USER MOD reduce.3.24.130724 H: found=0, std=0, add=687, rem=0, adj=10 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= -0.956 K(o=-1.9,f=-4.5) USER MOD Set 1.2: p 71 ASN :FLIP amide:sc= -0.915 F(o=-3.1!,f=-1.9) USER MOD Set 2.1: p 43 ASN : amide:sc= -0.607 K(o=-0.61,f=-2.3!) USER MOD Set 2.2: p 56 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Set 3.1: p 20 LYS NZ :NH3+ 159:sc= -0.953 (180deg=0) USER MOD Set 3.2: p 27 LYS NZ :NH3+ -176:sc= -1.01 (180deg=0) USER MOD Single : p 1 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : p 1 MET N :NH3+ 162:sc= 1.3 (180deg=0.805) 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 16 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : p 24 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : p 30 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : p 33 ASN : amide:sc= -1.98 K(o=-2,f=-6.3!) USER MOD Single : p 34 CYS SG : rot -19:sc= 0.0363 USER MOD Single : p 36 CYS SG : rot 180:sc= -0.144 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 180:sc= 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 -117:sc= -0.0827 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 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=-0.081) USER MOD ----------------------------------------------------------------- ATOM 1 N MET p 1 -7.278 24.215 3.939 1.00 0.00 N ATOM 2 CA MET p 1 -6.869 23.304 2.834 1.00 0.00 C ATOM 3 C MET p 1 -5.696 22.402 3.258 1.00 0.00 C ATOM 4 O MET p 1 -4.949 21.888 2.416 1.00 0.00 O ATOM 5 CB MET p 1 -6.491 24.128 1.593 1.00 0.00 C ATOM 6 CG MET p 1 -7.690 24.698 0.843 1.00 0.00 C ATOM 7 SD MET p 1 -8.631 25.896 1.815 1.00 0.00 S ATOM 8 CE MET p 1 -7.626 27.369 1.631 1.00 0.00 C ATOM 0 H1 MET p 1 -7.840 25.000 3.552 1.00 0.00 H new ATOM 0 H2 MET p 1 -7.849 23.688 4.630 1.00 0.00 H new ATOM 0 H3 MET p 1 -6.431 24.594 4.408 1.00 0.00 H new ATOM 0 HA MET p 1 -7.713 22.658 2.593 1.00 0.00 H new ATOM 0 HB2 MET p 1 -5.841 24.949 1.898 1.00 0.00 H new ATOM 0 HB3 MET p 1 -5.914 23.500 0.914 1.00 0.00 H new ATOM 0 HG2 MET p 1 -7.344 25.175 -0.074 1.00 0.00 H new ATOM 0 HG3 MET p 1 -8.349 23.881 0.548 1.00 0.00 H new ATOM 0 HE1 MET p 1 -8.084 28.193 2.179 1.00 0.00 H new ATOM 0 HE2 MET p 1 -6.628 27.180 2.027 1.00 0.00 H new ATOM 0 HE3 MET p 1 -7.554 27.631 0.575 1.00 0.00 H new ATOM 20 N GLN p 2 -5.546 22.216 4.572 1.00 0.00 N ATOM 21 CA GLN p 2 -4.492 21.392 5.144 1.00 0.00 C ATOM 22 C GLN p 2 -5.070 20.205 5.933 1.00 0.00 C ATOM 23 O GLN p 2 -4.332 19.356 6.432 1.00 0.00 O ATOM 24 CB GLN p 2 -3.620 22.254 6.070 1.00 0.00 C ATOM 25 CG GLN p 2 -4.343 23.412 6.757 1.00 0.00 C ATOM 26 CD GLN p 2 -3.420 24.240 7.629 1.00 0.00 C ATOM 27 OE1 GLN p 2 -3.253 23.960 8.817 1.00 0.00 O ATOM 28 NE2 GLN p 2 -2.812 25.265 7.043 1.00 0.00 N ATOM 0 H GLN p 2 -6.160 22.638 5.269 1.00 0.00 H new ATOM 0 HA GLN p 2 -3.891 20.991 4.328 1.00 0.00 H new ATOM 0 HB2 GLN p 2 -3.188 21.611 6.837 1.00 0.00 H new ATOM 0 HB3 GLN p 2 -2.791 22.658 5.489 1.00 0.00 H new ATOM 0 HG2 GLN p 2 -4.795 24.054 6.000 1.00 0.00 H new ATOM 0 HG3 GLN p 2 -5.156 23.017 7.367 1.00 0.00 H new ATOM 0 HE21 GLN p 2 -2.979 25.461 6.056 1.00 0.00 H new ATOM 0 HE22 GLN p 2 -2.178 25.856 7.580 1.00 0.00 H new ATOM 37 N ALA p 3 -6.394 20.154 6.019 1.00 0.00 N ATOM 38 CA ALA p 3 -7.099 19.118 6.778 1.00 0.00 C ATOM 39 C ALA p 3 -7.455 17.919 5.917 1.00 0.00 C ATOM 40 O ALA p 3 -7.337 16.777 6.346 1.00 0.00 O ATOM 41 CB ALA p 3 -8.345 19.697 7.437 1.00 0.00 C ATOM 0 H ALA p 3 -7.012 20.827 5.566 1.00 0.00 H new ATOM 0 HA ALA p 3 -6.420 18.764 7.554 1.00 0.00 H new ATOM 0 HB1 ALA p 3 -8.857 18.915 7.997 1.00 0.00 H new ATOM 0 HB2 ALA p 3 -8.058 20.500 8.116 1.00 0.00 H new ATOM 0 HB3 ALA p 3 -9.012 20.091 6.670 1.00 0.00 H new ATOM 47 N LEU p 4 -7.942 18.230 4.726 1.00 0.00 N ATOM 48 CA LEU p 4 -8.369 17.281 3.733 1.00 0.00 C ATOM 49 C LEU p 4 -7.248 17.017 2.745 1.00 0.00 C ATOM 50 O LEU p 4 -6.806 15.888 2.561 1.00 0.00 O ATOM 51 CB LEU p 4 -9.590 17.858 3.018 1.00 0.00 C ATOM 52 CG LEU p 4 -10.680 16.870 2.633 1.00 0.00 C ATOM 53 CD1 LEU p 4 -11.897 17.647 2.192 1.00 0.00 C ATOM 54 CD2 LEU p 4 -10.200 15.946 1.527 1.00 0.00 C ATOM 0 H LEU p 4 -8.052 19.197 4.420 1.00 0.00 H new ATOM 0 HA LEU p 4 -8.629 16.333 4.204 1.00 0.00 H new ATOM 0 HB2 LEU p 4 -10.032 18.621 3.659 1.00 0.00 H new ATOM 0 HB3 LEU p 4 -9.249 18.360 2.113 1.00 0.00 H new ATOM 0 HG LEU p 4 -10.934 16.248 3.491 1.00 0.00 H new ATOM 0 HD11 LEU p 4 -12.690 16.953 1.912 1.00 0.00 H new ATOM 0 HD12 LEU p 4 -12.241 18.280 3.010 1.00 0.00 H new ATOM 0 HD13 LEU p 4 -11.640 18.270 1.335 1.00 0.00 H new ATOM 0 HD21 LEU p 4 -10.995 15.247 1.266 1.00 0.00 H new ATOM 0 HD22 LEU p 4 -9.934 16.536 0.650 1.00 0.00 H new ATOM 0 HD23 LEU p 4 -9.327 15.391 1.870 1.00 0.00 H new ATOM 66 N GLU p 5 -6.821 18.115 2.116 1.00 0.00 N ATOM 67 CA GLU p 5 -5.748 18.136 1.102 1.00 0.00 C ATOM 68 C GLU p 5 -4.432 17.607 1.641 1.00 0.00 C ATOM 69 O GLU p 5 -3.648 17.020 0.900 1.00 0.00 O ATOM 70 CB GLU p 5 -5.520 19.554 0.568 1.00 0.00 C ATOM 71 CG GLU p 5 -6.777 20.405 0.500 1.00 0.00 C ATOM 72 CD GLU p 5 -7.029 20.973 -0.884 1.00 0.00 C ATOM 73 OE1 GLU p 5 -6.539 22.086 -1.167 1.00 0.00 O ATOM 74 OE2 GLU p 5 -7.718 20.304 -1.683 1.00 0.00 O ATOM 0 H GLU p 5 -7.216 19.038 2.297 1.00 0.00 H new ATOM 0 HA GLU p 5 -6.084 17.483 0.297 1.00 0.00 H new ATOM 0 HB2 GLU p 5 -4.789 20.056 1.202 1.00 0.00 H new ATOM 0 HB3 GLU p 5 -5.085 19.489 -0.429 1.00 0.00 H new ATOM 0 HG2 GLU p 5 -7.634 19.803 0.802 1.00 0.00 H new ATOM 0 HG3 GLU p 5 -6.695 21.224 1.214 1.00 0.00 H new ATOM 81 N LYS p 6 -4.206 17.842 2.929 1.00 0.00 N ATOM 82 CA LYS p 6 -2.991 17.383 3.608 1.00 0.00 C ATOM 83 C LYS p 6 -3.230 16.032 4.265 1.00 0.00 C ATOM 84 O LYS p 6 -2.294 15.398 4.741 1.00 0.00 O ATOM 85 CB LYS p 6 -2.486 18.397 4.620 1.00 0.00 C ATOM 86 CG LYS p 6 -1.535 19.425 4.020 1.00 0.00 C ATOM 87 CD LYS p 6 -0.827 20.233 5.095 1.00 0.00 C ATOM 88 CE LYS p 6 0.065 21.304 4.487 1.00 0.00 C ATOM 89 NZ LYS p 6 0.758 22.108 5.532 1.00 0.00 N ATOM 0 H LYS p 6 -4.852 18.352 3.531 1.00 0.00 H new ATOM 0 HA LYS p 6 -2.213 17.273 2.852 1.00 0.00 H new ATOM 0 HB2 LYS p 6 -3.338 18.914 5.062 1.00 0.00 H new ATOM 0 HB3 LYS p 6 -1.978 17.871 5.429 1.00 0.00 H new ATOM 0 HG2 LYS p 6 -0.796 18.918 3.400 1.00 0.00 H new ATOM 0 HG3 LYS p 6 -2.091 20.097 3.367 1.00 0.00 H new ATOM 0 HD2 LYS p 6 -1.565 20.699 5.747 1.00 0.00 H new ATOM 0 HD3 LYS p 6 -0.228 19.568 5.717 1.00 0.00 H new ATOM 0 HE2 LYS p 6 0.806 20.835 3.839 1.00 0.00 H new ATOM 0 HE3 LYS p 6 -0.535 21.963 3.860 1.00 0.00 H new ATOM 0 HZ1 LYS p 6 1.356 22.827 5.077 1.00 0.00 H new ATOM 0 HZ2 LYS p 6 0.052 22.576 6.135 1.00 0.00 H new ATOM 0 HZ3 LYS p 6 1.351 21.483 6.115 1.00 0.00 H new ATOM 103 N GLU p 7 -4.509 15.639 4.308 1.00 0.00 N ATOM 104 CA GLU p 7 -4.947 14.335 4.800 1.00 0.00 C ATOM 105 C GLU p 7 -4.918 13.400 3.591 1.00 0.00 C ATOM 106 O GLU p 7 -4.820 12.176 3.694 1.00 0.00 O ATOM 107 CB GLU p 7 -6.356 14.464 5.385 1.00 0.00 C ATOM 108 CG GLU p 7 -7.240 13.239 5.236 1.00 0.00 C ATOM 109 CD GLU p 7 -7.655 12.643 6.567 1.00 0.00 C ATOM 110 OE1 GLU p 7 -8.696 13.069 7.109 1.00 0.00 O ATOM 111 OE2 GLU p 7 -6.938 11.750 7.067 1.00 0.00 O ATOM 0 H GLU p 7 -5.279 16.231 3.996 1.00 0.00 H new ATOM 0 HA GLU p 7 -4.307 13.947 5.593 1.00 0.00 H new ATOM 0 HB2 GLU p 7 -6.270 14.702 6.445 1.00 0.00 H new ATOM 0 HB3 GLU p 7 -6.853 15.309 4.908 1.00 0.00 H new ATOM 0 HG2 GLU p 7 -8.132 13.508 4.671 1.00 0.00 H new ATOM 0 HG3 GLU p 7 -6.710 12.484 4.655 1.00 0.00 H new ATOM 118 N LEU p 8 -5.009 14.078 2.449 1.00 0.00 N ATOM 119 CA LEU p 8 -4.968 13.519 1.121 1.00 0.00 C ATOM 120 C LEU p 8 -3.511 13.507 0.698 1.00 0.00 C ATOM 121 O LEU p 8 -3.084 12.629 -0.029 1.00 0.00 O ATOM 122 CB LEU p 8 -5.840 14.374 0.165 1.00 0.00 C ATOM 123 CG LEU p 8 -5.947 13.941 -1.319 1.00 0.00 C ATOM 124 CD1 LEU p 8 -4.926 14.687 -2.164 1.00 0.00 C ATOM 125 CD2 LEU p 8 -5.765 12.440 -1.482 1.00 0.00 C ATOM 0 H LEU p 8 -5.120 15.092 2.437 1.00 0.00 H new ATOM 0 HA LEU p 8 -5.370 12.506 1.093 1.00 0.00 H new ATOM 0 HB2 LEU p 8 -6.849 14.406 0.575 1.00 0.00 H new ATOM 0 HB3 LEU p 8 -5.455 15.393 0.187 1.00 0.00 H new ATOM 0 HG LEU p 8 -6.950 14.194 -1.663 1.00 0.00 H new ATOM 0 HD11 LEU p 8 -5.014 14.372 -3.204 1.00 0.00 H new ATOM 0 HD12 LEU p 8 -5.109 15.759 -2.093 1.00 0.00 H new ATOM 0 HD13 LEU p 8 -3.922 14.466 -1.801 1.00 0.00 H new ATOM 0 HD21 LEU p 8 -5.847 12.176 -2.536 1.00 0.00 H new ATOM 0 HD22 LEU p 8 -4.782 12.150 -1.111 1.00 0.00 H new ATOM 0 HD23 LEU p 8 -6.536 11.916 -0.916 1.00 0.00 H new ATOM 137 N ALA p 9 -2.780 14.509 1.213 1.00 0.00 N ATOM 138 CA ALA p 9 -1.336 14.660 1.006 1.00 0.00 C ATOM 139 C ALA p 9 -0.652 13.799 2.043 1.00 0.00 C ATOM 140 O ALA p 9 0.536 13.491 1.949 1.00 0.00 O ATOM 141 CB ALA p 9 -0.871 16.105 1.111 1.00 0.00 C ATOM 0 H ALA p 9 -3.184 15.245 1.792 