 604 CA ILE p 38 20.637 -18.016 7.598 1.00 0.00 C ATOM 605 C ILE p 38 20.823 -19.209 8.555 1.00 0.00 C ATOM 606 O ILE p 38 21.355 -20.252 8.163 1.00 0.00 O ATOM 607 CB ILE p 38 19.511 -18.294 6.529 1.00 0.00 C ATOM 608 CG1 ILE p 38 18.125 -18.449 7.187 1.00 0.00 C ATOM 609 CG2 ILE p 38 19.819 -19.511 5.653 1.00 0.00 C ATOM 610 CD1 ILE p 38 17.409 -17.134 7.430 1.00 0.00 C ATOM 0 H ILE p 38 22.523 -18.469 6.794 1.00 0.00 H new ATOM 0 HA ILE p 38 20.306 -17.160 8.186 1.00 0.00 H new ATOM 0 HB ILE p 38 19.491 -17.418 5.881 1.00 0.00 H new ATOM 0 HG12 ILE p 38 17.501 -19.079 6.553 1.00 0.00 H new ATOM 0 HG13 ILE p 38 18.241 -18.969 8.138 1.00 0.00 H new ATOM 0 HG21 ILE p 38 19.012 -19.656 4.935 1.00 0.00 H new ATOM 0 HG22 ILE p 38 20.755 -19.347 5.118 1.00 0.00 H new ATOM 0 HG23 ILE p 38 19.910 -20.397 6.281 1.00 0.00 H new ATOM 0 HD11 ILE p 38 16.442 -17.327 7.895 1.00 0.00 H new ATOM 0 HD12 ILE p 38 18.011 -16.509 8.090 1.00 0.00 H new ATOM 0 HD13 ILE p 38 17.259 -16.620 6.480 1.00 0.00 H new ATOM 622 N GLU p 39 20.387 -19.029 9.806 1.00 0.00 N ATOM 623 CA GLU p 39 20.495 -20.074 10.829 1.00 0.00 C ATOM 624 C GLU p 39 19.149 -20.317 11.517 1.00 0.00 C ATOM 625 O GLU p 39 18.752 -21.468 11.718 1.00 0.00 O ATOM 626 CB GLU p 39 21.558 -19.702 11.873 1.00 0.00 C ATOM 627 CG GLU p 39 22.977 -19.668 11.326 1.00 0.00 C ATOM 628 CD GLU p 39 24.024 -19.574 12.419 1.00 0.00 C ATOM 629 OE1 GLU p 39 24.377 -18.441 12.807 1.00 0.00 O ATOM 630 OE2 GLU p 39 24.490 -20.634 12.886 1.00 0.00 O ATOM 0 H GLU p 39 19.954 -18.166 10.135 1.00 0.00 H new ATOM 0 HA GLU p 39 20.796 -20.995 10.330 1.00 0.00 H new ATOM 0 HB2 GLU p 39 21.317 -18.724 12.290 1.00 0.00 H new ATOM 0 HB3 GLU p 39 21.513 -20.418 12.694 1.00 0.00 H new ATOM 0 HG2 GLU p 39 23.155 -20.566 10.734 1.00 0.00 H new ATOM 0 HG3 GLU p 39 23.082 -18.817 10.654 1.00 0.00 H new ATOM 637 N ASN p 40 18.457 -19.226 11.872 1.00 0.00 N ATOM 638 CA ASN p 40 17.155 -19.308 12.538 1.00 0.00 C ATOM 639 C ASN p 40 16.078 -18.617 11.710 1.00 0.00 C ATOM 640 O ASN p 40 16.317 -17.552 11.132 1.00 0.00 O ATOM 641 CB ASN p 40 17.223 -18.678 13.933 1.00 0.00 C ATOM 642 CG ASN p 40 18.043 -19.505 14.908 1.00 0.00 C ATOM 643 OD1 ASN p 40 17.514 -20.376 15.597 1.00 0.00 O ATOM 644 ND2 ASN p 40 19.341 -19.233 14.969 1.00 0.00 N ATOM 0 H ASN p 40 18.781 -18.273 11.707 1.00 0.00 H new ATOM 0 HA ASN p 40 16.896 -20.362 12.638 1.00 0.00 H new ATOM 0 HB2 ASN p 40 17.655 -17.680 13.856 1.00 0.00 H new ATOM 0 HB3 ASN p 40 16.212 -18.559 14.324 1.00 0.00 H new ATOM 0 HD21 ASN p 40 19.942 -19.755 15.606 1.00 0.00 H new ATOM 0 HD22 ASN p 40 19.737 -18.502 14.379 1.00 0.00 H new ATOM 651 N CYS p 41 14.893 -19.235 11.662 1.00 0.00 N ATOM 652 CA CYS p 41 13.761 -18.695 10.908 1.00 0.00 C ATOM 653 C CYS p 41 12.507 -18.636 11.775 1.00 0.00 C ATOM 654 O CYS p 41 12.134 -19.629 12.408 1.00 0.00 O ATOM 655 CB CYS p 41 13.496 -19.546 9.663 1.00 0.00 C ATOM 656 SG CYS p 41 14.890 -19.629 8.515 1.00 0.00 S ATOM 0 H CYS p 41 14.694 -20.114 12.140 1.00 0.00 H new ATOM 0 HA CYS p 41 14.014 -17.681 10.599 1.00 0.00 H new ATOM 0 HB2 CYS p 41 13.236 -20.557 9.976 1.00 0.00 H new ATOM 0 HB3 CYS p 41 12.630 -19.143 9.138 1.00 0.00 H new ATOM 0 HG CYS p 41 14.570 -20.372 7.497 1.00 0.00 H new ATOM 662 N SER p 42 11.869 -17.463 11.795 1.00 0.00 N ATOM 663 CA SER p 42 10.650 -17.247 12.576 1.00 0.00 C ATOM 664 C SER p 42 9.417 -17.269 11.675 1.00 0.00 C ATOM 665 O SER p 42 9.512 -16.987 10.476 1.00 0.00 O ATOM 666 CB SER p 42 10.730 -15.913 13.322 1.00 0.00 C ATOM 667 OG SER p 42 11.834 -15.890 14.210 1.00 0.00 O ATOM 0 H SER p 42 12.180 -16.643 11.275 1.00 0.00 H new ATOM 0 HA SER p 42 10.561 -18.056 13.301 1.00 0.00 H new ATOM 0 HB2 SER p 42 10.819 -15.097 12.605 1.00 0.00 H new ATOM 0 HB3 SER p 42 9.808 -15.749 13.879 1.00 0.00 H new ATOM 0 HG SER p 42 11.864 -15.027 14.673 1.00 0.00 H new ATOM 673 N ASN p 43 8.264 -17.609 12.264 1.00 0.00 N ATOM 674 CA ASN p 43 7.002 -17.672 11.525 1.00 0.00 C ATOM 675 C ASN p 43 6.172 -16.406 11.748 1.00 0.00 C ATOM 676 O ASN p 43 5.623 -16.188 12.835 1.00 0.00 O ATOM 677 CB ASN p 43 6.201 -18.918 11.931 1.00 0.00 C ATOM 678 CG ASN p 43 6.838 -20.207 11.445 1.00 0.00 C ATOM 679 OD1 ASN p 43 7.655 -20.810 12.139 1.00 0.00 O ATOM 680 ND2 ASN p 43 6.463 -20.635 10.244 1.00 0.00 N ATOM 0 H ASN p 43 8.181 -17.845 13.253 1.00 0.00 H new ATOM 0 HA ASN p 43 7.236 -17.741 10.463 1.00 0.00 H new ATOM 0 HB2 ASN p 43 6.110 -18.949 13.017 1.00 0.00 H new ATOM 0 HB3 ASN p 43 5.191 -18.843 11.529 1.00 0.00 H new ATOM 0 HD21 ASN p 43 6.856 -21.496 9.864 1.00 0.00 H new ATOM 0 HD22 ASN p 43 5.782 -20.103 9.703 1.00 0.00 H new ATOM 687 N MET p 44 6.107 -15.568 10.707 1.00 0.00 N ATOM 688 CA MET p 44 5.349 -14.308 10.748 1.00 0.00 C ATOM 689 C MET p 44 4.669 -14.028 9.402 1.00 0.00 C ATOM 690 O MET p 44 3.525 -13.566 9.361 1.00 0.00 O ATOM 691 CB MET p 44 6.249 -13.113 11.158 1.00 0.00 C ATOM 692 CG MET p 44 7.536 -12.945 10.345 1.00 0.00 C ATOM 693 SD MET p 44 8.784 -14.184 10.747 1.00 0.00 S ATOM 694 CE MET p 44 10.116 -13.687 9.658 1.00 0.00 C ATOM 0 H MET p 44 6.574 -15.741 9.817 1.00 0.00 H new ATOM 0 HA MET p 44 4.576 -14.422 11.508 1.00 0.00 H new ATOM 0 HB2 MET p 44 5.665 -12.196 11.074 1.00 0.00 H new ATOM 0 HB3 MET p 44 6.516 -13.226 12.209 1.00 0.00 H new ATOM 0 HG2 MET p 44 7.300 -13.005 9.283 1.00 0.00 H new ATOM 0 HG3 MET p 44 7.946 -11.951 10.524 1.00 0.00 H new ATOM 0 HE1 MET p 44 10.964 -14.359 9.790 1.00 0.00 H new ATOM 0 HE2 MET p 44 9.776 -13.731 8.623 1.00 0.00 H new ATOM 0 HE3 MET p 44 10.420 -12.668 9.897 1.00 0.00 H new ATOM 704 N ALA p 45 5.391 -14.315 8.311 1.00 0.00 N ATOM 705 CA ALA p 45 4.887 -14.106 6.951 1.00 0.00 C ATOM 706 C ALA p 45 4.157 -15.359 6.426 1.00 0.00 C ATOM 707 O ALA p 45 4.376 -16.453 6.956 1.00 0.00 O ATOM 708 CB ALA p 45 6.043 -13.734 6.030 1.00 0.00 C ATOM 0 H ALA p 45 6.336 -14.697 8.347 1.00 0.00 H new ATOM 0 HA ALA p 45 4.165 -13.290 6.970 1.00 0.00 H new ATOM 0 HB1 ALA p 45 5.667 -13.579 5.019 1.00 0.00 H new ATOM 0 HB2 ALA p 45 6.512 -12.817 6.387 1.00 0.00 H new ATOM 0 HB3 ALA p 45 6.777 -14.539 6.024 1.00 0.00 H new ATOM 714 N PRO p 46 3.274 -15.237 5.373 1.00 0.00 N ATOM 715 CA PRO p 46 2.534 -16.397 4.810 1.00 0.00 C ATOM 716 C PRO p 46 3.457 -17.513 4.301 1.00 0.00 C ATOM 717 O PRO p 46 4.673 -17.324 4.204 1.00 0.00 O ATOM 718 CB PRO p 46 1.742 -15.787 3.644 1.00 0.00 C ATOM 719 CG PRO p 46 1.629 -14.341 3.966 1.00 0.00 C ATOM 720 CD PRO p 46 2.908 -13.982 4.662 1.00 0.00 C ATOM 0 HA PRO p 46 1.914 -16.876 5.567 1.00 0.00 H new ATOM 0 HB2 PRO p 46 2.256 -15.940 2.695 1.00 0.00 H new ATOM 0 HB3 PRO p 46 0.759 -16.248 3.552 1.00 0.00 H new ATOM 0 HG2 PRO p 46 1.495 -13.747 3.062 1.00 0.00 H new ATOM 0 HG3 PRO p 46 0.767 -14.148 4.605 1.00 0.00 H new ATOM 0 HD2 PRO p 46 3.680 -13.681 3.954 1.00 0.00 H new ATOM 0 HD3 PRO p 46 2.770 -13.152 5.355 1.00 0.00 H new ATOM 728 N LEU p 47 2.862 -18.672 3.978 1.00 0.00 N ATOM 729 CA LEU p 47 3.614 -19.835 3.486 1.00 0.00 C ATOM 730 C LEU p 47 3.859 -19.770 1.975 1.00 0.00 C ATOM 731 O LEU p 47 4.650 -20.550 1.433 1.00 0.00 O ATOM 732 CB LEU p 47 2.863 -21.127 3.828 1.00 0.00 C ATOM 733 CG LEU p 47 2.824 -21.500 5.316 1.00 0.00 C ATOM 734 CD1 LEU p 47 1.587 -22.330 5.622 1.00 0.00 C ATOM 735 CD2 LEU p 47 4.082 -22.262 5.718 1.00 0.00 C ATOM 0 H LEU p 47 1.857 -18.828 4.050 1.00 0.00 H new ATOM 0 HA LEU p 47 4.585 -19.825 3.980 1.00 0.00 H new ATOM 0 HB2 LEU p 47 1.838 -21.036 3.468 1.00 0.00 H new ATOM 0 HB3 LEU p 47 3.322 -21.949 3.278 1.00 0.00 H new ATOM 0 HG LEU p 47 2.781 -20.578 5.896 1.00 0.00 H new ATOM 0 HD11 LEU p 47 1.574 -22.587 6.681 1.00 0.00 H new ATOM 0 HD12 LEU p 47 0.694 -21.756 5.377 1.00 0.00 H new ATOM 0 HD13 LEU p 47 1.606 -23.244 5.028 1.00 0.00 H new ATOM 0 HD21 LEU p 47 4.031 -22.515 6.777 1.00 0.00 H new ATOM 0 HD22 LEU p 47 4.157 -23.176 5.129 1.00 0.00 H new ATOM 0 HD23 LEU p 47 4.958 -21.640 5.536 1.00 0.00 H new ATOM 747 N TYR p 48 3.181 -18.832 1.314 1.00 0.00 N ATOM 748 CA TYR p 48 3.301 -18.644 -0.137 1.00 0.00 C ATOM 749 C TYR p 48 4.415 -17.645 -0.466 1.00 0.00 C ATOM 750 O TYR p 48 5.327 -17.963 -1.234 1.00 0.00 O ATOM 751 CB TYR p 48 1.961 -18.172 -0.734 1.00 0.00 C ATOM 752 CG TYR p 48 0.791 -19.086 -0.425 1.00 0.00 C ATOM 753 CD1 TYR p 48 0.112 -18.990 0.785 1.00 0.00 C ATOM 754 CD2 TYR p 48 0.369 -20.043 -1.338 1.00 0.00 C ATOM 755 CE1 TYR p 48 -0.951 -19.820 1.076 1.00 0.00 C ATOM 756 CE2 TYR p 48 -0.696 -20.879 -1.055 1.00 0.00 C ATOM 757 CZ TYR p 48 -1.352 -20.764 0.153 1.00 0.00 C ATOM 758 OH TYR p 48 -2.412 -21.594 0.439 1.00 0.00 O ATOM 0 H TYR p 48 2.536 -18.183 1.764 1.00 0.00 H new ATOM 0 HA TYR p 48 3.560 -19.604 -0.584 1.00 0.00 H new ATOM 0 HB2 TYR p 48 1.738 -17.174 -0.356 1.00 0.00 H new ATOM 0 HB3 TYR p 48 2.067 -18.087 -1.816 1.00 0.00 H new ATOM 0 HD1 TYR p 48 0.423 -18.252 1.510 1.00 0.00 H new ATOM 0 HD2 TYR p 48 0.881 -20.136 -2.285 1.00 0.00 H new ATOM 0 HE1 TYR p 48 -1.466 -19.731 2.021 1.00 0.00 H new ATOM 0 HE2 TYR p 48 -1.012 -21.618 -1.776 1.00 0.00 H new ATOM 0 HH TYR p 48 -2.566 -22.200 -0.316 1.00 0.00 H new ATOM 768 N SER p 49 4.330 -16.432 0.134 1.00 0.00 N ATOM 769 CA SER p 49 5.318 -15.332 -0.048 1.00 0.00 C ATOM 770 C SER p 49 5.309 -14.731 -1.465 1.00 0.00 C ATOM 771 O SER p 49 5.541 -13.532 -1.627 1.00 0.00 O ATOM 772 CB SER p 49 6.743 -15.781 0.315 1.00 0.00 C ATOM 773 OG SER p 49 6.818 -16.198 1.669 1.00 0.00 O ATOM 0 H SER p 49 3.567 -16.184 0.765 1.00 0.00 H new ATOM 0 HA SER p 49 5.002 -14.548 0.641 1.00 0.00 H new ATOM 0 HB2 SER p 49 7.047 -16.599 -0.338 1.00 0.00 H new ATOM 0 HB3 SER p 49 7.440 -14.961 0.145 1.00 0.00 H new ATOM 0 HG SER p 49 7.734 -16.480 1.874 1.00 0.00 H new ATOM 779 N ASP p 50 5.059 -15.571 -2.474 1.00 0.00 N ATOM 780 CA ASP p 50 5.032 -15.133 -3.875 1.00 0.00 C ATOM 781 C ASP p 50 3.601 -14.877 -4.351 1.00 0.00 C ATOM 782 O ASP p 50 3.326 -13.865 -5.002 1.00 0.00 O ATOM 783 CB ASP p 50 5.710 -16.172 -4.777 1.00 0.00 C ATOM 784 CG ASP p 50 7.213 -16.229 -4.575 1.00 0.00 C ATOM 785 OD1 ASP p 50 7.933 -15.480 -5.268 1.00 0.00 O ATOM 786 OD2 ASP p 50 7.669 -17.020 -3.723 1.00 0.00 O ATOM 0 H ASP p 50 4.871 -16.565 -2.346 1.00 0.00 H new ATOM 0 HA ASP p 50 5.583 -14.195 -3.939 1.00 0.00 H new ATOM 0 HB2 ASP p 50 5.283 -17.155 -4.577 1.00 