1.00 0.00 H new ATOM 0 HA ALA p 9 -1.080 14.347 -0.006 1.00 0.00 H new ATOM 0 HB1 ALA p 9 0.206 16.153 0.949 1.00 0.00 H new ATOM 0 HB2 ALA p 9 -1.379 16.706 0.357 1.00 0.00 H new ATOM 0 HB3 ALA p 9 -1.106 16.492 2.103 1.00 0.00 H new ATOM 147 N GLN p 10 -1.466 13.438 3.053 1.00 0.00 N ATOM 148 CA GLN p 10 -1.089 12.536 4.109 1.00 0.00 C ATOM 149 C GLN p 10 -1.398 11.159 3.563 1.00 0.00 C ATOM 150 O GLN p 10 -0.755 10.184 3.906 1.00 0.00 O ATOM 151 CB GLN p 10 -1.892 12.844 5.375 1.00 0.00 C ATOM 152 CG GLN p 10 -2.160 11.658 6.282 1.00 0.00 C ATOM 153 CD GLN p 10 -1.431 11.751 7.609 1.00 0.00 C ATOM 154 OE1 GLN p 10 -0.300 11.283 7.743 1.00 0.00 O ATOM 155 NE2 GLN p 10 -2.077 12.358 8.596 1.00 0.00 N ATOM 0 H GLN p 10 -2.421 13.784 3.141 1.00 0.00 H new ATOM 0 HA GLN p 10 -0.040 12.623 4.392 1.00 0.00 H new ATOM 0 HB2 GLN p 10 -1.359 13.604 5.947 1.00 0.00 H new ATOM 0 HB3 GLN p 10 -2.848 13.278 5.082 1.00 0.00 H new ATOM 0 HG2 GLN p 10 -3.232 11.584 6.467 1.00 0.00 H new ATOM 0 HG3 GLN p 10 -1.860 10.742 5.772 1.00 0.00 H new ATOM 0 HE21 GLN p 10 -3.013 12.731 8.439 1.00 0.00 H new ATOM 0 HE22 GLN p 10 -1.637 12.452 9.512 1.00 0.00 H new ATOM 164 N ASN p 11 -2.410 11.162 2.676 1.00 0.00 N ATOM 165 CA ASN p 11 -2.877 9.988 1.944 1.00 0.00 C ATOM 166 C ASN p 11 -1.989 9.825 0.724 1.00 0.00 C ATOM 167 O ASN p 11 -1.953 8.764 0.107 1.00 0.00 O ATOM 168 CB ASN p 11 -4.344 10.124 1.530 1.00 0.00 C ATOM 169 CG ASN p 11 -5.034 8.779 1.379 1.00 0.00 C ATOM 170 OD1 ASN p 11 -5.006 8.171 0.310 1.00 0.00 O ATOM 171 ND2 ASN p 11 -5.661 8.313 2.453 1.00 0.00 N ATOM 0 H ASN p 11 -2.934 12.007 2.448 1.00 0.00 H new ATOM 0 HA ASN p 11 -2.817 9.109 2.585 1.00 0.00 H new ATOM 0 HB2 ASN p 11 -4.874 10.719 2.274 1.00 0.00 H new ATOM 0 HB3 ASN p 11 -4.403 10.667 0.587 1.00 0.00 H new ATOM 0 HD21 ASN p 11 -6.145 7.416 2.412 1.00 0.00 H new ATOM 0 HD22 ASN p 11 -5.658 8.852 3.319 1.00 0.00 H new ATOM 178 N GLU p 12 -1.305 10.936 0.385 1.00 0.00 N ATOM 179 CA GLU p 12 -0.301 10.976 -0.691 1.00 0.00 C ATOM 180 C GLU p 12 0.987 10.598 -0.030 1.00 0.00 C ATOM 181 O GLU p 12 1.956 10.174 -0.654 1.00 0.00 O ATOM 182 CB GLU p 12 -0.146 12.355 -1.320 1.00 0.00 C ATOM 183 CG GLU p 12 -1.425 12.844 -1.929 1.00 0.00 C ATOM 184 CD GLU p 12 -1.246 13.433 -3.315 1.00 0.00 C ATOM 185 OE1 GLU p 12 -1.005 14.654 -3.414 1.00 0.00 O ATOM 186 OE2 GLU p 12 -1.347 12.672 -4.300 1.00 0.00 O ATOM 0 H GLU p 12 -1.436 11.833 0.853 1.00 0.00 H new ATOM 0 HA GLU p 12 -0.600 10.310 -1.500 1.00 0.00 H new ATOM 0 HB2 GLU p 12 0.188 13.063 -0.562 1.00 0.00 H new ATOM 0 HB3 GLU p 12 0.629 12.319 -2.086 1.00 0.00 H new ATOM 0 HG2 GLU p 12 -2.133 12.017 -1.983 1.00 0.00 H new ATOM 0 HG3 GLU p 12 -1.865 13.598 -1.276 1.00 0.00 H new ATOM 193 N TRP p 13 0.926 10.820 1.280 1.00 0.00 N ATOM 194 CA TRP p 13 1.995 10.486 2.221 1.00 0.00 C ATOM 195 C TRP p 13 1.804 9.040 2.673 1.00 0.00 C ATOM 196 O TRP p 13 2.739 8.401 3.141 1.00 0.00 O ATOM 197 CB TRP p 13 2.022 11.423 3.428 1.00 0.00 C ATOM 198 CG TRP p 13 3.382 11.554 4.058 1.00 0.00 C ATOM 199 CD1 TRP p 13 4.348 12.463 3.732 1.00 0.00 C ATOM 200 CD2 TRP p 13 3.927 10.754 5.121 1.00 0.00 C ATOM 201 NE1 TRP p 13 5.457 12.279 4.521 1.00 0.00 N ATOM 202 CE2 TRP p 13 5.224 11.239 5.381 1.00 0.00 C ATOM 203 CE3 TRP p 13 3.447 9.678 5.880 1.00 0.00 C ATOM 204 CZ2 TRP p 13 6.044 10.686 6.363 1.00 0.00 C ATOM 205 CZ3 TRP p 13 4.263 9.132 6.853 1.00 0.00 C ATOM 206 CH2 TRP p 13 5.548 9.637 7.086 1.00 0.00 C ATOM 0 H TRP p 13 0.115 11.246 1.728 1.00 0.00 H new ATOM 0 HA TRP p 13 2.953 10.607 1.715 1.00 0.00 H new ATOM 0 HB2 TRP p 13 1.677 12.410 3.119 1.00 0.00 H new ATOM 0 HB3 TRP p 13 1.318 11.059 4.176 1.00 0.00 H new ATOM 0 HD1 TRP p 13 4.253 13.217 2.965 1.00 0.00 H new ATOM 0 HE1 TRP p 13 6.315 12.828 4.474 1.00 0.00 H new ATOM 0 HE3 TRP p 13 2.457 9.282 5.708 1.00 0.00 H new ATOM 0 HZ2 TRP p 13 7.036 11.072 6.546 1.00 0.00 H new ATOM 0 HZ3 TRP p 13 3.903 8.302 7.443 1.00 0.00 H new ATOM 0 HH2 TRP p 13 6.161 9.188 7.854 1.00 0.00 H new ATOM 217 N GLU p 14 0.546 8.572 2.549 1.00 0.00 N ATOM 218 CA GLU p 14 0.164 7.171 2.837 1.00 0.00 C ATOM 219 C GLU p 14 0.249 6.436 1.535 1.00 0.00 C ATOM 220 O GLU p 14 0.215 5.216 1.475 1.00 0.00 O ATOM 221 CB GLU p 14 -1.247 7.021 3.393 1.00 0.00 C ATOM 222 CG GLU p 14 -1.492 7.904 4.577 1.00 0.00 C ATOM 223 CD GLU p 14 -2.214 7.204 5.714 1.00 0.00 C ATOM 224 OE1 GLU p 14 -1.530 6.623 6.583 1.00 0.00 O ATOM 225 OE2 GLU p 14 -3.462 7.239 5.735 1.00 0.00 O ATOM 0 H GLU p 14 -0.236 9.153 2.246 1.00 0.00 H new ATOM 0 HA GLU p 14 0.834 6.780 3.603 1.00 0.00 H new ATOM 0 HB2 GLU p 14 -1.969 7.257 2.612 1.00 0.00 H new ATOM 0 HB3 GLU p 14 -1.414 5.982 3.678 1.00 0.00 H new ATOM 0 HG2 GLU p 14 -0.537 8.283 4.942 1.00 0.00 H new ATOM 0 HG3 GLU p 14 -2.078 8.767 4.262 1.00 0.00 H new ATOM 232 N LEU p 15 0.273 7.271 0.503 1.00 0.00 N ATOM 233 CA LEU p 15 0.455 6.867 -0.892 1.00 0.00 C ATOM 234 C LEU p 15 1.958 6.779 -1.118 1.00 0.00 C ATOM 235 O LEU p 15 2.445 6.071 -1.994 1.00 0.00 O ATOM 236 CB LEU p 15 -0.175 7.895 -1.856 1.00 0.00 C ATOM 237 CG LEU p 15 -0.105 7.618 -3.378 1.00 0.00 C ATOM 238 CD1 LEU p 15 1.119 8.291 -3.974 1.00 0.00 C ATOM 239 CD2 LEU p 15 -0.089 6.130 -3.678 1.00 0.00 C ATOM 0 H LEU p 15 0.163 8.279 0.614 1.00 0.00 H new ATOM 0 HA LEU p 15 -0.036 5.913 -1.086 1.00 0.00 H new ATOM 0 HB2 LEU p 15 -1.226 8.002 -1.586 1.00 0.00 H new ATOM 0 HB3 LEU p 15 0.301 8.858 -1.672 1.00 0.00 H new ATOM 0 HG LEU p 15 -1.003 8.035 -3.835 1.00 0.00 H new ATOM 0 HD11 LEU p 15 1.159 8.090 -5.045 1.00 0.00 H new ATOM 0 HD12 LEU p 15 1.060 9.367 -3.808 1.00 0.00 H new ATOM 0 HD13 LEU p 15 2.018 7.900 -3.497 1.00 0.00 H new ATOM 0 HD21 LEU p 15 -0.040 5.977 -4.756 1.00 0.00 H new ATOM 0 HD22 LEU p 15 0.781 5.673 -3.206 1.00 0.00 H new ATOM 0 HD23 LEU p 15 -0.997 5.670 -3.287 1.00 0.00 H new ATOM 251 N GLN p 16 2.641 7.560 -0.284 1.00 0.00 N ATOM 252 CA GLN p 16 4.063 7.666 -0.198 1.00 0.00 C ATOM 253 C GLN p 16 4.533 6.589 0.751 1.00 0.00 C ATOM 254 O GLN p 16 5.624 6.057 0.629 1.00 0.00 O ATOM 255 CB GLN p 16 4.362 9.020 0.385 1.00 0.00 C ATOM 256 CG GLN p 16 5.812 9.337 0.466 1.00 0.00 C ATOM 257 CD GLN p 16 6.225 10.513 -0.397 1.00 0.00 C ATOM 258 OE1 GLN p 16 6.209 11.660 0.047 1.00 0.00 O ATOM 259 NE2 GLN p 16 6.597 10.231 -1.642 1.00 0.00 N ATOM 0 H GLN p 16 2.168 8.168 0.385 1.00 0.00 H new ATOM 0 HA GLN p 16 4.554 7.552 -1.164 1.00 0.00 H new ATOM 0 HB2 GLN p 16 3.867 9.781 -0.218 1.00 0.00 H new ATOM 0 HB3 GLN p 16 3.932 9.077 1.385 1.00 0.00 H new ATOM 0 HG2 GLN p 16 6.072 9.549 1.503 1.00 0.00 H new ATOM 0 HG3 GLN p 16 6.385 8.459 0.167 1.00 0.00 H new ATOM 0 HE21 GLN p 16 6.595 9.265 -1.968 1.00 0.00 H new ATOM 0 HE22 GLN p 16 6.884 10.981 -2.271 1.00 0.00 H new ATOM 268 N ALA p 17 3.670 6.382 1.741 1.00 0.00 N ATOM 269 CA ALA p 17 3.816 5.342 2.766 1.00 0.00 C ATOM 270 C ALA p 17 3.296 4.038 2.194 1.00 0.00 C ATOM 271 O ALA p 17 3.546 2.967 2.735 1.00 0.00 O ATOM 272 CB ALA p 17 3.092 5.690 4.059 1.00 0.00 C ATOM 0 H ALA p 17 2.827 6.944 1.860 1.00 0.00 H new ATOM 0 HA ALA p 17 4.871 5.253 3.026 1.00 0.00 H new ATOM 0 HB1 ALA p 17 3.233 4.887 4.782 1.00 0.00 H new ATOM 0 HB2 ALA p 17 3.496 6.618 4.464 1.00 0.00 H new ATOM 0 HB3 ALA p 17 2.028 5.815 3.858 1.00 0.00 H new ATOM 278 N LEU p 18 2.524 4.185 1.099 1.00 0.00 N ATOM 279 CA LEU p 18 1.997 3.079 0.311 1.00 0.00 C ATOM 280 C LEU p 18 3.093 2.732 -0.671 1.00 0.00 C ATOM 281 O LEU p 18 3.298 1.584 -1.050 1.00 0.00 O ATOM 282 CB LEU p 18 0.761 3.538 -0.447 1.00 0.00 C ATOM 283 CG LEU p 18 -0.214 2.482 -0.948 1.00 0.00 C ATOM 284 CD1 LEU p 18 -1.422 3.208 -1.467 1.00 0.00 C ATOM 285 CD2 LEU p 18 0.398 1.640 -2.052 1.00 0.00 C ATOM 0 H LEU p 18 2.250 5.099 0.739 1.00 0.00 H new ATOM 0 HA LEU p 18 1.717 2.228 0.932 1.00 0.00 H new ATOM 0 HB2 LEU p 18 0.209 4.220 0.200 1.00 0.00 H new ATOM 0 HB3 LEU p 18 1.095 4.117 -1.308 1.00 0.00 H new ATOM 0 HG LEU p 18 -0.475 1.803 -0.136 1.00 0.00 H new ATOM 0 HD11 LEU p 18 -2.149 2.486 -1.837 1.00 0.00 H new ATOM 0 HD12 LEU p 18 -1.869 3.793 -0.663 1.00 0.00 H new ATOM 0 HD13 LEU p 18 -1.126 3.873 -2.278 1.00 0.00 H new ATOM 0 HD21 LEU p 18 -0.326 0.896 -2.386 1.00 0.00 H new ATOM 0 HD22 LEU p 18 0.672 2.282 -2.890 1.00 0.00 H new ATOM 0 HD23 LEU p 18 1.288 1.136 -1.675 1.00 0.00 H new ATOM 297 N GLU p 19 3.748 3.817 -1.088 1.00 0.00 N ATOM 298 CA GLU p 19 4.892 3.821 -1.949 1.00 0.00 C ATOM 299 C GLU p 19 6.070 3.279 -1.158 1.00 0.00 C ATOM 300 O GLU p 19 6.926 2.584 -1.678 1.00 0.00 O ATOM 301 CB GLU p 19 5.135 5.262 -2.316 1.00 0.00 C ATOM 302 CG GLU p 19 6.145 5.452 -3.384 1.00 0.00 C ATOM 303 CD GLU p 19 5.557 5.937 -4.694 1.00 0.00 C ATOM 304 OE1 GLU p 19 5.173 5.087 -5.524 1.00 0.00 O ATOM 305 OE2 GLU p 19 5.481 7.169 -4.890 1.00 0.00 O ATOM 0 H GLU p 19 3.466 4.757 -0.810 1.00 0.00 H new ATOM 0 HA GLU p 19 4.752 3.214 -2.843 1.00 0.00 H new ATOM 0 HB2 GLU p 19 4.194 5.708 -2.637 1.00 0.00 H new ATOM 0 HB3 GLU p 19 5.456 5.803 -1.426 1.00 0.00 H new ATOM 0 HG2 GLU p 19 6.892 6.169 -3.043 1.00 0.00 H new ATOM 0 HG3 GLU p 19 6.663 4.508 -3.555 1.00 0.00 H new ATOM 312 N LYS p 20 6.078 3.708 0.102 1.00 0.00 N ATOM 313 CA LYS p 20 7.045 3.300 1.119 1.00 0.00 C ATOM 314 C LYS p 20 6.658 1.933 1.660 1.00 0.00 C ATOM 315 O LYS p 20 7.446 1.272 2.330 1.00 0.00 O ATOM 316 CB LYS p 20 7.097 4.318 2.252 1.00 0.00 C ATOM 317 CG LYS p 20 8.493 4.820 2.569 1.00 0.00 C ATOM 318 CD LYS p 20 8.903 4.472 3.990 1.00 0.00 C ATOM 319 CE LYS p 20 10.267 5.049 4.333 1.00 0.00 C ATOM 320 NZ LYS p 20 10.644 4.779 5.748 1.00 0.00 N ATOM 0 H LYS p 20 5.388 4.371 0.455 1.00 0.00 H new ATOM 0 HA LYS p 20 8.035 3.246 0.666 1.00 0.00 H new ATOM 0 HB2 LYS p 20 6.467 5.168 1.991 1.00 0.00 H new ATOM 0 HB3 LYS p 20 6.671 3.869 3.149 1.00 0.00 H new ATOM 0 HG2 LYS p 20 9.205 4.385 1.867 1.00 0.00 H new ATOM 0 HG3 LYS p 20 8.531 5.901 2.433 1.00 0.00 H new ATOM 0 HD2 LYS p 20 8.159 4.854 4.689 1.00 0.00 H new ATOM 0 HD3 LYS p 20 8.925 3.389 4.109 1.00 0.00 H new ATOM 0 HE2 LYS p 20 11.019 4.622 3.669 1.00 0.00 H new ATOM 0 HE3 LYS p 20 10.261 6.125 4.158 1.00 0.00 H new ATOM 0 HZ1 LYS p 20 11.676 4.856 5.853 1.00 0.00 H new ATOM 0 HZ2 LYS p 20 10.180 5.472 6.369 1.00 0.00 H new ATOM 0 HZ3 LYS p 20 10.340 3.820 6.011 1.00 0.00 H new ATOM 334 N GLU p 21 5.399 1.560 1.375 1.00 0.00 N ATOM 335 CA GLU p 21 4.844 0.258 1.699 1.00 0.00 C ATOM 336 C GLU p 21 5.209 -0.612 0.513 1.00 0.00 C ATOM 337 O GLU p 21 5.434 -1.820 0.626 1.00 0.00 O ATOM 338 CB GLU p 21 3.326 0.356 1.909 1.00 0.00 C ATOM 339 CG GLU p 21 2.522 -0.860 1.477 1.00 0.00 C ATOM 340 CD GLU p 21 1.890 -1.594 2.643 1.00 0.00 C ATOM 341 OE1 GLU p 21 2.541 -2.508 3.192 1.00 0.00 O ATOM 342 OE2 GLU p 21 0.744 -1.256 3.009 1.00 0.00 O ATOM 0 H GLU p 21 4.735 2.175 0.904 1.00 0.00 H new ATOM 0 HA GLU p 21 5.235 -0.155 2.629 1.00 0.00 H new ATOM 0 HB2 GLU p 21 3.135 0.538 2.966 1.00 0.00 H new ATOM 0 HB3 GLU p 21 2.957 1.225 1.364 1.00 0.00 H new ATOM 0 HG2 GLU p 21 1.740 -0.545 0.786 1.00 0.00 H new ATOM 0 HG3 GLU p 21 3.172 -1.545 0.933 1.00 0.00 H new ATOM 349 N LEU p 22 5.245 0.076 -0.637 1.00 0.00 N ATOM 350 CA LEU p 22 5.681 -0.512 -1.901 1.00 0.00 C ATOM 351 C LEU p 22 7.185 -0.623 -1.845 1.00 0.00 C ATOM 352 O LEU p 22 7.788 -1.619 -2.253 1.00 0.00 O ATOM 353 CB LEU p 22 5.305 0.405 -3.052 1.00 0.00 C ATOM 354 CG LEU p 22 4.309 -0.131 -4.061 1.00 0.00 C ATOM 355 CD1 LEU p 22 2.939 -0.265 -3.425 1.00 0.00 C ATOM 356 CD2 LEU p 22 4.279 0.822 -5.230 1.00 0.00 C ATOM 0 H LEU p 22 4.972 1.056 -0.712 1.00 0.00 H new ATOM 0 HA LEU p 22 5.211 -1.484 -2.052 1.00 0.00 H new ATOM 0 HB2 LEU p 22 4.900 1.326 -2.633 1.00 0.00 H new ATOM 0 HB3 LEU p 22 6.218 0.671 -3.585 1.00 0.00 H new ATOM 0 HG LEU p 22 4.603 -1.123 -4.404 1.00 0.00 H new ATOM 0 HD11 LEU p 22 2.233 -0.651 -4.160 1.00 0.00 H new ATOM 0 HD12 LEU p 22 2.995 -0.952 -2.581 1.00 0.00 H new ATOM 0 HD13 LEU p 22 2.603 0.711 -3.076 1.00 0.00 H new ATOM 0 HD21 LEU p 22 3.569 0.462 -5.975 1.00 0.00 H new ATOM 0 HD22 LEU p 22 3.974 1.810 -4.886 1.00 0.00 H new ATOM 0 HD23 LEU p 22 5.272 0.883 -5.675 1.00 0.00 H new ATOM 368 N ALA p 23 7.752 0.457 -1.311 1.00 0.00 N ATOM 369 CA ALA p 23 9.200 0.574 -1.091 1.00 0.00 C ATOM 370 C ALA p 23 9.624 -0.254 0.119 1.00 0.00 C ATOM 371 O ALA p 23 10.808 -0.478 0.327 1.00 0.00 O ATOM 372 CB ALA p 23 9.637 2.025 -0.925 1.00 0.00 C ATOM 0 H ALA p 23 7.224 1.279 -1.017 1.00 0.00 H new ATOM 0 HA ALA p 23 9.697 0.185 -1.979 1.00 0.00 H new ATOM 0 HB1 ALA p 23 10.714 2.064 -0.765 1.00 0.00 H new ATOM 0 HB2 ALA p 23 9.383 2.587 -1.824 1.00 0.00 H new ATOM 0 HB3 ALA p 23 9.126 2.463 -0.067 1.00 0.00 H new ATOM 378 N GLN p 24 8.620 -0.704 0.899 1.00 0.00 N ATOM 379 CA GLN p 24 8.797 -1.538 2.080 1.00 0.00 C ATOM 380 C GLN p 24 9.146 -2.960 1.645 1.00 0.00 C ATOM 381 O GLN p 24 9.875 -3.669 2.321 1.00 0.00 O ATOM 382 CB GLN p 24 7.487 -1.516 2.870 1.00 0.00 C ATOM 383 CG GLN p 24 7.268 -2.696 3.784 1.00 0.00 C ATOM 384 CD GLN p 24 7.353 -2.337 5.255 1.00 0.00 C ATOM 385 OE1 GLN p 24 8.425 -2.391 5.858 1.00 0.00 O ATOM 386 NE2 GLN p 24 6.220 -1.966 5.839 1.00 0.00 N ATOM 0 H GLN p 24 7.642 -0.485 0.710 1.00 0.00 H new ATOM 0 HA GLN p 24 9.608 -1.166 2.707 1.00 0.00 H new ATOM 0 HB2 GLN p 24 7.456 -0.604 3.467 1.00 0.00 H new ATOM 0 HB3 GLN p 24 6.657 -1.464 2.165 1.00 0.00 H new ATOM 0 HG2 GLN p 24 6.289 -3.130 3.579 1.00 0.00 H new ATOM 0 HG3 GLN p 24 8.010 -3.463 3.560 1.00 0.00 H new ATOM 0 HE21 GLN p 24 5.355 -1.936 5.300 1.00 0.00 H new ATOM 0 HE22 GLN p 24 6.215 -1.711 6.827 1.00 0.00 H new ATOM 395 N LEU p 25 8.608 -3.308 0.480 1.00 0.00 N ATOM 396 CA LEU p 25 8.789 -4.597 -0.180 1.00 0.00 C ATOM 397 C LEU p 25 10.174 -4.621 -0.736 1.00 0.00 C ATOM 398 O LEU p 25 10.905 -5.555 -0.543 1.00 0.00 O ATOM 399 CB LEU p 25 7.792 -4.734 -1.327 1.00 0.00 C ATOM 400 CG LEU p 25 6.567 -5.600 -1.081 1.00 0.00 C ATOM 401 CD1 LEU p 25 5.546 -4.876 -0.220 1.00 0.00 C ATOM 402 CD2 LEU p 25 5.973 -5.964 -2.418 1.00 0.00 C ATOM 0 H LEU p 25 8.010 -2.675 -0.051 1.00 0.00 H new ATOM 0 HA LEU p 25 8.631 -5.413 0.525 1.00 0.00 H new ATOM 0 HB2 LEU p 25 7.451 -3.735 -1.600 1.00 0.00 H new ATOM 0 HB3 LEU p 25 8.323 -5.136 -2.190 1.00 0.00 H new ATOM 0 HG LEU p 25 6.858 -6.501 -0.541 1.00 0.00 H new ATOM 0 HD11 LEU p 25 4.681 -5.520 -0.061 1.00 0.00 H new ATOM 0 HD12 LEU p 25 5.993 -4.626 0.742 1.00 0.00 H new ATOM 0 HD13 LEU p 25 5.230 -3.962 -0.722 1.00 0.00 H new ATOM 0 HD21 LEU p 25 5.091 -6.586 -2.267 1.00 0.00 H new ATOM 0 HD22 LEU p 25 5.689 -5.056 -2.950 1.00 0.00 H new ATOM 0 HD23 LEU p 25 6.709 -6.513 -3.005 1.00 0.00 H new ATOM 414 N GLU p 26 10.466 -3.537 -1.444 1.00 0.00 N ATOM 415 CA GLU p 26 11.766 -3.223 -2.027 1.00 0.00 C ATOM 416 C GLU p 26 12.738 -2.981 -0.891 1.00 0.00 C ATOM 417 O GLU p 26 13.948 -3.000 -1.048 1.00 0.00 O ATOM 418 CB GLU p 26 11.650 -1.983 -2.902 1.00 0.00 C ATOM 419 CG GLU p 26 10.405 -1.982 -3.772 1.00 0.00 C ATOM 420 CD GLU p 26 10.698 -1.664 -5.226 1.00 0.00 C ATOM 421 OE1 GLU p 26 10.673 -0.469 -5.587 1.00 0.00 O ATOM 422 OE2 GLU p 26 10.951 -2.610 -6.001 1.00 0.00 O ATOM 0 H GLU p 26 9.769 -2.818 -1.637 1.00 0.00 H new ATOM 0 HA GLU p 26 12.119 -4.045 -2.650 1.00 0.00 H new ATOM 0 HB2 GLU p 26 11.643 -1.097 -2.267 1.00 0.00 H new ATOM 0 HB3 GLU p 26 12.531 -1.912 -3.539 1.00 0.00 H new ATOM 0 HG2 GLU p 26 9.924 -2.958 -3.709 1.00 0.00 H new ATOM 0 HG3 GLU p 26 9.696 -1.252 -3.382 1.00 0.00 H new ATOM 429 N LYS p 27 12.149 -2.671 0.251 1.00 0.00 N ATOM 430 CA LYS p 27 12.905 -2.536 1.503 1.00 0.00 C ATOM 431 C LYS p 27 13.147 -3.941 2.031 1.00 0.00 C ATOM 432 O LYS p 27 14.109 -4.204 2.757 1.00 0.00 O ATOM 433 CB LYS p 27 12.189 -1.703 2.560 1.00 0.00 C ATOM 434 CG LYS p 27 12.608 -0.241 2.579 1.00 0.00 C ATOM 435 CD LYS p 27 12.243 0.427 3.894 1.00 0.00 C ATOM 436 CE LYS p 27 12.710 1.874 3.932 1.00 0.00 C ATOM 437 NZ LYS p 27 12.401 2.522 5.237 1.00 0.00 N ATOM 0 H LYS p 27 11.147 -2.506 0.346 1.00 0.00 H new ATOM 0 HA LYS p 27 13.834 -2.007 1.291 1.00 0.00 H new ATOM 0 HB2 LYS p 27 11.114 -1.761 2.388 1.00 0.00 H new ATOM 0 HB3 LYS p 27 12.378 -2.138 3.541 1.00 0.00 H new ATOM 0 HG2 LYS p 27 13.684 -0.168 2.419 1.00 0.00 H new ATOM 0 HG3 LYS p 27 12.127 0.287 1.756 1.00 0.00 H new ATOM 0 HD2 LYS p 27 11.163 0.388 4.036 1.00 0.00 H new ATOM 0 HD3 LYS p 27 12.693 -0.124 4.720 1.00 0.00 H new ATOM 0 HE2 LYS p 27 13.784 1.914 3.752 1.00 0.00 H new ATOM 0 HE3 LYS p 27 12.231 2.432 3.127 1.00 0.00 H new ATOM 0 HZ1 LYS p 27 12.673 3.525 5.200 1.00 0.00 H new ATOM 0 HZ2 LYS p 27 11.382 2.447 5.429 1.00 0.00 H new ATOM 0 HZ3 LYS p 27 12.932 2.047 5.995 1.00 0.00 H new ATOM 451 N GLU p 28 12.220 -4.829 1.656 1.00 0.00 N ATOM 452 CA GLU p 28 12.327 -6.262 1.991 1.00 0.00 C ATOM 453 C GLU p 28 12.980 -6.996 0.833 1.00 0.00 C ATOM 454 O GLU p 28 13.762 -7.932 1.011 1.00 0.00 O ATOM 455 CB GLU p 28 10.953 -6.900 2.239 1.00 0.00 C ATOM 456 CG GLU p 28 10.094 -6.149 3.222 1.00 0.00 C ATOM 457 CD GLU p 28 9.757 -6.958 4.460 1.00 0.00 C ATOM 458 OE1 GLU p 28 8.726 -7.662 4.447 1.00 0.00 O ATOM 459 OE2 GLU p 28 10.524 -6.887 5.443 1.00 0.00 O ATOM 0 H GLU p 28 11.386 -4.586 1.121 1.00 0.00 H new ATOM 0 HA GLU p 28 12.919 -6.342 2.903 1.00 0.00 H new ATOM 0 HB2 GLU p 28 10.422 -6.973 1.290 1.00 0.00 H new ATOM 0 HB3 GLU p 28 11.097 -7.918 2.602 1.00 0.00 H new ATOM 0 HG2 GLU p 28 10.609 -5.236 3.521 1.00 0.00 H new ATOM 0 HG3 GLU p 28 9.169 -5.847 2.730 1.00 0.00 H new ATOM 466 N LEU p 29 12.612 -6.534 -0.357 1.00 0.00 N ATOM 467 CA LEU p 29 13.084 -7.082 -1.621 1.00 0.00 C ATOM 468 C LEU p 29 14.455 -6.568 -2.021 1.00 0.00 C ATOM 469 O LEU p 29 15.373 -7.356 -2.265 1.00 0.00 O ATOM 470 CB LEU p 29 12.090 -6.719 -2.728 1.00 0.00 C ATOM 471 CG LEU p 29 