0.00 H new ATOM 0 HB3 ASP p 50 5.496 -15.937 -5.820 1.00 0.00 H new ATOM 791 N GLN p 51 2.700 -15.810 -4.016 1.00 0.00 N ATOM 792 CA GLN p 51 1.286 -15.728 -4.395 1.00 0.00 C ATOM 793 C GLN p 51 0.465 -14.958 -3.348 1.00 0.00 C ATOM 794 O GLN p 51 -0.714 -14.675 -3.567 1.00 0.00 O ATOM 795 CB GLN p 51 0.716 -17.141 -4.583 1.00 0.00 C ATOM 796 CG GLN p 51 -0.399 -17.226 -5.618 1.00 0.00 C ATOM 797 CD GLN p 51 -0.948 -18.632 -5.767 1.00 0.00 C ATOM 798 OE1 GLN p 51 -0.464 -19.416 -6.583 1.00 0.00 O ATOM 799 NE2 GLN p 51 -1.964 -18.957 -4.976 1.00 0.00 N ATOM 0 H GLN p 51 2.932 -16.643 -3.474 1.00 0.00 H new ATOM 0 HA GLN p 51 1.218 -15.181 -5.335 1.00 0.00 H new ATOM 0 HB2 GLN p 51 1.523 -17.811 -4.878 1.00 0.00 H new ATOM 0 HB3 GLN p 51 0.338 -17.500 -3.626 1.00 0.00 H new ATOM 0 HG2 GLN p 51 -1.207 -16.552 -5.333 1.00 0.00 H new ATOM 0 HG3 GLN p 51 -0.023 -16.882 -6.582 1.00 0.00 H new ATOM 0 HE21 GLN p 51 -2.333 -18.275 -4.314 1.00 0.00 H new ATOM 0 HE22 GLN p 51 -2.375 -19.889 -5.031 1.00 0.00 H new ATOM 808 N ALA p 52 1.093 -14.651 -2.208 1.00 0.00 N ATOM 809 CA ALA p 52 0.435 -13.933 -1.113 1.00 0.00 C ATOM 810 C ALA p 52 0.906 -12.474 -0.992 1.00 0.00 C ATOM 811 O ALA p 52 0.357 -11.709 -0.202 1.00 0.00 O ATOM 812 CB ALA p 52 0.693 -14.677 0.188 1.00 0.00 C ATOM 0 H ALA p 52 2.066 -14.892 -2.020 1.00 0.00 H new ATOM 0 HA ALA p 52 -0.633 -13.898 -1.329 1.00 0.00 H new ATOM 0 HB1 ALA p 52 0.208 -14.151 1.010 1.00 0.00 H new ATOM 0 HB2 ALA p 52 0.290 -15.687 0.115 1.00 0.00 H new ATOM 0 HB3 ALA p 52 1.766 -14.726 0.372 1.00 0.00 H new ATOM 818 N LEU p 53 1.940 -12.115 -1.753 1.00 0.00 N ATOM 819 CA LEU p 53 2.522 -10.788 -1.748 1.00 0.00 C ATOM 820 C LEU p 53 1.958 -9.951 -2.886 1.00 0.00 C ATOM 821 O LEU p 53 1.186 -9.022 -2.673 1.00 0.00 O ATOM 822 CB LEU p 53 4.037 -10.936 -1.866 1.00 0.00 C ATOM 823 CG LEU p 53 4.873 -9.789 -1.334 1.00 0.00 C ATOM 824 CD1 LEU p 53 6.199 -10.334 -0.861 1.00 0.00 C ATOM 825 CD2 LEU p 53 5.076 -8.750 -2.422 1.00 0.00 C ATOM 0 H LEU p 53 2.400 -12.756 -2.400 1.00 0.00 H new ATOM 0 HA LEU p 53 2.276 -10.271 -0.821 1.00 0.00 H new ATOM 0 HB2 LEU p 53 4.333 -11.845 -1.342 1.00 0.00 H new ATOM 0 HB3 LEU p 53 4.285 -11.079 -2.918 1.00 0.00 H new ATOM 0 HG LEU p 53 4.363 -9.309 -0.499 1.00 0.00 H new ATOM 0 HD11 LEU p 53 6.811 -9.519 -0.475 1.00 0.00 H new ATOM 0 HD12 LEU p 53 6.031 -11.066 -0.071 1.00 0.00 H new ATOM 0 HD13 LEU p 53 6.714 -10.811 -1.694 1.00 0.00 H new ATOM 0 HD21 LEU p 53 5.678 -7.929 -2.033 1.00 0.00 H new ATOM 0 HD22 LEU p 53 5.589 -9.206 -3.269 1.00 0.00 H new ATOM 0 HD23 LEU p 53 4.108 -8.369 -2.746 1.00 0.00 H new ATOM 837 N LYS p 54 2.343 -10.346 -4.104 1.00 0.00 N ATOM 838 CA LYS p 54 1.918 -9.691 -5.359 1.00 0.00 C ATOM 839 C LYS p 54 0.397 -9.738 -5.546 1.00 0.00 C ATOM 840 O LYS p 54 -0.150 -9.055 -6.408 1.00 0.00 O ATOM 841 CB LYS p 54 2.606 -10.352 -6.558 1.00 0.00 C ATOM 842 CG LYS p 54 4.083 -10.009 -6.685 1.00 0.00 C ATOM 843 CD LYS p 54 4.715 -10.693 -7.886 1.00 0.00 C ATOM 844 CE LYS p 54 6.200 -10.382 -7.986 1.00 0.00 C ATOM 845 NZ LYS p 54 6.833 -11.060 -9.149 1.00 0.00 N ATOM 0 H LYS p 54 2.966 -11.139 -4.255 1.00 0.00 H new ATOM 0 HA LYS p 54 2.214 -8.644 -5.295 1.00 0.00 H new ATOM 0 HB2 LYS p 54 2.500 -11.434 -6.475 1.00 0.00 H new ATOM 0 HB3 LYS p 54 2.093 -10.050 -7.471 1.00 0.00 H new ATOM 0 HG2 LYS p 54 4.200 -8.929 -6.777 1.00 0.00 H new ATOM 0 HG3 LYS p 54 4.606 -10.310 -5.777 1.00 0.00 H new ATOM 0 HD2 LYS p 54 4.572 -11.771 -7.809 1.00 0.00 H new ATOM 0 HD3 LYS p 54 4.212 -10.369 -8.797 1.00 0.00 H new ATOM 0 HE2 LYS p 54 6.340 -9.305 -8.074 1.00 0.00 H new ATOM 0 HE3 LYS p 54 6.699 -10.694 -7.068 1.00 0.00 H new ATOM 0 HZ1 LYS p 54 7.845 -10.822 -9.181 1.00 0.00 H new ATOM 0 HZ2 LYS p 54 6.722 -12.090 -9.053 1.00 0.00 H new ATOM 0 HZ3 LYS p 54 6.375 -10.743 -10.027 1.00 0.00 H new ATOM 859 N LYS p 55 -0.248 -10.569 -4.727 1.00 0.00 N ATOM 860 CA LYS p 55 -1.683 -10.757 -4.713 1.00 0.00 C ATOM 861 C LYS p 55 -2.297 -9.879 -3.645 1.00 0.00 C ATOM 862 O LYS p 55 -3.346 -9.273 -3.858 1.00 0.00 O ATOM 863 CB LYS p 55 -2.020 -12.224 -4.466 1.00 0.00 C ATOM 864 CG LYS p 55 -2.189 -13.047 -5.738 1.00 0.00 C ATOM 865 CD LYS p 55 -3.617 -12.997 -6.262 1.00 0.00 C ATOM 866 CE LYS p 55 -3.765 -13.789 -7.552 1.00 0.00 C ATOM 867 NZ LYS p 55 -5.162 -13.761 -8.066 1.00 0.00 N ATOM 0 H LYS p 55 0.236 -11.143 -4.037 1.00 0.00 H new ATOM 0 HA LYS p 55 -2.095 -10.473 -5.682 1.00 0.00 H new ATOM 0 HB2 LYS p 55 -1.231 -12.670 -3.860 1.00 0.00 H new ATOM 0 HB3 LYS p 55 -2.940 -12.281 -3.884 1.00 0.00 H new ATOM 0 HG2 LYS p 55 -1.508 -12.675 -6.504 1.00 0.00 H new ATOM 0 HG3 LYS p 55 -1.911 -14.082 -5.540 1.00 0.00 H new ATOM 0 HD2 LYS p 55 -4.296 -13.396 -5.509 1.00 0.00 H new ATOM 0 HD3 LYS p 55 -3.906 -11.960 -6.435 1.00 0.00 H new ATOM 0 HE2 LYS p 55 -3.093 -13.381 -8.307 1.00 0.00 H new ATOM 0 HE3 LYS p 55 -3.462 -14.822 -7.380 1.00 0.00 H new ATOM 0 HZ1 LYS p 55 -5.219 -14.312 -8.946 1.00 0.00 H new ATOM 0 HZ2 LYS p 55 -5.801 -14.173 -7.357 1.00 0.00 H new ATOM 0 HZ3 LYS p 55 -5.443 -12.778 -8.255 1.00 0.00 H new ATOM 881 N LYS p 56 -1.619 -9.824 -2.484 1.00 0.00 N ATOM 882 CA LYS p 56 -2.065 -8.966 -1.359 1.00 0.00 C ATOM 883 C LYS p 56 -1.733 -7.498 -1.658 1.00 0.00 C ATOM 884 O LYS p 56 -2.198 -6.578 -0.984 1.00 0.00 O ATOM 885 CB LYS p 56 -1.420 -9.390 -0.044 1.00 0.00 C ATOM 886 CG LYS p 56 -2.193 -10.480 0.680 1.00 0.00 C ATOM 887 CD LYS p 56 -1.588 -10.782 2.041 1.00 0.00 C ATOM 888 CE LYS p 56 -2.359 -11.875 2.762 1.00 0.00 C ATOM 889 NZ LYS p 56 -1.781 -12.170 4.103 1.00 0.00 N ATOM 0 H LYS p 56 -0.769 -10.355 -2.296 1.00 0.00 H new ATOM 0 HA LYS p 56 -3.144 -9.081 -1.255 1.00 0.00 H new ATOM 0 HB2 LYS p 56 -0.407 -9.742 -0.241 1.00 0.00 H new ATOM 0 HB3 LYS p 56 -1.334 -8.521 0.608 1.00 0.00 H new ATOM 0 HG2 LYS p 56 -3.231 -10.171 0.803 1.00 0.00 H new ATOM 0 HG3 LYS p 56 -2.200 -11.386 0.074 1.00 0.00 H new ATOM 0 HD2 LYS p 56 -0.549 -11.088 1.919 1.00 0.00 H new ATOM 0 HD3 LYS p 56 -1.584 -9.877 2.648 1.00 0.00 H new ATOM 0 HE2 LYS p 56 -3.400 -11.572 2.874 1.00 0.00 H new ATOM 0 HE3 LYS p 56 -2.355 -12.782 2.157 1.00 0.00 H new ATOM 0 HZ1 LYS p 56 -2.335 -12.921 4.562 1.00 0.00 H new ATOM 0 HZ2 LYS p 56 -0.795 -12.484 3.995 1.00 0.00 H new ATOM 0 HZ3 LYS p 56 -1.808 -11.311 4.689 1.00 0.00 H new ATOM 903 N LEU p 57 -0.906 -7.341 -2.691 1.00 0.00 N ATOM 904 CA LEU p 57 -0.449 -6.076 -3.230 1.00 0.00 C ATOM 905 C LEU p 57 -1.387 -5.717 -4.343 1.00 0.00 C ATOM 906 O LEU p 57 -1.814 -4.577 -4.483 1.00 0.00 O ATOM 907 CB LEU p 57 0.959 -6.225 -3.790 1.00 0.00 C ATOM 908 CG LEU p 57 2.111 -5.705 -2.937 1.00 0.00 C ATOM 909 CD1 LEU p 57 2.218 -6.463 -1.620 1.00 0.00 C ATOM 910 CD2 LEU p 57 3.382 -5.844 -3.740 1.00 0.00 C ATOM 0 H LEU p 57 -0.521 -8.139 -3.196 1.00 0.00 H new ATOM 0 HA LEU p 57 -0.432 -5.309 -2.456 1.00 0.00 H new ATOM 0 HB2 LEU p 57 1.134 -7.283 -3.984 1.00 0.00 H new ATOM 0 HB3 LEU p 57 0.995 -5.714 -4.752 1.00 0.00 H new ATOM 0 HG LEU p 57 1.935 -4.660 -2.682 1.00 0.00 H new ATOM 0 HD11 LEU p 57 3.050 -6.066 -1.038 1.00 0.00 H new ATOM 0 HD12 LEU p 57 1.292 -6.346 -1.057 1.00 0.00 H new ATOM 0 HD13 LEU p 57 2.389 -7.520 -1.822 1.00 0.00 H new ATOM 0 HD21 LEU p 57 4.225 -5.479 -3.153 1.00 0.00 H new ATOM 0 HD22 LEU p 57 3.541 -6.893 -3.990 1.00 0.00 H new ATOM 0 HD23 LEU p 57 3.299 -5.261 -4.657 1.00 0.00 H new ATOM 922 N ALA p 58 -1.670 -6.750 -5.151 1.00 0.00 N ATOM 923 CA ALA p 58 -2.637 -6.642 -6.267 1.00 0.00 C ATOM 924 C ALA p 58 -4.042 -6.381 -5.719 1.00 0.00 C ATOM 925 O ALA p 58 -4.932 -5.908 -6.432 1.00 0.00 O ATOM 926 CB ALA p 58 -2.635 -7.893 -7.130 1.00 0.00 C ATOM 0 H ALA p 58 -1.245 -7.673 -5.057 1.00 0.00 H new ATOM 0 HA ALA p 58 -2.333 -5.805 -6.895 1.00 0.00 H new ATOM 0 HB1 ALA p 58 -3.357 -7.778 -7.939 1.00 0.00 H new ATOM 0 HB2 ALA p 58 -1.640 -8.044 -7.550 1.00 0.00 H new ATOM 0 HB3 ALA p 58 -2.907 -8.755 -6.521 1.00 0.00 H new ATOM 932 N GLN p 59 -4.204 -6.711 -4.433 1.00 0.00 N ATOM 933 CA GLN p 59 -5.414 -6.516 -3.683 1.00 0.00 C ATOM 934 C GLN p 59 -5.327 -5.163 -2.975 1.00 0.00 C ATOM 935 O GLN p 59 -6.337 -4.549 -2.657 1.00 0.00 O ATOM 936 CB GLN p 59 -5.526 -7.668 -2.682 1.00 0.00 C ATOM 937 CG GLN p 59 -6.485 -7.418 -1.548 1.00 0.00 C ATOM 938 CD GLN p 59 -7.518 -8.517 -1.385 1.00 0.00 C ATOM 939 OE1 GLN p 59 -7.303 -9.483 -0.654 1.00 0.00 O ATOM 940 NE2 GLN p 59 -8.647 -8.375 -2.070 1.00 0.00 N ATOM 0 H GLN p 59 -3.459 -7.136 -3.881 1.00 0.00 H new ATOM 0 HA GLN p 59 -6.298 -6.512 -4.320 1.00 0.00 H new ATOM 0 HB2 GLN p 59 -5.839 -8.566 -3.214 1.00 0.00 H new ATOM 0 HB3 GLN p 59 -4.538 -7.870 -2.268 1.00 0.00 H new ATOM 0 HG2 GLN p 59 -5.922 -7.317 -0.620 1.00 0.00 H new ATOM 0 HG3 GLN p 59 -6.996 -6.470 -1.715 1.00 0.00 H new ATOM 0 HE21 GLN p 59 -8.783 -7.558 -2.665 1.00 0.00 H new ATOM 0 HE22 GLN p 59 -9.378 -9.083 -2.001 1.00 0.00 H new ATOM 949 N LEU p 60 -4.080 -4.748 -2.740 1.00 0.00 N ATOM 950 CA LEU p 60 -3.735 -3.478 -2.095 1.00 0.00 C ATOM 951 C LEU p 60 -3.669 -2.358 -3.148 1.00 0.00 C ATOM 952 O LEU p 60 -3.658 -1.169 -2.832 1.00 0.00 O ATOM 953 CB LEU p 60 -2.380 -3.636 -1.379 1.00 0.00 C ATOM 954 CG LEU p 60 -1.924 -2.493 -0.452 1.00 0.00 C ATOM 955 CD1 LEU p 60 -1.003 -1.558 -1.212 1.00 0.00 C ATOM 956 CD2 LEU p 60 -3.114 -1.729 0.110 1.00 0.00 C ATOM 0 H LEU p 60 -3.262 -5.299 -2.999 1.00 0.00 H new ATOM 0 HA LEU p 60 -4.497 -3.210 -1.363 1.00 0.00 H new ATOM 0 HB2 LEU p 60 -2.417 -4.552 -0.789 1.00 0.00 H new ATOM 0 HB3 LEU p 60 -1.613 -3.777 -2.140 1.00 0.00 H new ATOM 0 HG LEU p 60 -1.384 -2.925 0.390 1.00 0.00 H new ATOM 0 HD11 LEU p 60 -0.682 -0.750 -0.555 1.00 0.00 H new ATOM 0 HD12 LEU p 60 -0.131 -2.111 -1.561 1.00 0.00 H new ATOM 0 HD13 LEU p 60 -1.534 -1.140 -2.067 1.00 0.00 H new ATOM 0 HD21 LEU p 60 -2.759 -0.929 0.760 1.00 0.00 H new ATOM 0 HD22 LEU p 60 -3.692 -1.301 -0.709 1.00 0.00 H new ATOM 0 HD23 LEU p 60 -3.745 -2.409 0.683 1.00 0.00 H new ATOM 968 N LYS p 61 -3.619 -2.811 -4.390 1.00 0.00 N ATOM 969 CA LYS p 61 -3.582 -2.004 -5.592 1.00 0.00 C ATOM 970 C LYS p 61 -5.011 -1.887 -6.068 1.00 0.00 C ATOM 971 O LYS p 61 -5.424 -0.897 -6.680 1.00 0.00 O ATOM 972 CB LYS p 61 -2.701 -2.681 -6.644 1.00 0.00 C ATOM 973 CG LYS p 61 -1.306 -2.084 -6.758 1.00 0.00 C ATOM 974 CD LYS p 61 -1.241 -0.993 -7.817 1.00 0.00 C ATOM 975 CE LYS p 61 0.158 -0.407 -7.928 1.00 0.00 C ATOM 976 NZ LYS p 61 0.240 0.642 -8.982 1.00 0.00 N ATOM 0 H LYS p 61 -3.602 -3.810 -4.595 1.00 0.00 H new ATOM 0 HA LYS p 61 -3.158 -1.017 -5.407 1.00 0.00 H new ATOM 0 HB2 LYS p 61 -2.613 -3.740 -6.403 1.00 0.00 H new ATOM 0 HB3 LYS p 61 -3.194 -2.615 -7.614 1.00 0.00 H new ATOM 0 HG2 LYS p 61 -1.007 -1.672 -5.794 1.00 0.00 H new ATOM 0 HG3 LYS p 61 -0.593 -2.871 -7.003 1.00 0.00 H new ATOM 0 HD2 LYS p 61 -1.543 -1.402 -8.781 1.00 0.00 H new ATOM 0 HD3 LYS p 61 -1.949 -0.202 -7.570 1.00 0.00 H new ATOM 0 HE2 LYS p 61 0.450 0.019 -6.968 1.00 0.00 H new ATOM 0 HE3 LYS p 61 0.868 -1.203 -8.152 1.00 0.00 H new ATOM 0 HZ1 LYS p 61 1.210 1.016 -9.025 1.00 0.00 H new ATOM 0 HZ2 LYS p 61 -0.014 0.230 -9.903 1.00 0.00 H new ATOM 0 HZ3 LYS p 61 -0.419 1.414 -8.755 1.00 0.00 H new ATOM 990 N TRP p 62 -5.749 -2.962 -5.754 1.00 0.00 N ATOM 991 CA TRP p 62 -7.174 -3.065 -6.009 1.00 0.00 C ATOM 992 C TRP p 62 -7.866 -2.297 -4.904 1.00 0.00 C ATOM 993 O TRP p 62 -8.946 -1.729 -5.093 1.00 0.00 O ATOM 994 CB TRP p 62 -7.629 -4.523 -6.020 1.00 0.00 C ATOM 995 CG TRP p 62 -8.524 -4.858 -7.178 1.00 0.00 C ATOM 996 CD1 TRP p 62 -8.146 -5.416 -8.365 1.00 0.00 C ATOM 997 CD2 TRP p 62 -9.945 -4.656 -7.264 1.00 0.00 C ATOM 998 NE1 TRP p 62 -9.238 -5.575 -9.183 1.00 0.00 N ATOM 999 CE2 TRP p 62 -10.353 -5.117 -8.532 1.00 0.00 C ATOM 1000 CE3 TRP p 62 -10.913 -4.134 -6.396 1.00 0.00 C ATOM 1001 CZ2 TRP p 62 -11.681 -5.070 -8.949 1.00 0.00 C ATOM 1002 CZ3 TRP p 62 -12.230 -4.089 -6.815 1.00 0.00 C ATOM 1003 CH2 TRP p 62 -12.603 -4.555 -8.081 1.00 0.00 C ATOM 0 H TRP p 62 -5.356 -3.792 -5.309 1.00 0.00 H new ATOM 0 HA TRP p 62 -7.421 -2.655 -6.988 1.00 0.00 H new ATOM 0 HB2 TRP p 62 -6.752 -5.170 -6.049 1.00 0.00 H new ATOM 0 HB3 TRP p 62 -8.154 -4.739 -5.090 1.00 0.00 H new ATOM 0 HD1 TRP p 62 -7.135 -5.693 -8.624 1.00 0.00 H new ATOM 0 HE1 TRP p 62 -9.221 -5.970 -10.123 1.00 0.00 H new ATOM 0 HE3 TRP p 62 -10.635 -3.773 -5.417 1.00 0.00 H new ATOM 0 HZ2 TRP p 62 -11.973 -5.428 -9.925 1.00 0.00 H new ATOM 0 HZ3 TRP p 62 -12.984 -3.687 -6.154 1.00 0.00 H new ATOM 0 HH2 TRP p 62 -13.640 -4.507 -8.378 1.00 0.00 H new ATOM 1014 N LYS p 63 -7.200 -2.303 -3.735 1.00 0.00 N ATOM 1015 CA LYS p 63 -7.661 -1.530 -2.574 1.00 0.00 C ATOM 1016 C LYS p 63 -7.200 -0.075 -2.717 1.00 0.00 C ATOM 1017 O LYS p 63 -7.653 0.797 -1.991 1.00 0.00 O ATOM 1018 CB LYS p 63 -7.157 -2.115 -1.256 1.00 0.00 C ATOM 1019 CG LYS p 63 -8.074 -3.178 -0.675 1.00 0.00 C ATOM 1020 CD LYS p 63 -7.669 -3.556 0.742 1.00 0.00 C ATOM 1021 CE LYS p 63 -8.579 -4.631 1.313 1.00 0.00 C ATOM 1022 NZ LYS p 63 -8.175 -5.031 2.688 1.00 0.00 N ATOM 0 H LYS p 63 -6.344 -2.834 -3.572 1.00 0.00 H new ATOM 0 HA LYS p 63 -8.750 -1.576 -2.550 1.00 0.00 H new ATOM 0 HB2 LYS p 63 -6.168 -2.546 -1.413 1.00 0.00 H new ATOM 0 HB3 LYS p 63 -7.042 -1.310 -0.531 1.00 0.00 H new ATOM 0 HG2 LYS p 63 -9.101 -2.812 -0.675 1.00 0.00 H new ATOM 0 HG3 LYS p 63 -8.051 -4.064 -1.309 1.00 0.00 H new ATOM 0 HD2 LYS p 63 -6.638 -3.911 0.745 1.00 0.00 H new ATOM 0 HD3 LYS p 63 -7.703 -2.672 1.379 1.00 0.00 H new ATOM 0 HE2 LYS p 63 -9.606 -4.266 1.329 1.00 0.00 H new ATOM 0 HE3 LYS p 63 -8.561 -5.505 0.661 1.00 0.00 H new ATOM 0 HZ1 LYS p 63 -8.821 -5.766 3.040 1.00 0.00 H new ATOM 0 HZ2 LYS p 63 -7.204 -5.404 2.670 1.00 0.00 H new ATOM 0 HZ3 LYS p 63 -8.216 -4.203 3.317 1.00 0.00 H new ATOM 1036 N LEU p 64 -6.264 0.131 -3.659 1.00 0.00 N ATOM 1037 CA LEU p 64 -5.692 1.440 -4.008 1.00 0.00 C ATOM 1038 C LEU p 64 -6.552 2.110 -5.077 1.00 0.00 C ATOM 1039 O LEU p 64 -6.498 3.306 -5.285 1.00 0.00 O ATOM 1040 CB LEU p 64 -4.236 1.221 -4.511 1.00 0.00 C ATOM 1041 CG LEU p 64 -3.413 2.417 -5.075 1.00 0.00 C ATOM 1042 CD1 LEU p 64 -3.611 2.546 -6.578 1.00 0.00 C ATOM 1043 CD2 LEU p 64 -3.754 3.726 -4.394 1.00 0.00 C ATOM 0 H LEU p 64 -5.874 -0.631 -4.214 1.00 0.00 H new ATOM 0 HA LEU p 64 -5.674 2.096 -3.137 1.00 0.00 H new ATOM 0 HB2 LEU p 64 -3.668 0.800 -3.682 1.00 0.00 H new ATOM 0 HB3 LEU p 64 -4.274 0.459 -5.290 1.00 0.00 H new ATOM 0 HG LEU p 64 -2.365 2.202 -4.866 1.00 0.00 H new ATOM 0 HD11 LEU p 64 -3.027 3.388 -6.951 1.00 0.00 H new ATOM 0 HD12 LEU p 64 -3.281 1.630 -7.068 1.00 0.00 H new ATOM 0 HD13 LEU p 64 -4.666 2.713 -6.793 1.00 0.00 H new ATOM 0 HD21 LEU p 64 -3.153 4.527 -4.824 1.00 0.00 H new ATOM 0 HD22 LEU p 64 -4.811 3.947 -4.540 1.00 0.00 H new ATOM 0 HD23 LEU p 64 -3.544 3.647 -3.327 1.00 0.00 H new ATOM 1055 N GLN p 65 -7.314 1.272 -5.726 1.00 0.00 N ATOM 1056 CA GLN p 65 -8.251 1.606 -6.771 1.00 0.00 C ATOM 1057 C GLN p 65 -9.601 1.747 -6.092 1.00 0.00 C ATOM 1058 O GLN p 65 -10.534 2.338 -6.615 1.00 0.00 O ATOM 1059 CB GLN p 65 -8.233 0.473 -7.805 1.00 0.00 C ATOM 1060 CG GLN p 65 -9.527 0.284 -8.575 1.00 0.00 C ATOM 1061 CD GLN p 65 -9.319 0.187 -10.073 1.00 0.00 C ATOM 1062 OE1 GLN p 65 -9.333 1.195 -10.780 1.00 0.00 O ATOM 1063 NE2 GLN p 65 -9.125 -1.031 -10.565 1.00 0.00 N ATOM 0 H GLN p 65 -7.298 0.272 -5.528 1.00 0.00 H new ATOM 0 HA GLN p 65 -8.010 2.531 -7.296 1.00 0.00 H new ATOM 0 HB2 GLN p 65 -7.430 0.664 -8.516 