11.465 -7.869 -3.500 1.00 0.00 C ATOM 472 CD1 LEU p 29 10.415 -7.305 -4.431 1.00 0.00 C ATOM 473 CD2 LEU p 29 12.527 -8.623 -4.278 1.00 0.00 C ATOM 0 H LEU p 29 11.965 -5.754 -0.471 1.00 0.00 H new ATOM 0 HA LEU p 29 13.163 -8.161 -1.487 1.00 0.00 H new ATOM 0 HB2 LEU p 29 11.286 -6.134 -2.282 1.00 0.00 H new ATOM 0 HB3 LEU p 29 12.599 -6.070 -3.441 1.00 0.00 H new ATOM 0 HG LEU p 29 11.001 -8.573 -2.810 1.00 0.00 H new ATOM 0 HD11 LEU p 29 9.955 -8.117 -4.994 1.00 0.00 H new ATOM 0 HD12 LEU p 29 9.652 -6.789 -3.849 1.00 0.00 H new ATOM 0 HD13 LEU p 29 10.881 -6.602 -5.122 1.00 0.00 H new ATOM 0 HD21 LEU p 29 12.063 -9.444 -4.825 1.00 0.00 H new ATOM 0 HD22 LEU p 29 13.012 -7.946 -4.981 1.00 0.00 H new ATOM 0 HD23 LEU p 29 13.270 -9.022 -3.587 1.00 0.00 H new ATOM 485 N GLN p 30 14.578 -5.248 -2.082 1.00 0.00 N ATOM 486 CA GLN p 30 15.839 -4.617 -2.520 1.00 0.00 C ATOM 487 C GLN p 30 16.840 -4.384 -1.378 1.00 0.00 C ATOM 488 O GLN p 30 18.026 -4.698 -1.509 1.00 0.00 O ATOM 489 CB GLN p 30 15.514 -3.318 -3.298 1.00 0.00 C ATOM 490 CG GLN p 30 16.415 -2.120 -3.012 1.00 0.00 C ATOM 491 CD GLN p 30 17.301 -1.758 -4.187 1.00 0.00 C ATOM 492 OE1 GLN p 30 16.916 -0.966 -5.050 1.00 0.00 O ATOM 493 NE2 GLN p 30 18.497 -2.333 -4.228 1.00 0.00 N ATOM 0 H GLN p 30 13.836 -4.591 -1.839 1.00 0.00 H new ATOM 0 HA GLN p 30 16.349 -5.314 -3.185 1.00 0.00 H new ATOM 0 HB2 GLN p 30 15.562 -3.536 -4.365 1.00 0.00 H new ATOM 0 HB3 GLN p 30 14.485 -3.034 -3.077 1.00 0.00 H new ATOM 0 HG2 GLN p 30 15.797 -1.261 -2.750 1.00 0.00 H new ATOM 0 HG3 GLN p 30 17.039 -2.339 -2.146 1.00 0.00 H new ATOM 0 HE21 GLN p 30 18.776 -2.983 -3.493 1.00 0.00 H new ATOM 0 HE22 GLN p 30 19.137 -2.125 -4.995 1.00 0.00 H new ATOM 502 N ALA p 31 16.346 -3.840 -0.278 1.00 0.00 N ATOM 503 CA ALA p 31 17.176 -3.518 0.900 1.00 0.00 C ATOM 504 C ALA p 31 17.655 -4.754 1.671 1.00 0.00 C ATOM 505 O ALA p 31 18.805 -4.795 2.118 1.00 0.00 O ATOM 506 CB ALA p 31 16.426 -2.585 1.834 1.00 0.00 C ATOM 0 H ALA p 31 15.360 -3.604 -0.164 1.00 0.00 H new ATOM 0 HA ALA p 31 18.069 -3.026 0.515 1.00 0.00 H new ATOM 0 HB1 ALA p 31 17.050 -2.356 2.698 1.00 0.00 H new ATOM 0 HB2 ALA p 31 16.182 -1.662 1.308 1.00 0.00 H new ATOM 0 HB3 ALA p 31 15.507 -3.066 2.168 1.00 0.00 H new ATOM 512 N TRP p 32 16.775 -5.752 1.825 1.00 0.00 N ATOM 513 CA TRP p 32 17.112 -6.983 2.557 1.00 0.00 C ATOM 514 C TRP p 32 17.813 -8.008 1.653 1.00 0.00 C ATOM 515 O TRP p 32 18.666 -8.769 2.122 1.00 0.00 O ATOM 516 CB TRP p 32 15.848 -7.597 3.171 1.00 0.00 C ATOM 517 CG TRP p 32 16.108 -8.424 4.401 1.00 0.00 C ATOM 518 CD1 TRP p 32 16.561 -9.713 4.438 1.00 0.00 C ATOM 519 CD2 TRP p 32 15.925 -8.026 5.770 1.00 0.00 C ATOM 520 NE1 TRP p 32 16.675 -10.138 5.739 1.00 0.00 N ATOM 521 CE2 TRP p 32 16.290 -9.122 6.575 1.00 0.00 C ATOM 522 CE3 TRP p 32 15.491 -6.848 6.396 1.00 0.00 C ATOM 523 CZ2 TRP p 32 16.235 -9.078 7.965 1.00 0.00 C ATOM 524 CZ3 TRP p 32 15.436 -6.808 7.776 1.00 0.00 C ATOM 525 CH2 TRP p 32 15.807 -7.916 8.547 1.00 0.00 C ATOM 0 H TRP p 32 15.825 -5.733 1.454 1.00 0.00 H new ATOM 0 HA TRP p 32 17.806 -6.715 3.354 1.00 0.00 H new ATOM 0 HB2 TRP p 32 15.153 -6.796 3.424 1.00 0.00 H new ATOM 0 HB3 TRP p 32 15.358 -8.220 2.423 1.00 0.00 H new ATOM 0 HD1 TRP p 32 16.795 -10.311 3.570 1.00 0.00 H new ATOM 0 HE1 TRP p 32 16.994 -11.060 6.035 1.00 0.00 H new ATOM 0 HE3 TRP p 32 15.205 -5.987 5.810 1.00 0.00 H new ATOM 0 HZ2 TRP p 32 16.520 -9.931 8.563 1.00 0.00 H new ATOM 0 HZ3 TRP p 32 15.101 -5.907 8.268 1.00 0.00 H new ATOM 0 HH2 TRP p 32 15.754 -7.852 9.624 1.00 0.00 H new ATOM 536 N ASN p 33 17.446 -8.017 0.367 1.00 0.00 N ATOM 537 CA ASN p 33 18.034 -8.944 -0.603 1.00 0.00 C ATOM 538 C ASN p 33 18.629 -8.182 -1.785 1.00 0.00 C ATOM 539 O ASN p 33 18.000 -7.261 -2.315 1.00 0.00 O ATOM 540 CB ASN p 33 16.984 -9.945 -1.099 1.00 0.00 C ATOM 541 CG ASN p 33 16.455 -10.841 0.009 1.00 0.00 C ATOM 542 OD1 ASN p 33 17.005 -11.908 0.278 1.00 0.00 O ATOM 543 ND2 ASN p 33 15.379 -10.408 0.656 1.00 0.00 N ATOM 0 H ASN p 33 16.743 -7.391 -0.026 1.00 0.00 H new ATOM 0 HA ASN p 33 18.833 -9.493 -0.104 1.00 0.00 H new ATOM 0 HB2 ASN p 33 16.153 -9.401 -1.548 1.00 0.00 H new ATOM 0 HB3 ASN p 33 17.420 -10.564 -1.883 1.00 0.00 H new ATOM 0 HD21 ASN p 33 14.977 -10.967 1.409 1.00 0.00 H new ATOM 0 HD22 ASN p 33 14.954 -9.517 0.400 1.00 0.00 H new ATOM 550 N CYS p 34 19.843 -8.572 -2.185 1.00 0.00 N ATOM 551 CA CYS p 34 20.538 -7.932 -3.306 1.00 0.00 C ATOM 552 C CYS p 34 20.933 -8.955 -4.373 1.00 0.00 C ATOM 553 O CYS p 34 20.707 -8.728 -5.566 1.00 0.00 O ATOM 554 CB CYS p 34 21.776 -7.182 -2.804 1.00 0.00 C ATOM 555 SG CYS p 34 21.412 -5.866 -1.618 1.00 0.00 S ATOM 0 H CYS p 34 20.366 -9.330 -1.747 1.00 0.00 H new ATOM 0 HA CYS p 34 19.852 -7.219 -3.763 1.00 0.00 H new ATOM 0 HB2 CYS p 34 22.457 -7.896 -2.341 1.00 0.00 H new ATOM 0 HB3 CYS p 34 22.298 -6.752 -3.659 1.00 0.00 H new ATOM 0 HG CYS p 34 20.159 -5.534 -1.710 1.00 0.00 H new ATOM 561 N ILE p 35 21.520 -10.076 -3.935 1.00 0.00 N ATOM 562 CA ILE p 35 21.951 -11.144 -4.847 1.00 0.00 C ATOM 563 C ILE p 35 20.955 -12.308 -4.851 1.00 0.00 C ATOM 564 O ILE p 35 20.573 -12.801 -5.917 1.00 0.00 O ATOM 565 CB ILE p 35 23.381 -11.674 -4.522 1.00 0.00 C ATOM 566 CG1 ILE p 35 23.584 -11.918 -3.010 1.00 0.00 C ATOM 567 CG2 ILE p 35 24.428 -10.700 -5.049 1.00 0.00 C ATOM 568 CD1 ILE p 35 24.369 -13.177 -2.693 1.00 0.00 C ATOM 0 H ILE p 35 21.708 -10.268 -2.951 1.00 0.00 H new ATOM 0 HA ILE p 35 21.983 -10.696 -5.840 1.00 0.00 H new ATOM 0 HB ILE p 35 23.497 -12.637 -5.020 1.00 0.00 H new ATOM 0 HG12 ILE p 35 24.101 -11.061 -2.579 1.00 0.00 H new ATOM 0 HG13 ILE p 35 22.609 -11.978 -2.527 1.00 0.00 H new ATOM 0 HG21 ILE p 35 25.424 -11.077 -4.818 1.00 0.00 H new ATOM 0 HG22 ILE p 35 24.320 -10.598 -6.129 1.00 0.00 H new ATOM 0 HG23 ILE p 35 24.290 -9.727 -4.577 1.00 0.00 H new ATOM 0 HD11 ILE p 35 24.470 -13.280 -1.613 1.00 0.00 H new ATOM 0 HD12 ILE p 35 23.843 -14.044 -3.093 1.00 0.00 H new ATOM 0 HD13 ILE p 35 25.358 -13.113 -3.146 1.00 0.00 H new ATOM 580 N CYS p 36 20.546 -12.735 -3.651 1.00 0.00 N ATOM 581 CA CYS p 36 19.594 -13.832 -3.493 1.00 0.00 C ATOM 582 C CYS p 36 18.418 -13.400 -2.625 1.00 0.00 C ATOM 583 O CYS p 36 18.593 -12.632 -1.674 1.00 0.00 O ATOM 584 CB CYS p 36 20.283 -15.048 -2.871 1.00 0.00 C ATOM 585 SG CYS p 36 21.654 -15.701 -3.851 1.00 0.00 S ATOM 0 H CYS p 36 20.865 -12.331 -2.770 1.00 0.00 H new ATOM 0 HA CYS p 36 19.218 -14.104 -4.479 1.00 0.00 H new ATOM 0 HB2 CYS p 36 20.654 -14.776 -1.883 1.00 0.00 H new ATOM 0 HB3 CYS p 36 19.545 -15.837 -2.728 1.00 0.00 H new ATOM 0 HG CYS p 36 22.173 -16.725 -3.242 1.00 0.00 H new ATOM 591 N ASP p 37 17.223 -13.897 -2.962 1.00 0.00 N ATOM 592 CA ASP p 37 16.003 -13.566 -2.223 1.00 0.00 C ATOM 593 C ASP p 37 15.648 -14.667 -1.228 1.00 0.00 C ATOM 594 O ASP p 37 15.766 -15.856 -1.537 1.00 0.00 O ATOM 595 CB ASP p 37 14.834 -13.343 -3.188 1.00 0.00 C ATOM 596 CG ASP p 37 14.975 -12.061 -3.988 1.00 0.00 C ATOM 597 OD1 ASP p 37 15.590 -12.102 -5.074 1.00 0.00 O ATOM 598 OD2 ASP p 37 14.469 -11.015 -3.527 1.00 0.00 O ATOM 0 H ASP p 37 17.076 -14.533 -3.746 1.00 0.00 H new ATOM 0 HA ASP p 37 16.189 -12.646 -1.669 1.00 0.00 H new ATOM 0 HB2 ASP p 37 14.766 -14.189 -3.872 1.00 0.00 H new ATOM 0 HB3 ASP p 37 13.902 -13.314 -2.624 1.00 0.00 H new ATOM 603 N ILE p 38 15.216 -14.251 -0.033 1.00 0.00 N ATOM 604 CA ILE p 38 14.833 -15.185 1.033 1.00 0.00 C ATOM 605 C ILE p 38 13.348 -15.049 1.387 1.00 0.00 C ATOM 606 O ILE p 38 12.715 -14.038 1.063 1.00 0.00 O ATOM 607 CB ILE p 38 15.703 -15.012 2.318 1.00 0.00 C ATOM 608 CG1 ILE p 38 15.836 -13.531 2.736 1.00 0.00 C ATOM 609 CG2 ILE p 38 17.081 -15.630 2.102 1.00 0.00 C ATOM 610 CD1 ILE p 38 15.769 -13.310 4.235 1.00 0.00 C ATOM 0 H ILE p 38 15.122 -13.268 0.222 1.00 0.00 H new ATOM 0 HA ILE p 38 15.014 -16.186 0.640 1.00 0.00 H new ATOM 0 HB ILE p 38 15.196 -15.531 3.131 1.00 0.00 H new ATOM 0 HG12 ILE p 38 16.783 -13.141 2.363 1.00 0.00 H new ATOM 0 HG13 ILE p 38 15.044 -12.955 2.257 1.00 0.00 H new ATOM 0 HG21 ILE p 38 17.681 -15.505 3.003 1.00 0.00 H new ATOM 0 HG22 ILE p 38 16.973 -16.692 1.883 1.00 0.00 H new ATOM 0 HG23 ILE p 38 17.575 -15.135 1.266 1.00 0.00 H new ATOM 0 HD11 ILE p 38 15.870 -12.246 4.451 1.00 0.00 H new ATOM 0 HD12 ILE p 38 14.811 -13.668 4.613 1.00 0.00 H new ATOM 0 HD13 ILE p 38 16.578 -13.857 4.720 1.00 0.00 H new ATOM 622 N GLU p 39 12.804 -16.076 2.054 1.00 0.00 N ATOM 623 CA GLU p 39 11.394 -16.091 2.459 1.00 0.00 C ATOM 624 C GLU p 39 11.218 -15.512 3.862 1.00 0.00 C ATOM 625 O GLU p 39 11.905 -15.924 4.803 1.00 0.00 O ATOM 626 CB GLU p 39 10.837 -17.519 2.413 1.00 0.00 C ATOM 627 CG GLU p 39 10.617 -18.050 1.004 1.00 0.00 C ATOM 628 CD GLU p 39 10.106 -19.477 0.992 1.00 0.00 C ATOM 629 OE1 GLU p 39 8.878 -19.669 1.119 1.00 0.00 O ATOM 630 OE2 GLU p 39 