1.00 0.00 H new ATOM 0 HB3 GLN p 65 -7.992 -0.460 -7.295 1.00 0.00 H new ATOM 0 HG2 GLN p 65 -10.023 -0.621 -8.224 1.00 0.00 H new ATOM 0 HG3 GLN p 65 -10.196 1.118 -8.360 1.00 0.00 H new ATOM 0 HE21 GLN p 65 -9.121 -1.838 -9.942 1.00 0.00 H new ATOM 0 HE22 GLN p 65 -8.980 -1.159 -11.566 1.00 0.00 H new ATOM 1072 N ALA p 66 -9.630 1.147 -4.907 1.00 0.00 N ATOM 1073 CA ALA p 66 -10.777 1.132 -4.009 1.00 0.00 C ATOM 1074 C ALA p 66 -10.611 2.256 -3.011 1.00 0.00 C ATOM 1075 O ALA p 66 -11.585 2.764 -2.458 1.00 0.00 O ATOM 1076 CB ALA p 66 -10.910 -0.207 -3.300 1.00 0.00 C ATOM 0 H ALA p 66 -8.827 0.641 -4.533 1.00 0.00 H new ATOM 0 HA ALA p 66 -11.691 1.275 -4.585 1.00 0.00 H new ATOM 0 HB1 ALA p 66 -11.776 -0.184 -2.638 1.00 0.00 H new ATOM 0 HB2 ALA p 66 -11.039 -0.998 -4.038 1.00 0.00 H new ATOM 0 HB3 ALA p 66 -10.011 -0.400 -2.715 1.00 0.00 H new ATOM 1082 N LEU p 67 -9.334 2.616 -2.796 1.00 0.00 N ATOM 1083 CA LEU p 67 -8.945 3.706 -1.936 1.00 0.00 C ATOM 1084 C LEU p 67 -8.936 4.948 -2.800 1.00 0.00 C ATOM 1085 O LEU p 67 -9.302 6.026 -2.361 1.00 0.00 O ATOM 1086 CB LEU p 67 -7.576 3.427 -1.285 1.00 0.00 C ATOM 1087 CG LEU p 67 -6.404 4.345 -1.665 1.00 0.00 C ATOM 1088 CD1 LEU p 67 -6.530 5.703 -1.007 1.00 0.00 C ATOM 1089 CD2 LEU p 67 -5.099 3.694 -1.294 1.00 0.00 C ATOM 0 H LEU p 67 -8.543 2.139 -3.230 1.00 0.00 H new ATOM 0 HA LEU p 67 -9.640 3.835 -1.106 1.00 0.00 H new ATOM 0 HB2 LEU p 67 -7.703 3.475 -0.203 1.00 0.00 H new ATOM 0 HB3 LEU p 67 -7.292 2.403 -1.527 1.00 0.00 H new ATOM 0 HG LEU p 67 -6.429 4.500 -2.744 1.00 0.00 H new ATOM 0 HD11 LEU p 67 -5.685 6.328 -1.297 1.00 0.00 H new ATOM 0 HD12 LEU p 67 -7.458 6.177 -1.326 1.00 0.00 H new ATOM 0 HD13 LEU p 67 -6.538 5.583 0.076 1.00 0.00 H new ATOM 0 HD21 LEU p 67 -4.274 4.352 -1.567 1.00 0.00 H new ATOM 0 HD22 LEU p 67 -5.077 3.510 -0.220 1.00 0.00 H new ATOM 0 HD23 LEU p 67 -5.000 2.748 -1.826 1.00 0.00 H new ATOM 1101 N LYS p 68 -8.432 4.756 -4.024 1.00 0.00 N ATOM 1102 CA LYS p 68 -8.428 5.804 -5.050 1.00 0.00 C ATOM 1103 C LYS p 68 -9.854 6.063 -5.487 1.00 0.00 C ATOM 1104 O LYS p 68 -10.184 7.165 -5.915 1.00 0.00 O ATOM 1105 CB LYS p 68 -7.559 5.466 -6.260 1.00 0.00 C ATOM 1106 CG LYS p 68 -6.184 6.111 -6.216 1.00 0.00 C ATOM 1107 CD LYS p 68 -5.487 6.034 -7.563 1.00 0.00 C ATOM 1108 CE LYS p 68 -4.113 6.684 -7.515 1.00 0.00 C ATOM 1109 NZ LYS p 68 -3.423 6.621 -8.833 1.00 0.00 N ATOM 0 H LYS p 68 -8.018 3.875 -4.330 1.00 0.00 H new ATOM 0 HA LYS p 68 -7.989 6.697 -4.605 1.00 0.00 H new ATOM 0 HB2 LYS p 68 -7.443 4.384 -6.323 1.00 0.00 H new ATOM 0 HB3 LYS p 68 -8.073 5.785 -7.167 1.00 0.00 H new ATOM 0 HG2 LYS p 68 -6.280 7.154 -5.915 1.00 0.00 H new ATOM 0 HG3 LYS p 68 -5.573 5.616 -5.461 1.00 0.00 H new ATOM 0 HD2 LYS p 68 -5.387 4.991 -7.864 1.00 0.00 H new ATOM 0 HD3 LYS p 68 -6.098 6.527 -8.319 1.00 0.00 H new ATOM 0 HE2 LYS p 68 -4.214 7.725 -7.208 1.00 0.00 H new ATOM 0 HE3 LYS p 68 -3.502 6.187 -6.761 1.00 0.00 H new ATOM 0 HZ1 LYS p 68 -2.490 7.075 -8.758 1.00 0.00 H new ATOM 0 HZ2 LYS p 68 -3.303 5.627 -9.115 1.00 0.00 H new ATOM 0 HZ3 LYS p 68 -3.993 7.117 -9.547 1.00 0.00 H new ATOM 1123 N LYS p 69 -10.687 5.008 -5.396 1.00 0.00 N ATOM 1124 CA LYS p 69 -12.118 5.127 -5.661 1.00 0.00 C ATOM 1125 C LYS p 69 -12.775 5.676 -4.401 1.00 0.00 C ATOM 1126 O LYS p 69 -13.902 6.169 -4.427 1.00 0.00 O ATOM 1127 CB LYS p 69 -12.742 3.790 -6.038 1.00 0.00 C ATOM 1128 CG LYS p 69 -13.062 3.665 -7.517 1.00 0.00 C ATOM 1129 CD LYS p 69 -14.190 2.673 -7.765 1.00 0.00 C ATOM 1130 CE LYS p 69 -14.529 2.565 -9.245 1.00 0.00 C ATOM 1131 NZ LYS p 69 -15.269 3.761 -9.740 1.00 0.00 N ATOM 0 H LYS p 69 -10.385 4.068 -5.140 1.00 0.00 H new ATOM 0 HA LYS p 69 -12.273 5.794 -6.509 1.00 0.00 H new ATOM 0 HB2 LYS p 69 -12.062 2.988 -5.753 1.00 0.00 H new ATOM 0 HB3 LYS p 69 -13.658 3.651 -5.463 1.00 0.00 H new ATOM 0 HG2 LYS p 69 -13.342 4.641 -7.913 1.00 0.00 H new ATOM 0 HG3 LYS p 69 -12.171 3.346 -8.057 1.00 0.00 H new ATOM 0 HD2 LYS p 69 -13.903 1.693 -7.385 1.00 0.00 H new ATOM 0 HD3 LYS p 69 -15.076 2.983 -7.210 1.00 0.00 H new ATOM 0 HE2 LYS p 69 -13.610 2.445 -9.819 1.00 0.00 H new ATOM 0 HE3 LYS p 69 -15.130 1.672 -9.414 1.00 0.00 H new ATOM 0 HZ1 LYS p 69 -15.479 3.645 -10.752 1.00 0.00 H new ATOM 0 HZ2 LYS p 69 -16.159 3.862 -9.211 1.00 0.00 H new ATOM 0 HZ3 LYS p 69 -14.686 4.611 -9.603 1.00 0.00 H new ATOM 1145 N LYS p 70 -12.016 5.556 -3.298 1.00 0.00 N ATOM 1146 CA LYS p 70 -12.391 6.073 -1.992 1.00 0.00 C ATOM 1147 C LYS p 70 -11.831 7.480 -1.874 1.00 0.00 C ATOM 1148 O LYS p 70 -12.303 8.291 -1.083 1.00 0.00 O ATOM 1149 CB LYS p 70 -11.837 5.197 -0.880 1.00 0.00 C ATOM 1150 CG LYS p 70 -12.883 4.356 -0.166 1.00 0.00 C ATOM 1151 CD LYS p 70 -13.402 5.043 1.089 1.00 0.00 C ATOM 1152 CE LYS p 70 -14.426 4.183 1.812 1.00 0.00 C ATOM 1153 NZ LYS p 70 -14.927 4.837 3.052 1.00 0.00 N ATOM 0 H LYS p 70 -11.110 5.087 -3.301 1.00 0.00 H new ATOM 0 HA LYS p 70 -13.477 6.079 -1.894 1.00 0.00 H new ATOM 0 HB2 LYS p 70 -11.079 4.535 -1.299 1.00 0.00 H new ATOM 0 HB3 LYS p 70 -11.337 5.832 -0.148 1.00 0.00 H new ATOM 0 HG2 LYS p 70 -13.715 4.159 -0.843 1.00 0.00 H new ATOM 0 HG3 LYS p 70 -12.453 3.390 0.100 1.00 0.00 H new ATOM 0 HD2 LYS p 70 -12.569 5.258 1.758 1.00 0.00 H new ATOM 0 HD3 LYS p 70 -13.852 5.999 0.822 1.00 0.00 H new ATOM 0 HE2 LYS p 70 -15.264 3.979 1.145 1.00 0.00 H new ATOM 0 HE3 LYS p 70 -13.979 3.222 2.064 1.00 0.00 H new ATOM 0 HZ1 LYS p 70 -15.623 4.218 3.514 1.00 0.00 H new ATOM 0 HZ2 LYS p 70 -14.132 5.008 3.700 1.00 0.00 H new ATOM 0 HZ3 LYS p 70 -15.377 5.743 2.809 1.00 0.00 H new ATOM 1167 N ASN p 71 -10.773 7.708 -2.671 1.00 0.00 N ATOM 1168 CA ASN p 71 -10.106 9.007 -2.800 1.00 0.00 C ATOM 1169 C ASN p 71 -10.830 9.790 -3.893 1.00 0.00 C ATOM 1170 O ASN p 71 -10.662 10.997 -4.033 1.00 0.00 O ATOM 1171 CB ASN p 71 -8.624 8.847 -3.162 1.00 0.00 C ATOM 1172 CG ASN p 71 -7.765 10.022 -2.710 1.00 0.00 C ATOM 1173 OD1 ASN p 71 -8.215 11.170 -2.673 1.00 0.00 O ATOM 1174 ND2 ASN p 71 -6.513 9.737 -2.368 1.00 0.00 N ATOM 0 H ASN p 71 -10.354 6.981 -3.251 1.00 0.00 H new ATOM 0 HA ASN p 71 -10.147 9.534 -1.847 1.00 0.00 H new ATOM 0 HB2 ASN p 71 -8.243 7.932 -2.709 1.00 0.00 H new ATOM 0 HB3 ASN p 71 -8.531 8.731 -4.242 1.00 0.00 H new ATOM 0 HD21 ASN p 71 -5.886 10.481 -2.061 1.00 0.00 H new ATOM 0 HD22 ASN p 71 -6.179 8.774 -2.412 1.00 0.00 H new ATOM 1181 N ALA p 72 -11.613 9.024 -4.669 1.00 0.00 N ATOM 1182 CA ALA p 72 -12.471 9.513 -5.739 1.00 0.00 C ATOM 1183 C ALA p 72 -13.827 9.738 -5.118 1.00 0.00 C ATOM 1184 O ALA p 72 -14.659 10.475 -5.638 1.00 0.00 O ATOM 1185 CB ALA p 72 -12.570 8.524 -6.891 1.00 0.00 C ATOM 0 H ALA p 72 -11.662 8.011 -4.558 1.00 0.00 H new ATOM 0 HA ALA p 72 -12.061 10.429 -6.165 1.00 0.00 H new ATOM 0 HB1 ALA p 72 -13.220 8.931 -7.665 1.00 0.00 H new ATOM 0 HB2 ALA p 72 -11.577 8.348 -7.306 1.00 0.00 H new ATOM 0 HB3 ALA p 72 -12.984 7.583 -6.528 1.00 0.00 H new ATOM 1191 N GLN p 73 -14.009 9.030 -3.989 1.00 0.00 N ATOM 1192 CA GLN p 73 -15.158 9.104 -3.142 1.00 0.00 C ATOM 1193 C GLN p 73 -14.929 10.275 -2.214 1.00 0.00 C ATOM 1194 O GLN p 73 -15.848 10.970 -1.804 1.00 0.00 O ATOM 1195 CB GLN p 73 -15.200 7.820 -2.359 1.00 0.00 C ATOM 1196 CG GLN p 73 -16.391 7.688 -1.479 1.00 0.00 C ATOM 1197 CD GLN p 73 -17.313 6.552 -1.876 1.00 0.00 C ATOM 1198 OE1 GLN p 73 -18.231 6.733 -2.676 1.00 0.00 O ATOM 1199 NE2 GLN p 73 -17.074 5.371 -1.316 1.00 0.00 N ATOM 0 H GLN p 73 -13.313 8.367 -3.648 1.00 0.00 H new ATOM 0 HA GLN p 73 -16.092 9.235 -3.688 1.00 0.00 H new ATOM 0 HB2 GLN p 73 -15.180 6.981 -3.055 1.00 0.00 H new ATOM 0 HB3 GLN p 73 -14.300 7.749 -1.748 1.00 0.00 H new ATOM 0 HG2 GLN p 73 -16.059 7.534 -0.452 1.00 0.00 H new ATOM 0 HG3 GLN p 73 -16.951 8.623 -1.496 1.00 0.00 H new ATOM 0 HE21 GLN p 73 -16.302 5.266 -0.658 1.00 0.00 H new ATOM 0 HE22 GLN p 73 -17.663 4.570 -1.544 1.00 0.00 H new ATOM 1208 N LEU p 74 -13.649 10.395 -1.872 1.00 0.00 N ATOM 1209 CA LEU p 74 -13.106 11.473 -1.054 1.00 0.00 C ATOM 1210 C LEU p 74 -13.013 12.716 -1.921 1.00 0.00 C ATOM 1211 O LEU p 74 -13.154 13.821 -1.451 1.00 0.00 O ATOM 1212 CB LEU p 74 -11.726 11.089 -0.527 1.00 0.00 C ATOM 1213 CG LEU p 74 -11.226 11.821 0.722 1.00 0.00 C ATOM 1214 CD1 LEU p 74 -11.914 11.315 1.988 1.00 0.00 C ATOM 1215 CD2 LEU p 74 -9.727 11.632 0.819 1.00 0.00 C ATOM 0 H LEU p 74 -12.940 9.723 -2.166 1.00 0.00 H new ATOM 0 HA LEU p 74 -13.752 11.661 -0.197 1.00 0.00 H new ATOM 0 HB2 LEU p 74 -11.731 10.020 -0.313 1.00 0.00 H new ATOM 0 HB3 LEU p 74 -11.002 11.250 -1.326 1.00 0.00 H new ATOM 0 HG LEU p 74 -11.468 12.880 0.634 1.00 0.00 H new ATOM 0 HD11 LEU p 74 -11.532 11.859 2.852 1.00 0.00 H new ATOM 0 HD12 LEU p 74 -12.989 11.473 1.906 1.00 0.00 H new ATOM 0 HD13 LEU p 74 -11.712 10.251 2.111 1.00 0.00 H new ATOM 0 HD21 LEU p 74 -9.352 12.147 1.703 1.00 0.00 H new ATOM 0 HD22 LEU p 74 -9.498 10.569 0.894 1.00 0.00 H new ATOM 0 HD23 LEU p 74 -9.250 12.044 -0.070 1.00 0.00 H new ATOM 1227 N LYS p 75 -12.808 12.478 -3.213 1.00 0.00 N ATOM 1228 CA LYS p 75 -12.752 13.527 -4.226 1.00 0.00 C ATOM 1229 C LYS p 75 -14.181 13.825 -4.611 1.00 0.00 C ATOM 1230 O LYS p 75 -14.506 14.879 -5.164 1.00 0.00 O ATOM 1231 CB LYS p 75 -11.959 13.072 -5.442 1.00 0.00 C ATOM 1232 CG LYS p 75 -10.736 13.921 -5.748 1.00 0.00 C ATOM 1233 CD LYS p 75 -10.937 14.757 -7.001 1.00 0.00 C ATOM 1234 CE LYS p 75 -9.719 15.617 -7.299 1.00 0.00 C ATOM 1235 NZ LYS p 75 -9.907 16.442 -8.523 1.00 0.00 N ATOM 0 H LYS p 75 -12.674 11.540 -3.591 1.00 0.00 H new ATOM 0 HA LYS p 75 -12.251 14.413 -3.837 1.00 0.00 H new ATOM 0 HB2 LYS p 75 -11.641 12.041 -5.288 1.00 0.00 H new ATOM 0 HB3 LYS p 75 -12.616 13.077 -6.312 1.00 0.00 H new ATOM 0 HG2 LYS p 75 -10.526 14.576 -4.902 1.00 0.00 H new ATOM 0 HG3 LYS p 75 -9.867 13.276 -5.875 1.00 0.00 H new ATOM 0 HD2 LYS p 75 -11.137 14.102 -7.849 1.00 0.00 H new ATOM 0 HD3 LYS p 75 -11.812 15.395 -6.878 1.00 0.00 H new ATOM 0 HE2 LYS p 75 -9.519 16.269 -6.449 1.00 0.00 H new ATOM 0 HE3 LYS p 75 -8.845 14.978 -7.423 1.00 0.00 H new ATOM 0 HZ1 LYS p 75 -9.054 17.013 -8.691 1.00 0.00 H new ATOM 0 HZ2 LYS p 75 -10.073 15.819 -9.339 1.00 0.00 H new ATOM 0 HZ3 LYS p 75 -10.725 17.071 -8.395 1.00 0.00 H new ATOM 1249 N LYS p 76 -15.022 12.834 -4.287 1.00 0.00 N ATOM 