10.933 -20.403 0.858 1.00 0.00 O ATOM 0 H GLU p 39 13.323 -16.911 2.325 1.00 0.00 H new ATOM 0 HA GLU p 39 10.840 -15.469 1.756 1.00 0.00 H new ATOM 0 HB2 GLU p 39 11.523 -18.183 2.938 1.00 0.00 H new ATOM 0 HB3 GLU p 39 9.891 -17.547 2.953 1.00 0.00 H new ATOM 0 HG2 GLU p 39 9.905 -17.409 0.485 1.00 0.00 H new ATOM 0 HG3 GLU p 39 11.554 -17.999 0.450 1.00 0.00 H new ATOM 637 N ASN p 40 10.293 -14.556 3.985 1.00 0.00 N ATOM 638 CA ASN p 40 10.007 -13.903 5.263 1.00 0.00 C ATOM 639 C ASN p 40 8.587 -14.229 5.728 1.00 0.00 C ATOM 640 O ASN p 40 7.697 -14.471 4.906 1.00 0.00 O ATOM 641 CB ASN p 40 10.187 -12.385 5.132 1.00 0.00 C ATOM 642 CG ASN p 40 10.535 -11.718 6.451 1.00 0.00 C ATOM 643 OD1 ASN p 40 11.707 -11.579 6.800 1.00 0.00 O ATOM 644 ND2 ASN p 40 9.514 -11.301 7.192 1.00 0.00 N ATOM 0 H ASN p 40 9.726 -14.216 3.208 1.00 0.00 H new ATOM 0 HA ASN p 40 10.708 -14.279 6.008 1.00 0.00 H new ATOM 0 HB2 ASN p 40 10.974 -12.178 4.407 1.00 0.00 H new ATOM 0 HB3 ASN p 40 9.269 -11.947 4.740 1.00 0.00 H new ATOM 0 HD21 ASN p 40 9.687 -10.846 8.088 1.00 0.00 H new ATOM 0 HD22 ASN p 40 8.557 -11.436 6.865 1.00 0.00 H new ATOM 651 N CYS p 41 8.391 -14.227 7.050 1.00 0.00 N ATOM 652 CA CYS p 41 7.088 -14.521 7.645 1.00 0.00 C ATOM 653 C CYS p 41 6.383 -13.239 8.079 1.00 0.00 C ATOM 654 O CYS p 41 6.953 -12.425 8.813 1.00 0.00 O ATOM 655 CB CYS p 41 7.253 -15.463 8.841 1.00 0.00 C ATOM 656 SG CYS p 41 5.694 -16.045 9.550 1.00 0.00 S ATOM 0 H CYS p 41 9.124 -14.024 7.730 1.00 0.00 H new ATOM 0 HA CYS p 41 6.472 -15.010 6.890 1.00 0.00 H new ATOM 0 HB2 CYS p 41 7.842 -16.326 8.530 1.00 0.00 H new ATOM 0 HB3 CYS p 41 7.823 -14.951 9.616 1.00 0.00 H new ATOM 0 HG CYS p 41 5.941 -16.835 10.552 1.00 0.00 H new ATOM 662 N SER p 42 5.141 -13.071 7.613 1.00 0.00 N ATOM 663 CA SER p 42 4.330 -11.895 7.940 1.00 0.00 C ATOM 664 C SER p 42 2.924 -12.303 8.387 1.00 0.00 C ATOM 665 O SER p 42 2.384 -11.738 9.342 1.00 0.00 O ATOM 666 CB SER p 42 4.244 -10.953 6.735 1.00 0.00 C ATOM 667 OG SER p 42 5.530 -10.507 6.344 1.00 0.00 O ATOM 0 H SER p 42 4.673 -13.741 7.003 1.00 0.00 H new ATOM 0 HA SER p 42 4.814 -11.373 8.765 1.00 0.00 H new ATOM 0 HB2 SER p 42 3.765 -11.467 5.901 1.00 0.00 H new ATOM 0 HB3 SER p 42 3.618 -10.096 6.983 1.00 0.00 H new ATOM 0 HG SER p 42 5.448 -9.909 5.572 1.00 0.00 H new ATOM 673 N ASN p 43 2.345 -13.288 7.687 1.00 0.00 N ATOM 674 CA ASN p 43 1.003 -13.790 7.998 1.00 0.00 C ATOM 675 C ASN p 43 1.083 -15.065 8.843 1.00 0.00 C ATOM 676 O ASN p 43 2.156 -15.666 8.971 1.00 0.00 O ATOM 677 CB ASN p 43 0.225 -14.057 6.702 1.00 0.00 C ATOM 678 CG ASN p 43 -0.147 -12.780 5.971 1.00 0.00 C ATOM 679 OD1 ASN p 43 0.608 -12.288 5.133 1.00 0.00 O ATOM 680 ND2 ASN p 43 -1.318 -12.237 6.286 1.00 0.00 N ATOM 0 H ASN p 43 2.790 -13.755 6.897 1.00 0.00 H new ATOM 0 HA ASN p 43 0.476 -13.030 8.575 1.00 0.00 H new ATOM 0 HB2 ASN p 43 0.826 -14.686 6.045 1.00 0.00 H new ATOM 0 HB3 ASN p 43 -0.682 -14.615 6.935 1.00 0.00 H new ATOM 0 HD21 ASN p 43 -1.622 -11.378 5.827 1.00 0.00 H new ATOM 0 HD22 ASN p 43 -1.913 -12.679 6.987 1.00 0.00 H new ATOM 687 N MET p 44 -0.062 -15.475 9.417 1.00 0.00 N ATOM 688 CA MET p 44 -0.136 -16.679 10.255 1.00 0.00 C ATOM 689 C MET p 44 -0.211 -17.947 9.397 1.00 0.00 C ATOM 690 O MET p 44 -1.185 -18.163 8.667 1.00 0.00 O ATOM 691 CB MET p 44 -1.343 -16.605 11.200 1.00 0.00 C ATOM 692 CG MET p 44 -1.174 -15.613 12.340 1.00 0.00 C ATOM 693 SD MET p 44 -2.613 -15.550 13.425 1.00 0.00 S ATOM 694 CE MET p 44 -2.085 -14.321 14.618 1.00 0.00 C ATOM 0 H MET p 44 -0.951 -14.986 9.313 1.00 0.00 H new ATOM 0 HA MET p 44 0.775 -16.726 10.852 1.00 0.00 H new ATOM 0 HB2 MET p 44 -2.227 -16.333 10.623 1.00 0.00 H new ATOM 0 HB3 MET p 44 -1.526 -17.595 11.617 1.00 0.00 H new ATOM 0 HG2 MET p 44 -0.295 -15.884 12.925 1.00 0.00 H new ATOM 0 HG3 MET p 44 -0.990 -14.620 11.929 1.00 0.00 H new ATOM 0 HE1 MET p 44 -2.871 -14.171 15.358 1.00 0.00 H new ATOM 0 HE2 MET p 44 -1.178 -14.664 15.116 1.00 0.00 H new ATOM 0 HE3 MET p 44 -1.884 -13.380 14.106 1.00 0.00 H new ATOM 704 N ALA p 45 0.847 -18.779 9.494 1.00 0.00 N ATOM 705 CA ALA p 45 0.974 -20.052 8.743 1.00 0.00 C ATOM 706 C ALA p 45 0.773 -19.860 7.216 1.00 0.00 C ATOM 707 O ALA p 45 -0.195 -20.377 6.642 1.00 0.00 O ATOM 708 CB ALA p 45 0.024 -21.117 9.305 1.00 0.00 C ATOM 0 H ALA p 45 1.645 -18.587 10.100 1.00 0.00 H new ATOM 0 HA ALA p 45 1.996 -20.404 8.879 1.00 0.00 H new ATOM 0 HB1 ALA p 45 0.136 -22.041 8.737 1.00 0.00 H new ATOM 0 HB2 ALA p 45 0.264 -21.303 10.352 1.00 0.00 H new ATOM 0 HB3 ALA p 45 -1.005 -20.765 9.226 1.00 0.00 H new ATOM 714 N PRO p 46 1.682 -19.096 6.532 1.00 0.00 N ATOM 715 CA PRO p 46 1.589 -18.846 5.082 1.00 0.00 C ATOM 716 C PRO p 46 2.146 -19.994 4.241 1.00 0.00 C ATOM 717 O PRO p 46 3.029 -20.732 4.688 1.00 0.00 O ATOM 718 CB PRO p 46 2.444 -17.582 4.872 1.00 0.00 C ATOM 719 CG PRO p 46 2.925 -17.166 6.230 1.00 0.00 C ATOM 720 CD PRO p 46 2.847 -18.388 7.097 1.00 0.00 C ATOM 0 HA PRO p 46 0.551 -18.740 4.768 1.00 0.00 H new ATOM 0 HB2 PRO p 46 3.284 -17.787 4.208 1.00 0.00 H new ATOM 0 HB3 PRO p 46 1.858 -16.789 4.408 1.00 0.00 H new ATOM 0 HG2 PRO p 46 3.946 -16.788 6.182 1.00 0.00 H new ATOM 0 HG3 PRO p 46 2.307 -16.364 6.633 1.00 0.00 H new ATOM 0 HD2 PRO p 46 3.756 -18.987 7.039 1.00 0.00 H new ATOM 0 HD3 PRO p 46 2.700 -18.134 8.147 1.00 0.00 H new ATOM 728 N LEU p 47 1.616 -20.128 3.023 1.00 0.00 N ATOM 729 CA LEU p 47 2.047 -21.174 2.091 1.00 0.00 C ATOM 730 C LEU p 47 2.590 -20.578 0.793 1.00 0.00 C ATOM 731 O LEU p 47 3.233 -21.275 0.001 1.00 0.00 O ATOM 732 CB LEU p 47 0.877 -22.115 1.774 1.00 0.00 C ATOM 733 CG LEU p 47 0.307 -22.910 2.960 1.00 0.00 C ATOM 734 CD1 LEU p 47 -1.079 -23.439 2.624 1.00 0.00 C ATOM 735 CD2 LEU p 47 1.230 -24.061 3.345 1.00 0.00 C ATOM 0 H LEU p 47 0.883 -19.521 2.657 1.00 0.00 H new ATOM 0 HA LEU p 47 2.849 -21.735 2.571 1.00 0.00 H new ATOM 0 HB2 LEU p 47 0.071 -21.525 1.338 1.00 0.00 H new ATOM 0 HB3 LEU p 47 1.203 -22.823 1.012 1.00 0.00 H new ATOM 0 HG LEU p 47 0.232 -22.235 3.813 1.00 0.00 H new ATOM 0 HD11 LEU p 47 -1.470 -24.000 3.473 1.00 0.00 H new ATOM 0 HD12 LEU p 47 -1.744 -22.604 2.404 1.00 0.00 H new ATOM 0 HD13 LEU p 47 -1.018 -24.093 1.754 1.00 0.00 H new ATOM 0 HD21 LEU p 47 0.801 -24.605 4.186 1.00 0.00 H new ATOM 0 HD22 LEU p 47 1.344 -24.736 2.496 1.00 0.00 H new ATOM 0 HD23 LEU p 47 2.206 -23.666 3.628 1.00 0.00 H new ATOM 747 N TYR p 48 2.322 -19.290 0.592 1.00 0.00 N ATOM 748 CA TYR p 48 2.754 -18.568 -0.610 1.00 0.00 C ATOM 749 C TYR p 48 3.821 -17.530 -0.271 1.00 0.00 C ATOM 750 O TYR p 48 3.860 -17.011 0.850 1.00 0.00 O ATOM 751 CB TYR p 48 1.553 -17.878 -1.281 1.00 0.00 C ATOM 752 CG TYR p 48 0.328 -18.762 -1.437 1.00 0.00 C ATOM 753 CD1 TYR p 48 -0.565 -18.928 -0.384 1.00 0.00 C ATOM 754 CD2 TYR p 48 0.070 -19.429 -2.627 1.00 0.00 C ATOM 755 CE1 TYR p 48 -1.677 -19.732 -0.511 1.00 0.00 C ATOM 756 CE2 TYR p 48 -1.045 -20.237 -2.763 1.00 0.00 C ATOM 757 CZ TYR p 48 -1.914 -20.387 -1.702 1.00 0.00 C ATOM 758 OH TYR p 48 -3.023 -21.189 -1.833 1.00 0.00 O ATOM 0 H TYR p 48 1.801 -18.715 1.254 1.00 0.00 H new ATOM 0 HA TYR p 48 3.183 -19.294 -1.301 1.00 0.00 H new ATOM 0 HB2 TYR p 48 1.280 -17.000 -0.695 1.00 0.00 H new ATOM 0 HB3 TYR p 48 1.857 -17.523 -2.265 1.00 0.00 H new ATOM 0 HD1 TYR p 48 -0.384 -18.418 0.550 1.00 0.00 H new ATOM 0 HD2 TYR p 48 0.750 -19.316 -3.459 1.00 0.00 H new ATOM 0 HE1 TYR p 48 -2.360 -19.849 0.318 1.00 0.00 H new ATOM 0 HE2 TYR p 48 -1.234 -20.748 -3.696 1.00 0.00 H new ATOM 0 HH TYR p 48 -3.043 -21.575 -2.733 1.00 0.00 H new ATOM 768 N SER p 49 4.679 -17.234 -1.254 1.00 0.00 N ATOM 769 CA SER p 49 5.756 -16.254 -1.088 1.00 0.00 C ATOM 770 C SER p 49 5.767 -15.248 -2.241 1.00 0.00 C ATOM 771 O SER p 49 6.038 -14.063 -2.036 1.00 0.00 O ATOM 772 CB SER p 49 7.111 -16.962 -1.005 1.00 0.00 C ATOM 773 OG SER p 49 7.123 -17.919 0.041 1.00 0.00 O ATOM 0 H SER p 49 4.647 -17.663 -2.179 1.00 0.00 H new ATOM 0 HA SER p 49 5.576 -15.713 -0.159 1.00 0.00 H new ATOM 0 HB2 SER p 49 7.327 -17.453 -1.954 1.00 0.00 H new ATOM 0 HB3 SER p 49 7.899 -16.228 -0.839 1.00 0.00 H new ATOM 0 HG SER p 49 7.792 -17.664 0.710 1.00 0.00 H new ATOM 779 N ASP p 50 5.476 -15.740 -3.450 1.00 0.00 N ATOM 780 CA ASP p 50 5.440 -14.907 -4.659 1.00 0.00 C ATOM 781 C ASP p 50 4.004 -14.496 -4.983 1.00 0.00 C ATOM 782 O ASP p 50 3.748 -13.361 -5.395 1.00 0.00 O ATOM 783 CB ASP p 50 6.056 -15.653 -5.848 1.00 0.00 C ATOM 784 CG ASP p 50 7.556 -15.834 -5.713 1.00 0.00 C ATOM 785 OD1 ASP p 50 7.982 -16.855 -5.133 1.00 0.00 O ATOM 786 OD2 ASP p 50 8.305 -14.954 -6.186 1.00 0.00 O ATOM 0 H ASP p 50 5.260 -16.722 -3.619 1.00 0.00 H new ATOM 0 HA ASP p 50 6.027 -14.008 -4.471 1.00 0.00 H new ATOM 0 HB2 ASP p 50 5.583 -16.631 -5.942 1.00 0.00 H new ATOM 0 HB3 ASP p 50 5.842 -15.105 -6.766 1.00 0.00 H new ATOM 791 N GLN