1250 CA LYS p 76 -16.462 12.924 -4.486 1.00 0.00 C ATOM 1251 C LYS p 76 -17.052 13.561 -3.250 1.00 0.00 C ATOM 1252 O LYS p 76 -18.052 14.282 -3.315 1.00 0.00 O ATOM 1253 CB LYS p 76 -17.081 11.551 -4.717 1.00 0.00 C ATOM 1254 CG LYS p 76 -17.601 11.330 -6.128 1.00 0.00 C ATOM 1255 CD LYS p 76 -19.116 11.469 -6.189 1.00 0.00 C ATOM 1256 CE LYS p 76 -19.646 11.266 -7.602 1.00 0.00 C ATOM 1257 NZ LYS p 76 -19.399 12.452 -8.469 1.00 0.00 N ATOM 0 H LYS p 76 -14.716 11.950 -3.880 1.00 0.00 H new ATOM 0 HA LYS p 76 -16.674 13.521 -5.373 1.00 0.00 H new ATOM 0 HB2 LYS p 76 -16.337 10.787 -4.493 1.00 0.00 H new ATOM 0 HB3 LYS p 76 -17.902 11.412 -4.014 1.00 0.00 H new ATOM 0 HG2 LYS p 76 -17.140 12.050 -6.804 1.00 0.00 H new ATOM 0 HG3 LYS p 76 -17.311 10.338 -6.473 1.00 0.00 H new ATOM 0 HD2 LYS p 76 -19.575 10.741 -5.520 1.00 0.00 H new ATOM 0 HD3 LYS p 76 -19.405 12.457 -5.831 1.00 0.00 H new ATOM 0 HE2 LYS p 76 -19.172 10.389 -8.044 1.00 0.00 H new ATOM 0 HE3 LYS p 76 -20.716 11.064 -7.562 1.00 0.00 H new ATOM 0 HZ1 LYS p 76 -19.776 12.270 -9.421 1.00 0.00 H new ATOM 0 HZ2 LYS p 76 -19.872 13.284 -8.062 1.00 0.00 H new ATOM 0 HZ3 LYS p 76 -18.376 12.631 -8.530 1.00 0.00 H new ATOM 1271 N LYS p 77 -16.401 13.271 -2.117 1.00 0.00 N ATOM 1272 CA LYS p 77 -16.776 13.850 -0.844 1.00 0.00 C ATOM 1273 C LYS p 77 -16.084 15.198 -0.671 1.00 0.00 C ATOM 1274 O LYS p 77 -16.484 16.007 0.172 1.00 0.00 O ATOM 1275 CB LYS p 77 -16.424 12.910 0.300 1.00 0.00 C ATOM 1276 CG LYS p 77 -17.558 11.985 0.701 1.00 0.00 C ATOM 1277 CD LYS p 77 -17.281 11.304 2.032 1.00 0.00 C ATOM 1278 CE LYS p 77 -18.424 10.389 2.437 1.00 0.00 C ATOM 1279 NZ LYS p 77 -18.173 9.731 3.749 1.00 0.00 N ATOM 0 H LYS p 77 -15.607 12.632 -2.068 1.00 0.00 H new ATOM 0 HA LYS p 77 -17.855 14.003 -0.828 1.00 0.00 H new ATOM 0 HB2 LYS p 77 -15.561 12.309 0.012 1.00 0.00 H new ATOM 0 HB3 LYS p 77 -16.126 13.501 1.166 1.00 0.00 H new ATOM 0 HG2 LYS p 77 -18.485 12.554 0.769 1.00 0.00 H new ATOM 0 HG3 LYS p 77 -17.703 11.230 -0.072 1.00 0.00 H new ATOM 0 HD2 LYS p 77 -16.359 10.727 1.962 1.00 0.00 H new ATOM 0 HD3 LYS p 77 -17.127 12.059 2.803 1.00 0.00 H new ATOM 0 HE2 LYS p 77 -19.348 10.965 2.491 1.00 0.00 H new ATOM 0 HE3 LYS p 77 -18.568 9.627 1.671 1.00 0.00 H new ATOM 0 HZ1 LYS p 77 -18.977 9.116 3.988 1.00 0.00 H new ATOM 0 HZ2 LYS p 77 -17.305 9.161 3.691 1.00 0.00 H new ATOM 0 HZ3 LYS p 77 -18.061 10.457 4.486 1.00 0.00 H new ATOM 1293 N LEU p 78 -15.033 15.424 -1.486 1.00 0.00 N ATOM 1294 CA LEU p 78 -14.280 16.683 -1.481 1.00 0.00 C ATOM 1295 C LEU p 78 -15.187 17.893 -1.751 1.00 0.00 C ATOM 1296 O LEU p 78 -15.287 18.810 -0.930 1.00 0.00 O ATOM 1297 CB LEU p 78 -13.151 16.575 -2.528 1.00 0.00 C ATOM 1298 CG LEU p 78 -12.344 17.840 -2.841 1.00 0.00 C ATOM 1299 CD1 LEU p 78 -11.607 18.321 -1.608 1.00 0.00 C ATOM 1300 CD2 LEU p 78 -11.377 17.555 -3.974 1.00 0.00 C ATOM 0 H LEU p 78 -14.689 14.740 -2.160 1.00 0.00 H new ATOM 0 HA LEU p 78 -13.851 16.845 -0.492 1.00 0.00 H new ATOM 0 HB2 LEU p 78 -12.454 15.808 -2.191 1.00 0.00 H new ATOM 0 HB3 LEU p 78 -13.591 16.219 -3.460 1.00 0.00 H new ATOM 0 HG LEU p 78 -13.025 18.633 -3.150 1.00 0.00 H new ATOM 0 HD11 LEU p 78 -11.040 19.220 -1.851 1.00 0.00 H new ATOM 0 HD12 LEU p 78 -12.325 18.547 -0.820 1.00 0.00 H new ATOM 0 HD13 LEU p 78 -10.925 17.543 -1.265 1.00 0.00 H new ATOM 0 HD21 LEU p 78 -10.803 18.454 -4.197 1.00 0.00 H new ATOM 0 HD22 LEU p 78 -10.698 16.754 -3.680 1.00 0.00 H new ATOM 0 HD23 LEU p 78 -11.934 17.251 -4.860 1.00 0.00 H new ATOM 1312 N GLN p 79 -15.830 17.859 -2.905 1.00 0.00 N ATOM 1313 CA GLN p 79 -16.749 18.900 -3.352 1.00 0.00 C ATOM 1314 C GLN p 79 -18.168 18.659 -2.836 1.00 0.00 C ATOM 1315 O GLN p 79 -18.852 19.590 -2.399 1.00 0.00 O ATOM 1316 CB GLN p 79 -16.748 18.985 -4.887 1.00 0.00 C ATOM 1317 CG GLN p 79 -16.605 17.648 -5.619 1.00 0.00 C ATOM 1318 CD GLN p 79 -16.624 17.804 -7.128 1.00 0.00 C ATOM 1319 OE1 GLN p 79 -17.682 17.753 -7.756 1.00 0.00 O ATOM 1320 NE2 GLN p 79 -15.450 17.993 -7.719 1.00 0.00 N ATOM 0 H GLN p 79 -15.729 17.094 -3.573 1.00 0.00 H new ATOM 0 HA GLN p 79 -16.403 19.848 -2.940 1.00 0.00 H new ATOM 0 HB2 GLN p 79 -17.676 19.458 -5.208 1.00 0.00 H new ATOM 0 HB3 GLN p 79 -15.933 19.639 -5.197 1.00 0.00 H new ATOM 0 HG2 GLN p 79 -15.672 17.171 -5.318 1.00 0.00 H new ATOM 0 HG3 GLN p 79 -17.414 16.984 -5.316 1.00 0.00 H new ATOM 0 HE21 GLN p 79 -14.598 18.029 -7.160 1.00 0.00 H new ATOM 0 HE22 GLN p 79 -15.401 18.103 -8.732 1.00 0.00 H new ATOM 1329 N ALA p 80 -18.582 17.388 -2.893 1.00 0.00 N ATOM 1330 CA ALA p 80 -19.918 16.920 -2.449 1.00 0.00 C ATOM 1331 C ALA p 80 -21.056 17.576 -3.243 1.00 0.00 C ATOM 1332 O ALA p 80 -21.738 16.852 -3.999 1.00 0.00 O ATOM 1333 CB ALA p 80 -20.116 17.126 -0.944 1.00 0.00 C ATOM 1334 OXT ALA p 80 -21.250 18.804 -3.108 1.00 0.00 O ATOM 0 H ALA p 80 -17.995 16.636 -3.254 1.00 0.00 H new ATOM 0 HA ALA p 80 -19.954 15.850 -2.651 1.00 0.00 H new ATOM 0 HB1 ALA p 80 -21.106 16.772 -0.655 1.00 0.00 H new ATOM 0 HB2 ALA p 80 -19.357 16.567 -0.397 1.00 0.00 H new ATOM 0 HB3 ALA p 80 -20.027 18.186 -0.707 1.00 0.00 H new TER 1340 ALA p 80