p 51 3.080 -15.446 -4.789 1.00 0.00 N ATOM 792 CA GLN p 51 1.646 -15.242 -5.033 1.00 0.00 C ATOM 793 C GLN p 51 0.974 -14.500 -3.870 1.00 0.00 C ATOM 794 O GLN p 51 -0.203 -14.155 -3.948 1.00 0.00 O ATOM 795 CB GLN p 51 0.951 -16.590 -5.266 1.00 0.00 C ATOM 796 CG GLN p 51 1.226 -17.196 -6.634 1.00 0.00 C ATOM 797 CD GLN p 51 0.474 -18.494 -6.859 1.00 0.00 C ATOM 798 OE1 GLN p 51 -0.652 -18.494 -7.358 1.00 0.00 O ATOM 799 NE2 GLN p 51 1.095 -19.609 -6.494 1.00 0.00 N ATOM 0 H GLN p 51 3.308 -16.383 -4.456 1.00 0.00 H new ATOM 0 HA GLN p 51 1.547 -14.625 -5.926 1.00 0.00 H new ATOM 0 HB2 GLN p 51 1.274 -17.292 -4.497 1.00 0.00 H new ATOM 0 HB3 GLN p 51 -0.125 -16.459 -5.147 1.00 0.00 H new ATOM 0 HG2 GLN p 51 0.947 -16.480 -7.407 1.00 0.00 H new ATOM 0 HG3 GLN p 51 2.296 -17.377 -6.739 1.00 0.00 H new ATOM 0 HE21 GLN p 51 2.028 -19.562 -6.084 1.00 0.00 H new ATOM 0 HE22 GLN p 51 0.639 -20.512 -6.623 1.00 0.00 H new ATOM 808 N ALA p 52 1.720 -14.303 -2.781 1.00 0.00 N ATOM 809 CA ALA p 52 1.211 -13.623 -1.587 1.00 0.00 C ATOM 810 C ALA p 52 1.554 -12.124 -1.555 1.00 0.00 C ATOM 811 O ALA p 52 1.014 -11.384 -0.736 1.00 0.00 O ATOM 812 CB ALA p 52 1.771 -14.315 -0.351 1.00 0.00 C ATOM 0 H ALA p 52 2.690 -14.609 -2.701 1.00 0.00 H new ATOM 0 HA ALA p 52 0.123 -13.688 -1.607 1.00 0.00 H new ATOM 0 HB1 ALA p 52 1.399 -13.817 0.545 1.00 0.00 H new ATOM 0 HB2 ALA p 52 1.456 -15.358 -0.344 1.00 0.00 H new ATOM 0 HB3 ALA p 52 2.860 -14.265 -0.368 1.00 0.00 H new ATOM 818 N LEU p 53 2.473 -11.702 -2.421 1.00 0.00 N ATOM 819 CA LEU p 53 2.927 -10.323 -2.504 1.00 0.00 C ATOM 820 C LEU p 53 2.212 -9.565 -3.605 1.00 0.00 C ATOM 821 O LEU p 53 1.380 -8.695 -3.359 1.00 0.00 O ATOM 822 CB LEU p 53 4.452 -10.301 -2.736 1.00 0.00 C ATOM 823 CG LEU p 53 5.344 -10.204 -1.488 1.00 0.00 C ATOM 824 CD1 LEU p 53 4.965 -8.992 -0.659 1.00 0.00 C ATOM 825 CD2 LEU p 53 5.265 -11.479 -0.658 1.00 0.00 C ATOM 0 H LEU p 53 2.927 -12.321 -3.093 1.00 0.00 H new ATOM 0 HA LEU p 53 2.692 -9.825 -1.563 1.00 0.00 H new ATOM 0 HB2 LEU p 53 4.726 -11.206 -3.279 1.00 0.00 H new ATOM 0 HB3 LEU p 53 4.684 -9.457 -3.385 1.00 0.00 H new ATOM 0 HG LEU p 53 6.377 -10.086 -1.815 1.00 0.00 H new ATOM 0 HD11 LEU p 53 5.606 -8.938 0.221 1.00 0.00 H new ATOM 0 HD12 LEU p 53 5.091 -8.089 -1.256 1.00 0.00 H new ATOM 0 HD13 LEU p 53 3.925 -9.077 -0.345 1.00 0.00 H new ATOM 0 HD21 LEU p 53 5.906 -11.383 0.219 1.00 0.00 H new ATOM 0 HD22 LEU p 53 4.236 -11.642 -0.339 1.00 0.00 H new ATOM 0 HD23 LEU p 53 5.597 -12.326 -1.259 1.00 0.00 H new ATOM 837 N LYS p 54 2.549 -9.964 -4.831 1.00 0.00 N ATOM 838 CA LYS p 54 2.000 -9.387 -6.079 1.00 0.00 C ATOM 839 C LYS p 54 0.476 -9.509 -6.154 1.00 0.00 C ATOM 840 O LYS p 54 -0.169 -8.833 -6.953 1.00 0.00 O ATOM 841 CB LYS p 54 2.629 -10.069 -7.299 1.00 0.00 C ATOM 842 CG LYS p 54 4.077 -9.675 -7.545 1.00 0.00 C ATOM 843 CD LYS p 54 4.647 -10.384 -8.762 1.00 0.00 C ATOM 844 CE LYS p 54 6.095 -9.993 -9.009 1.00 0.00 C ATOM 845 NZ LYS p 54 6.662 -10.684 -10.199 1.00 0.00 N ATOM 0 H LYS p 54 3.223 -10.711 -4.998 1.00 0.00 H new ATOM 0 HA LYS p 54 2.249 -8.326 -6.077 1.00 0.00 H new ATOM 0 HB2 LYS p 54 2.574 -11.150 -7.168 1.00 0.00 H new ATOM 0 HB3 LYS p 54 2.041 -9.825 -8.183 1.00 0.00 H new ATOM 0 HG2 LYS p 54 4.143 -8.596 -7.687 1.00 0.00 H new ATOM 0 HG3 LYS p 54 4.676 -9.918 -6.667 1.00 0.00 H new ATOM 0 HD2 LYS p 54 4.580 -11.463 -8.620 1.00 0.00 H new ATOM 0 HD3 LYS p 54 4.049 -10.140 -9.640 1.00 0.00 H new ATOM 0 HE2 LYS p 54 6.161 -8.914 -9.150 1.00 0.00 H new ATOM 0 HE3 LYS p 54 6.692 -10.236 -8.130 1.00 0.00 H new ATOM 0 HZ1 LYS p 54 7.651 -10.390 -10.333 1.00 0.00 H new ATOM 0 HZ2 LYS p 54 6.623 -11.713 -10.054 1.00 0.00 H new ATOM 0 HZ3 LYS p 54 6.109 -10.432 -11.043 1.00 0.00 H new ATOM 859 N LYS p 55 -0.064 -10.386 -5.310 1.00 0.00 N ATOM 860 CA LYS p 55 -1.482 -10.643 -5.203 1.00 0.00 C ATOM 861 C LYS p 55 -2.061 -9.810 -4.084 1.00 0.00 C ATOM 862 O LYS p 55 -3.188 -9.343 -4.185 1.00 0.00 O ATOM 863 CB LYS p 55 -1.744 -12.120 -4.962 1.00 0.00 C ATOM 864 CG LYS p 55 -2.013 -12.917 -6.233 1.00 0.00 C ATOM 865 CD LYS p 55 -3.497 -12.959 -6.572 1.00 0.00 C ATOM 866 CE LYS p 55 -3.752 -13.729 -7.858 1.00 0.00 C ATOM 867 NZ LYS p 55 -5.200 -13.765 -8.206 1.00 0.00 N ATOM 0 H LYS p 55 0.495 -10.948 -4.668 1.00 0.00 H new ATOM 0 HA LYS p 55 -1.965 -10.367 -6.140 1.00 0.00 H new ATOM 0 HB2 LYS p 55 -0.885 -12.552 -4.449 1.00 0.00 H new ATOM 0 HB3 LYS p 55 -2.599 -12.223 -4.293 1.00 0.00 H new ATOM 0 HG2 LYS p 55 -1.463 -12.473 -7.063 1.00 0.00 H new ATOM 0 HG3 LYS p 55 -1.639 -13.934 -6.110 1.00 0.00 H new ATOM 0 HD2 LYS p 55 -4.046 -13.424 -5.753 1.00 0.00 H new ATOM 0 HD3 LYS p 55 -3.877 -11.943 -6.674 1.00 0.00 H new ATOM 0 HE2 LYS p 55 -3.194 -13.269 -8.673 1.00 0.00 H new ATOM 0 HE3 LYS p 55 -3.379 -14.748 -7.751 1.00 0.00 H new ATOM 0 HZ1 LYS p 55 -5.332 -14.299 -9.089 1.00 0.00 H new ATOM 0 HZ2 LYS p 55 -5.730 -14.227 -7.440 1.00 0.00 H new ATOM 0 HZ3 LYS p 55 -5.551 -12.794 -8.333 1.00 0.00 H new ATOM 881 N LYS p 56 -1.273 -9.647 -3.005 1.00 0.00 N ATOM 882 CA LYS p 56 -1.682 -8.790 -1.864 1.00 0.00 C ATOM 883 C LYS p 56 -1.547 -7.312 -2.263 1.00 0.00 C ATOM 884 O LYS p 56 -2.033 -6.402 -1.588 1.00 0.00 O ATOM 885 CB LYS p 56 -0.845 -9.077 -0.622 1.00 0.00 C ATOM 886 CG LYS p 56 -1.446 -10.150 0.272 1.00 0.00 C ATOM 887 CD LYS p 56 -0.695 -10.264 1.590 1.00 0.00 C ATOM 888 CE LYS p 56 -1.287 -11.345 2.485 1.00 0.00 C ATOM 889 NZ LYS p 56 -2.592 -10.935 3.077 1.00 0.00 N ATOM 0 H LYS p 56 -0.360 -10.089 -2.894 1.00 0.00 H new ATOM 0 HA LYS p 56 -2.721 -9.013 -1.621 1.00 0.00 H new ATOM 0 HB2 LYS p 56 0.154 -9.387 -0.929 1.00 0.00 H new ATOM 0 HB3 LYS p 56 -0.731 -8.157 -0.048 1.00 0.00 H new ATOM 0 HG2 LYS p 56 -2.493 -9.917 0.468 1.00 0.00 H new ATOM 0 HG3 LYS p 56 -1.424 -11.110 -0.245 1.00 0.00 H new ATOM 0 HD2 LYS p 56 0.353 -10.489 1.393 1.00 0.00 H new ATOM 0 HD3 LYS p 56 -0.724 -9.306 2.109 1.00 0.00 H new ATOM 0 HE2 LYS p 56 -1.424 -12.258 1.906 1.00 0.00 H new ATOM 0 HE3 LYS p 56 -0.584 -11.577 3.285 1.00 0.00 H new ATOM 0 HZ1 LYS p 56 -2.957 -11.701 3.678 1.00 0.00 H new ATOM 0 HZ2 LYS p 56 -2.459 -10.078 3.651 1.00 0.00 H new ATOM 0 HZ3 LYS p 56 -3.272 -10.739 2.315 1.00 0.00 H new ATOM 903 N LEU p 57 -0.858 -7.141 -3.390 1.00 0.00 N ATOM 904 CA LEU p 57 -0.593 -5.878 -4.047 1.00 0.00 C ATOM 905 C LEU p 57 -1.677 -5.687 -5.071 1.00 0.00 C ATOM 906 O LEU p 57 -2.229 -4.601 -5.241 1.00 0.00 O ATOM 907 CB LEU p 57 0.760 -5.941 -4.750 1.00 0.00 C ATOM 908 CG LEU p 57 1.944 -5.284 -4.046 1.00 0.00 C ATOM 909 CD1 LEU p 57 2.225 -5.939 -2.699 1.00 0.00 C ATOM 910 CD2 LEU p 57 3.148 -5.392 -4.955 1.00 0.00 C ATOM 0 H LEU p 57 -0.450 -7.930 -3.891 1.00 0.00 H new ATOM 0 HA LEU p 57 -0.575 -5.058 -3.329 1.00 0.00 H new ATOM 0 HB2 LEU p 57 1.006 -6.990 -4.916 1.00 0.00 H new ATOM 0 HB3 LEU p 57 0.652 -5.479 -5.732 1.00 0.00 H new ATOM 0 HG LEU p 57 1.714 -4.238 -3.846 1.00 0.00 H new ATOM 0 HD11 LEU p 57 3.074 -5.447 -2.225 1.00 0.00 H new ATOM 0 HD12 LEU p 57 1.348 -5.846 -2.059 1.00 0.00 H new ATOM 0 HD13 LEU p 57 2.454 -6.994 -2.848 1.00 0.00 H new ATOM 0 HD21 LEU p 57 4.010 -4.929 -4.474 1.00 0.00 H new ATOM 0 HD22 LEU p 57 3.363 -6.442 -5.151 1.00 0.00 H new ATOM 0 HD23 LEU p 57 2.940 -4.883 -5.896 1.00 0.00 H new ATOM 922 N ALA p 58 -1.938 -6.800 -5.771 1.00 0.00 N ATOM 923 CA ALA p 58 -3.017 -6.863 -6.778 1.00 0.00 C ATOM 924 C ALA p 58 -4.387 -6.831 -6.090 1.00 0.00 C ATOM 925 O ALA p 58 -5.413 -6.609 -6.734 1.00 0.00 O ATOM 926 CB ALA p 58 -2.893 -8.102 -7.654 1.00 0.00 C ATOM 0 H ALA p 58 -1.419 -7.671 -5.661 1.00 0.00 H new ATOM 0 HA ALA p 58 -2.922 -5.990 -7.424 1.00 0.00 H new ATOM 0 HB1 ALA p 58 -3.703 -8.115 -8.383 1.00 0.00 H new ATOM 0 HB2 ALA p 58 -1.936 -8.085 -8.176 1.00 0.00 H new ATOM 0 HB3 ALA p 58 -2.951 -8.995 -7.032 1.00 0.00 H new ATOM 932 N GLN p 59 -4.362 -7.071 -4.771 1.00 0.00 N ATOM 933 CA GLN p 59 -5.522 -7.034 -3.909 1.00 0.00 C ATOM 934 C GLN p 59 -5.594 -5.639 -3.299 1.00 0.00 C ATOM 935 O GLN p 59 -6.657 -5.161 -2.923 1.00 0.00 O ATOM 936 CB GLN p 59 -5.360 -8.113 -2.833 1.00 0.00 C ATOM 937 CG GLN p 59 -6.136 -7.870 -1.558 1.00 0.00 C ATOM 938 CD GLN p 59 -7.171 -8.942 -1.278 1.00 0.00 C ATOM 939 OE1 GLN p 59 -6.884 -9.941 -0.618 1.00 0.00 O ATOM 940 NE2 GLN p 59 -8.384 -8.739 -1.779 1.00 0.00 N ATOM 0 H GLN p 59 -3.502 -7.302 -4.273 1.00 0.00 H new ATOM 0 HA GLN p 59 -6.446 -7.233 -4.452 1.00 0.00 H new ATOM 0 HB2 GLN p 59 -5.670 -9.071 -3.251 1.00 0.00 H new ATOM 0 HB3 GLN p 59 -4.302 -8.201 -2.585 1.00 0.00 H new ATOM 0 HG2 GLN p 59 -5.440 -7.818 -0.721 1.00 0.00 H new ATOM 0 HG3 GLN p 59 -6.632 -6.902 -1.621 1.00 0.00 H new ATOM 0 HE21 GLN p 59 -8.578 -7.896 -2.320 1.00 0.00 H new ATOM 0 HE22 GLN p 59 -9.122 -9.426 -1.622 1.00 0.00 H new ATOM 949 N LEU p 60 -4.407 -5.035 -3.205 1.00 0.00 N ATOM 950 CA LEU p 60 -4.197 -3.679 -2.698 1.00 0.00 C ATOM 951 C LEU p 60 -4.667 -2.669 -3.747 1.00 0.00 C ATOM 952 O LEU p 60 -5.317 -1.680 -3.448 1.00 0.00 O ATOM 953 CB LEU p 60 -2.696 -3.512 -2.411 1.00 0.00 C ATOM 954 CG LEU p 60 -2.212 -2.125 -1.987 1.00 0.00 C ATOM 955 CD1 LEU p 60 -2.939 -1.667 -0.742 1.00 0.00 C ATOM 956 CD2 LEU p 60 -0.715 -2.166 -1.770 1.00 0.00 C ATOM 0 H LEU p 60 -3.540 -5.491 -3.489 1.00 0.00 H new ATOM 0 HA LEU p 60 -4.765 -3.508 -1.784 1.00 0.00 H new ATOM 0 HB2 LEU p 60 -2.422 -4.219 -1.628 1.00 0.00 H new ATOM 0 HB3 LEU p 60 -2.147 -3.801 -3.307 1.00 0.00 H new ATOM 0 HG LEU p 60 -2.431 -1.404 -2.774 1.00 0.00 H new ATOM 0 HD11 LEU p 60 -2.582 -0.678 -0.455 1.00 0.00 H new ATOM 0 HD12 LEU p 60 -4.010 -1.622 -0.942 1.00 0.00 H new ATOM 0 HD13 LEU p 60 -2.750 -2.370 0.069 1.00 0.00 H new ATOM 0 HD21 LEU p 60 -0.364 -1.179 -1.467 1.00 0.00 H new ATOM 0 HD22 LEU p 60 -0.480 -2.890 -0.990 1.00 0.00 H new ATOM 0 HD23 LEU p 60 -0.221 -2.458 -2.697 1.00 0.00 H new ATOM 968 N LYS p 61 -4.271 -2.985 -4.968 1.00 0.00 N ATOM 969 CA LYS p 61 -4.590 -2.278 -6.199 1.00 0.00 C ATOM 970 C LYS p 61 -6.057 -2.504 -6.508 1.00 0.00 C ATOM 971 O LYS p 61 -6.726 -1.682 -7.140 1.00 0.00 O ATOM 972 CB LYS p 61 -3.709 -2.816 -7.330 1.00 0.00 C ATOM 973 CG LYS p 61 -2.582 -1.878 -7.718 1.00 0.00 C ATOM 974 CD LYS p 61 -1.935 -2.294 -9.029 1.00 0.00 C ATOM 975 CE LYS p 61 -0.806 -1.355 -9.415 1.00 0.00 C ATOM 976 NZ LYS p 61 -0.164 -1.756 -10.699 1.00 0.00 N ATOM 0 H LYS p 61 -3.678 -3.797 -5.138 1.00 0.00 H new ATOM 0 HA LYS p 61 -4.403 -1.209 -6.095 1.00 0.00 H new ATOM 0 HB2 LYS p 61 -3.286 -3.773 -7.026 1.00 0.00 H new ATOM 0 HB3 LYS p 61 -4.331 -3.006 -8.205 1.00 0.00 H new ATOM 0 HG2 LYS p 61 -2.968 -0.862 -7.808 1.00 0.00 H new ATOM 0 HG3 LYS p 61 -1.830 -1.865 -6.929 1.00 0.00 H new ATOM 0 HD2 LYS p 61 -1.550 -3.310 -8.940 1.00 0.00 H new ATOM 0 HD3 LYS p 61 -2.686 -2.306 -9.819 1.00 0.00 H new ATOM 0 HE2 LYS p 61 -1.193 -0.340 -9.504 1.00 0.00 H new ATOM 0 HE3 LYS p 61 -0.057 -1.343 -8.623 1.00 0.00 H new ATOM 0 HZ1 LYS p 61 0.601 -1.090 -10.927 1.00 0.00 H new ATOM 0 HZ2 LYS p 61 0.228 -2.715 -10.607 1.00 0.00 H new ATOM 0 HZ3 LYS p 61 -0.872 -1.743 -11.460 1.00 0.00 H new ATOM 990 N TRP p 62 -6.522 -3.669 -6.044 1.00 0.00 N ATOM 991 CA TRP p 62 -7.921 -4.058 -6.119 1.00 0.00 C ATOM 992 C TRP p 62 -8.615 -3.339 -4.987 1.00 0.00 C ATOM 993 O TRP p 62 -9.805 -3.017 -5.053 1.00 0.00 O ATOM 994 CB TRP p 62 -8.086 -5.564 -5.971 1.00 0.00 C ATOM 995 CG TRP p 62 -9.114 -6.149 -6.896 1.00 0.00 C ATOM 996 CD1 TRP p 62 -10.443 -6.317 -6.635 1.00 0.00 C ATOM 997 CD2 TRP p 62 -8.901 -6.644 -8.228 1.00 0.00 C ATOM 998 NE1 TRP p 62 -11.070 -6.884 -7.717 1.00 0.00 N ATOM 999 CE2 TRP p 62 -10.146 -7.095 -8.706 1.00 0.00 C ATOM 1000 CE3 TRP p 62 -7.781 -6.751 -9.064 1.00 0.00 C ATOM 1001 CZ2 TRP p 62 -10.302 -7.641 -9.978 1.00 0.00 C ATOM 1002 CZ3 TRP p 62 -7.940 -7.294 -10.325 1.00 0.00 C ATOM 1003 CH2 TRP p 62 -9.192 -7.733 -10.772 1.00 0.00 C ATOM 0 H TRP p 62 -5.926 -4.370 -5.603 1.00 0.00 H new ATOM 0 HA TRP p 62 -8.346 -3.793 -7.087 1.00 0.00 H new ATOM 0 HB2 TRP p 62 -7.126 -6.046 -6.156 1.00 0.00 H new ATOM 0 HB3 TRP p 62 -8.364 -5.791 -4.942 1.00 0.00 H new ATOM 0 HD1 TRP p 62 -10.931 -6.044 -5.711 1.00 0.00 H new ATOM 0 HE1 TRP p 62 -12.063 -7.111 -7.775 1.00 0.00 H new ATOM 0 HE3 TRP p 62 -6.811 -6.415 -8.729 1.00 0.00 H new ATOM 0 HZ2 TRP p 62 -11.267 -7.980 -10.326 1.00 0.00 H new ATOM 0 HZ3 TRP p 62 -7.083 -7.381 -10.977 1.00 0.00 H new ATOM 0 HH2 TRP p 62 -9.283 -8.152 -11.763 1.00 0.00 H new ATOM 1014 N LYS p 63 -7.813 -3.101 -3.933 1.00 0.00 N ATOM 1015 CA LYS p 63 -8.263 -2.329 -2.772 1.00 0.00 C ATOM 1016 C LYS p 63 -8.269 -0.851 -3.136 1.00 0.00 C ATOM 1017 O LYS p 63 -9.041 -0.085 -2.584 1.00 0.00 O ATOM 1018 CB LYS p 63 -7.391 -2.571 -1.540 1.00 0.00 C ATOM 1019 CG LYS p 63 -7.876 -3.712 -0.663 1.00 0.00 C ATOM 1020 CD LYS p 63 -7.113 -3.769 0.650 1.00 0.00 C ATOM 1021 CE LYS p 63 -7.593 -4.916 1.525 1.00 0.00 C ATOM 1022 NZ LYS p 63 -6.848 -4.983 2.812 1.00 0.00 N ATOM 0 H LYS p 63 -6.851 -3.434 -3.866 1.00 0.00 H new ATOM 0 HA LYS p 63 -9.269 -2.658 -2.512 1.00 0.00 H new ATOM 0 HB2 LYS p 63 -6.371 -2.781 -1.863 1.00 0.00 H new ATOM 0 HB3 LYS p 63 -7.355 -1.658 -0.946 1.00 0.00 H new ATOM 0 HG2 LYS p 63 -8.940 -3.590 -0.461 1.00 0.00 H new ATOM 0 HG3 LYS p 63 -7.758 -4.656 -1.195 1.00 0.00 H new ATOM 0 HD2 LYS p 63 -6.048 -3.885 0.448 1.00 0.00 H new ATOM 0 HD3 LYS p 63 -7.235 -2.827 1.184 1.00 0.00 H new ATOM 0 HE2 LYS p 63 -8.657 -4.797 1.728 1.00 0.00 H new ATOM 0 HE3 LYS p 63 -7.474 -5.857 0.988 1.00 0.00 H new ATOM 0 HZ1 LYS p 63 -7.205 -5.778 3.379 1.00 0.00 H new ATOM 0 HZ2 LYS p 63 -5.835 -5.122 2.620 1.00 0.00 H new ATOM 0 HZ3 LYS p 63 -6.982 -4.095 3.337 1.00 0.00 H new ATOM 1036 N LEU p 64 -7.384 -0.485 -4.086 1.00 0.00 N ATOM 1037 CA LEU p 64 -7.282 0.877 -4.646 1.00 0.00 C ATOM 1038 C LEU p 64 -8.585 1.208 -5.335 1.00 0.00 C ATOM 1039 O LEU p 64 -9.195 2.233 -5.151 1.00 0.00 O ATOM 1040 CB LEU p 64 -6.164 0.923 -5.691 1.00 0.00 C ATOM 1041 CG LEU p 64 -4.831 1.569 -5.306 1.00 0.00 C ATOM 1042 CD1 LEU p 64 -4.047 0.697 -4.339 1.00 0.00 C ATOM 1043 CD2 LEU p 64 -4.026 1.798 -6.566 1.00 0.00 C ATOM 0 H LEU p 64 -6.711 -1.136 -4.491 1.00 0.00 H new ATOM 0 HA LEU p 64 -7.070 1.586 -3.846 1.00 0.00 H new ATOM 0 HB2 LEU p 64 -5.958 -0.101 -6.002 1.00 0.00 H new ATOM 0 HB3 LEU p 64 -6.548 1.450 -6.564 1.00 0.00 H new ATOM 0 HG LEU p 64 -5.029 2.516 -4.803 1.00 0.00 H new ATOM 0 HD11 LEU p 64 -3.106 1.187 -4.088 1.00 0.00 H new ATOM 0 HD12 LEU p 64 -4.631 0.545 -3.431 1.00 0.00 H new ATOM 0 HD13 LEU p 64 -3.841 -0.267 -4.804 1.00 0.00 H new ATOM 0 HD21 LEU p 64 -3.072 2.258 -6.310 1.00 0.00 H new ATOM 0 HD22 LEU p 64 -3.847 0.844 -7.062 1.00 0.00 H new ATOM 0 HD23 LEU p 64 -4.578 2.457 -7.236 1.00 0.00 H new ATOM 1055 N GLN p 65 -8.999 0.264 -6.122 1.00 0.00 N ATOM 1056 CA GLN p 65 -10.268 0.309 -6.848 1.00 0.00 C ATOM 1057 C GLN p 65 -11.385 0.635 -5.846 1.00 0.00 C ATOM 1058 O GLN p 65 -12.476 1.051 -6.206 1.00 0.00 O ATOM 1059 CB GLN p 65 -10.467 -1.053 -7.537 1.00 0.00 C ATOM 1060 CG GLN p 65 -11.838 -1.700 -7.376 1.00 0.00 C ATOM 1061 CD GLN p 65 -12.676 -1.621 -8.637 1.00 0.00 C ATOM 1062 OE1 GLN p 65 -13.435 -0.672 -8.834 1.00 0.00 O ATOM 1063 NE2 GLN p 65 -12.540 -2.620 -9.501 1.00 0.00 N ATOM 0 H GLN p 65 -8.464 -0.587 -6.294 1.00 0.00 H new ATOM 0 HA GLN p 65 -10.280 1.081 -7.618 1.00 0.00 H new ATOM 0 HB2 GLN p 65 -10.271 -0.929 -8.602 1.00 0.00 H new ATOM 0 HB3 GLN p 65 -9.716 -1.743 -7.153 1.00 0.00 H new ATOM 0 HG2 GLN p 65 -11.711 -2.745 -7.095 1.00 0.00 H new ATOM 0 HG3 GLN p 65 -12.371 -1.213 -6.560 1.00 0.00 H new ATOM 0 HE21 GLN p 65 -11.899 -3.387 -9.297 1.00 0.00 H new ATOM 0 HE22 GLN p 65 -13.076 -2.621 -10.369 1.00 0.00 H new ATOM 1072 N ALA p 66 -11.079 0.277 -4.608 1.00 0.00 N ATOM 1073 CA ALA p 66 -11.914 0.523 -3.446 1.00 0.00 C ATOM 1074 C ALA p 66 -11.427 1.712 -2.619 1.00 0.00 C ATOM 1075 O ALA p 66 -12.233 2.450 -2.063 1.00 0.00 O ATOM 1076 CB ALA p 66 -12.034 -0.727 -2.588 1.00 0.00 C ATOM 0 H ALA p 66 -10.212 -0.209 -4.379 1.00 0.00 H new ATOM 0 HA ALA p 66 -12.906 0.782 -3.817 1.00 0.00 H new ATOM 0 HB1 ALA p 66 -12.664 -0.516 -1.724 1.00 0.00 H new ATOM 0 HB2 ALA p 66 -12.480 -1.530 -3.175 1.00 0.00 H new ATOM 0 HB3 ALA p 66 -11.044 -1.032 -2.249 1.00 0.00 H new ATOM 1082 N LEU p 67 -10.089 1.872 -2.553 1.00 0.00 N ATOM 1083 CA LEU p 67 -9.423 2.905 -1.767 1.00 0.00 C ATOM 1084 C LEU p 67 -9.299 4.176 -2.585 1.00 0.00 C ATOM 1085 O LEU p 67 -9.547 5.268 -2.095 1.00 0.00 O ATOM 1086 CB LEU p 67 -8.049 2.365 -1.292 1.00 0.00 C ATOM 1087 CG LEU p 67 -6.789 3.116 -1.754 1.00 0.00 C ATOM 1088 CD1 LEU p 67 -6.596 4.379 -0.950 1.00 0.00 C ATOM 1089 CD2 LEU p 67 -5.574 2.222 -1.657 1.00 0.00 C ATOM 0 H LEU p 67 -9.438 1.270 -3.058 1.00 0.00 H new ATOM 0 HA LEU p 67 -10.009 3.155 -0.882 1.00 0.00 H new ATOM 0 HB2 LEU p 67 -8.052 2.353 -0.202 1.00 0.00 H new ATOM 0 HB3 LEU p 67 -7.963 1.330 -1.622 1.00 0.00 H new ATOM 0 HG LEU p 67 -6.920 3.399 -2.798 1.00 0.00 H new ATOM 0 HD11 LEU p 67 -5.699 4.895 -1.293 1.00 0.00 H new ATOM 0 HD12 LEU p 67 -7.461 5.029 -1.080 1.00 0.00 H new ATOM 0 HD13 LEU p 67 -6.488 4.126 0.105 1.00 0.00 H new ATOM 0 HD21 LEU p 67 -4.692 2.770 -1.988 1.00 0.00 H new ATOM 0 HD22 LEU p 67 -5.437 1.905 -0.623 1.00 0.00 H new ATOM 0 HD23 LEU p 67 -5.715 1.346 -2.290 1.00 0.00 H new ATOM 1101 N LYS p 68 -8.853 3.985 -3.818 1.00 0.00 N ATOM 1102 CA LYS p 68 -8.724 5.045 -4.807 1.00 0.00 C ATOM 1103 C LYS p 68 -10.112 5.453 -5.249 1.00 0.00 C ATOM 1104 O LYS p 68 -10.305 6.569 -5.720 1.00 0.00 O ATOM 1105 CB LYS p 68 -7.871 4.620 -6.009 1.00 0.00 C ATOM 1106 CG LYS p 68 -6.371 4.753 -5.777 1.00 0.00 C ATOM 1107 CD LYS p 68 -5.866 6.155 -6.098 1.00 0.00 C ATOM 1108 CE LYS p 68 -4.367 6.273 -5.872 1.00 0.00 C ATOM 1109 NZ LYS p 68 -3.862 7.635 -6.197 1.00 0.00 N ATOM 0 H LYS p 68 -8.565 3.070 -4.166 1.00 0.00 H new ATOM 0 HA LYS p 68 -8.207 5.890 -4.352 1.00 0.00 H new ATOM 0 HB2 LYS p 68 -8.100 3.584 -6.257 1.00 0.00 H new ATOM 0 HB3 LYS p 68 -8.150 5.224 -6.872 1.00 0.00 H new ATOM 0 HG2 LYS p 68 -6.142 4.514 -4.738 1.00 0.00 H new ATOM 0 HG3 LYS p 68 -5.843 4.027 -6.395 1.00 0.00 H new ATOM 0 HD2 LYS p 68 -6.099 6.398 -7.135 1.00 0.00 H new ATOM 0 HD3 LYS p 68 -6.387 6.882 -5.475 1.00 0.00 H new ATOM 0 HE2 LYS p 68 -4.137 6.039 -4.833 1.00 0.00 H new ATOM 0 HE3 LYS p 68 -3.848 5.537 -6.487 1.00 0.00 H new ATOM 0 HZ1 LYS p 68 -2.836 7.674 -6.030 1.00 0.00 H new ATOM 0 HZ2 LYS p 68 -4.058 7.849 -7.196 1.00 0.00 H new ATOM 0 HZ3 LYS p 68 -4.338 8.335 -5.593 1.00 0.00 H new ATOM 1123 N LYS p 69 -11.072 4.509 -5.118 1.00 0.00 N ATOM 1124 CA LYS p 69 -12.471 4.805 -5.383 1.00 0.00 C ATOM 1125 C LYS p 69 -13.056 5.414 -4.116 1.00 0.00 C ATOM 1126 O LYS p 69 -14.121 6.028 -4.133 1.00 0.00 O ATOM 1127 CB LYS p 69 -13.243 3.561 -5.781 1.00 0.00 C ATOM 1128 CG LYS p 69 -13.587 3.517 -7.259 1.00 0.00 C ATOM 1129 CD LYS p 69 -14.836 2.689 -7.518 1.00 0.00 C ATOM 1130 CE LYS p 69 -15.185 2.653 -8.997 1.00 0.00 C ATOM 1131 NZ LYS p 69 -16.411 1.851 -9.260 1.00 0.00 N ATOM 0 H LYS p 69 -10.891 3.547 -4.832 1.00 0.00 H new ATOM 0 HA LYS p 69 -12.548 5.499 -6.220 1.00 0.00 H new ATOM 0 HB2 LYS p 69 -12.655 2.679 -5.525 1.00 0.00 H new ATOM 0 HB3 LYS p 69 -14.163 3.511 -5.199 1.00 0.00 H new ATOM 0 HG2 LYS p 69 -13.739 4.531 -7.628 1.00 0.00 H new ATOM 0 HG3 LYS p 69 -12.749 3.097 -7.816 1.00 0.00 H new ATOM 0 HD2 LYS p 69 -14.682 1.673 -7.155 1.00 0.00 H new ATOM 0 HD3 LYS p 69 -15.672 3.105 -6.956 1.00 0.00 H new ATOM 0 HE2 LYS p 69 -15.332 3.670 -9.360 1.00 0.00 H new ATOM 0 HE3 LYS p 69 -14.350 2.233 -9.557 1.00 0.00 H new ATOM 0 HZ1 LYS p 69 -16.614 1.852 -10.280 1.00 0.00 H new ATOM 0 HZ2 LYS p 69 -16.262 0.874 -8.937 1.00 0.00 H new ATOM 0 HZ3 LYS p 69 -17.214 2.267 -8.747 1.00 0.00 H new ATOM 1145 N LYS p 70 -12.310 5.197 -3.020 1.00 0.00 N ATOM 1146 CA LYS p 70 -12.612 5.750 -1.707 1.00 0.00 C ATOM 1147 C LYS p 70 -11.866 7.068 -1.585 1.00 0.00 C ATOM 1148 O LYS p 70 -12.219 7.930 -0.785 1.00 0.00 O ATOM 1149 CB LYS p 70 -12.186 4.806 -0.588 1.00 0.00 C ATOM 1150 CG LYS p 70 -13.338 4.246 0.234 1.00 0.00 C ATOM 1151 CD LYS p 70 -13.281 4.729 1.674 1.00 0.00 C ATOM 1152 CE LYS p 70 -14.414 4.145 2.503 1.00 0.00 C ATOM 1153 NZ LYS p 70 -14.359 4.603 3.919 1.00 0.00 N ATOM 0 H LYS p 70 -11.468 4.622 -3.031 1.00 0.00 H new ATOM 0 HA LYS p 70 -13.688 5.895 -1.611 1.00 0.00 H new ATOM 0 HB2 LYS p 70 -11.628 3.976 -1.022 1.00 0.00 H new ATOM 0 HB3 LYS p 70 -11.504 5.335 0.078 1.00 0.00 H new ATOM 0 HG2 LYS p 70 -14.285 4.545 -0.214 1.00 0.00 H new ATOM 0 HG3 LYS p 70 -13.306 3.157 0.213 1.00 0.00 H new ATOM 0 HD2 LYS p 70 -12.324 4.449 2.115 1.00 0.00 H new ATOM 0 HD3 LYS p 70 -13.336 5.817 1.696 1.00 0.00 H new ATOM 0 HE2 LYS p 70 -15.370 4.433 2.065 1.00 0.00 H new ATOM 0 HE3 LYS p 70 -14.364 3.057 2.471 1.00 0.00 H new ATOM 0 HZ1 LYS p 70 -15.148 4.183 4.451 1.00 0.00 H new ATOM 0 HZ2 LYS p 70 -13.458 4.307 4.345 1.00 0.00 H new ATOM 0 HZ3 LYS p 70 -14.433 5.640 3.952 1.00 0.00 H new ATOM 1167 N ASN p 71 -10.800 7.163 -2.398 1.00 0.00 N ATOM 1168 CA ASN p 71 -9.964 8.360 -2.515 1.00 0.00 C ATOM 1169 C ASN p 71 -10.558 9.233 -3.615 1.00 0.00 C ATOM 1170 O ASN p 71 -10.223 10.405 -3.751 1.00 0.00 O ATOM 1171 CB ASN p 71 -8.514 8.001 -2.844 1.00 0.00 C ATOM 1172 CG ASN p 71 -7.527 9.024 -2.314 1.00 0.00 C ATOM 1173 OD1 ASN p 71 -7.200 10.011 -3.138 1.00 0.00 O flip ATOM 1174 ND2 ASN p 71 -7.064 8.926 -1.178 1.00 0.00 N flip ATOM 0 H ASN p 71 -10.494 6.397 -2.999 1.00 0.00 H new ATOM 0 HA ASN p 71 -9.950 8.892 -1.564 1.00 0.00 H new ATOM 0 HB2 ASN p 71 -8.281 7.023 -2.422 1.00 0.00 H new ATOM 0 HB3 ASN p 71 -8.400 7.917 -3.925 1.00 0.00 H new ATOM 0 HD21 ASN p 71 -7.344 8.150 -0.578 1.00 0.00 H new ATOM 0 HD22 ASN p 71 -6.400 9.621 -0.836 1.00 0.00 H new ATOM 1181 N ALA p 72 -11.427 8.582 -4.407 1.00 0.00 N ATOM 1182 CA ALA p 72 -12.198 9.192 -5.483 1.00 0.00 C ATOM 1183 C ALA p 72 -13.517 9.592 -4.877 1.00 0.00 C ATOM 1184 O ALA p 72 -14.237 10.434 -5.401 1.00 0.00 O ATOM 1185 CB ALA p 72 -12.416 8.236 -6.648 1.00 0.00 C ATOM 0 H ALA p 72 -11.612 7.584 -4.305 1.00 0.00 H new ATOM 0 HA ALA p 72 -11.661 10.047 -5.894 1.00 0.00 H new ATOM 0 HB1 ALA p 72 -12.995 8.735 -7.425 1.00 0.00 H new ATOM 0 HB2 ALA p 72 -11.451 7.931 -7.054 1.00 0.00 H new ATOM 0 HB3 ALA p 72 -12.958 7.356 -6.300 1.00 0.00 H new ATOM 1191 N GLN p 73 -13.805 8.913 -3.749 1.00 0.00 N ATOM 1192 CA GLN p 73 -14.944 9.134 -2.915 1.00 0.00 C ATOM 1193 C GLN p 73 -14.579 10.268 -1.986 1.00 0.00 C ATOM 1194 O GLN p 73 -15.405 11.078 -1.582 1.00 0.00 O ATOM 1195 CB GLN p 73 -15.156 7.868 -2.129 1.00 0.00 C ATOM 1196 CG GLN p 73 -16.354 7.897 -1.247 1.00 0.00 C ATOM 1197 CD GLN p 73 -17.421 6.895 -1.642 1.00 0.00 C ATOM 1198 OE1 GLN p 73 -18.309 7.197 -2.438 1.00 0.00 O ATOM 1199 NE2 GLN p 73 -17.339 5.692 -1.083 1.00 0.00 N ATOM 0 H GLN p 73 -13.205 8.165 -3.401 1.00 0.00 H new ATOM 0 HA GLN p 73 -15.848 9.381 -3.472 1.00 0.00 H new ATOM 0 HB2 GLN p 73 -15.249 7.033 -2.823 1.00 0.00 H new ATOM 0 HB3 GLN p 73 -14.273 7.679 -1.519 1.00 0.00 H new ATOM 0 HG2 GLN p 73 -16.044 7.700 -0.221 1.00 0.00 H new ATOM 0 HG3 GLN p 73 -16.784 8.899 -1.264 1.00 0.00 H new ATOM 0 HE21 GLN p 73 -16.585 5.484 -0.428 1.00 0.00 H new ATOM 0 HE22 GLN p 73 -18.030 4.976 -1.309 1.00 0.00 H new ATOM 1208 N LEU p 74 -13.297 10.222 -1.637 1.00 0.00 N ATOM 1209 CA LEU p 74 -12.632 11.220 -0.816 1.00 0.00 C ATOM 1210 C LEU p 74 -12.361 12.433 -1.684 1.00 0.00 C ATOM 1211 O LEU p 74 -12.387 13.551 -1.224 1.00 0.00 O ATOM 1212 CB LEU p 74 -11.326 10.662 -0.262 1.00 0.00 C ATOM 1213 CG LEU p 74 -10.771 11.321 1.004 1.00 0.00 C ATOM 1214 CD1 LEU p 74 -11.541 10.887 2.249 1.00 0.00 C ATOM 1215 CD2 LEU p 74 -9.309 10.963 1.130 1.00 0.00 C ATOM 0 H LEU p 74 -12.677 9.466 -1.928 1.00 0.00 H new ATOM 0 HA LEU p 74 -13.263 11.496 0.029 1.00 0.00 H new ATOM 0 HB2 LEU p 74 -11.471 9.601 -0.056 1.00 0.00 H new ATOM 0 HB3 LEU p 74 -10.568 10.735 -1.042 1.00 0.00 H new ATOM 0 HG LEU p 74 -10.886 12.402 0.922 1.00 0.00 H new ATOM 0 HD11 LEU p 74 -11.118 11.375 3.127 1.00 0.00 H new ATOM 0 HD12 LEU p 74 -12.589 11.170 2.146 1.00 0.00 H new ATOM 0 HD13 LEU p 74 -11.467 9.806 2.364 1.00 0.00 H new ATOM 0 HD21 LEU p 74 -8.897 11.425 2.027 1.00 0.00 H new ATOM 0 HD22 LEU p 74 -9.204 9.880 1.198 1.00 0.00 H new ATOM 0 HD23 LEU p 74 -8.769 11.325 0.255 1.00 0.00 H new ATOM 1227 N LYS p 75 -12.153 12.162 -2.972 1.00 0.00 N ATOM 1228 CA LYS p 75 -11.932 13.190 -3.983 1.00 0.00 C ATOM 1229 C LYS p 75 -13.295 13.686 -4.394 1.00 0.00 C ATOM 1230 O LYS p 75 -13.456 14.778 -4.946 1.00 0.00 O ATOM 1231 CB LYS p 75 -11.189 12.628 -5.188 1.00 0.00 C ATOM 1232 CG LYS p 75 -9.858 13.304 -5.474 1.00 0.00 C ATOM 1233 CD LYS p 75 -9.911 14.128 -6.752 1.00 0.00 C ATOM 1234 CE LYS p 75 -8.579 14.804 -7.043 1.00 0.00 C ATOM 1235 NZ LYS p 75 -8.316 15.950 -6.125 1.00 0.00 N ATOM 0 H LYS p 75 -12.133 11.213 -3.344 1.00 0.00 H new ATOM 0 HA LYS p 75 -11.317 13.996 -3.582 1.00 0.00 H new ATOM 0 HB2 LYS p 75 -11.016 11.564 -5.029 1.00 0.00 H new ATOM 0 HB3 LYS p 75 -11.826 12.719 -6.068 1.00 0.00 H new ATOM 0 HG2 LYS p 75 -9.589 13.948 -4.636 1.00 0.00 H new ATOM 0 HG3 LYS p 75 -9.077 12.549 -5.560 1.00 0.00 H new ATOM 0 HD2 LYS p 75 -10.183 13.484 -7.589 1.00 0.00 H new ATOM 0 HD3 LYS p 75 -10.691 14.884 -6.665 1.00 0.00 H new ATOM 0 HE2 LYS p 75 -7.775 14.074 -6.950 1.00 0.00 H new ATOM 0 HE3 LYS p 75 -8.570 15.157 -8.074 1.00 0.00 H new ATOM 0 HZ1 LYS p 75 -7.399 16.380 -6.360 1.00 0.00 H new ATOM 0 HZ2 LYS p 75 -9.068 16.660 -6.232 1.00 0.00 H new ATOM 0 HZ3 LYS p 75 -8.297 15.610 -5.142 1.00 0.00 H new ATOM 1249 N LYS p 76 -14.275 12.821 -4.097 1.00 0.00 N ATOM 1250 CA LYS p 76 -15.682 13.124 -4.319 1.00 0.00 C ATOM 1251 C LYS p 76 -16.172 13.865 -3.101 1.00 0.00 C ATOM 1252 O LYS p 76 -17.075 14.703 -3.178 1.00 0.00 O ATOM 1253 CB LYS p 76 -16.500 11.858 -4.535 1.00 0.00 C ATOM 1254 CG LYS p 76 -16.971 11.654 -5.967 1.00 0.00 C ATOM 1255 CD LYS p 76 -18.379 12.192 -6.181 1.00 0.00 C ATOM 1256 CE LYS p 76 -18.850 11.968 -7.609 1.00 0.00 C ATOM 1257 NZ LYS p 76 -20.243 12.452 -7.815 1.00 0.00 N ATOM 0 H LYS p 76 -14.108 11.897 -3.698 1.00 0.00 H new ATOM 0 HA LYS p 76 -15.796 13.727 -5.220 1.00 0.00 H new ATOM 0 HB2 LYS p 76 -15.902 10.997 -4.236 1.00 0.00 H new ATOM 0 HB3 LYS p 76 -17.370 11.885 -3.879 1.00 0.00 H new ATOM 0 HG2 LYS p 76 -16.284 12.153 -6.650 1.00 0.00 H new ATOM 0 HG3 LYS p 76 -16.947 10.592 -6.210 1.00 0.00 H new ATOM 0 HD2 LYS p 76 -19.065 11.703 -5.490 1.00 0.00 H new ATOM 0 HD3 LYS p 76 -18.401 13.258 -5.952 1.00 0.00 H new ATOM 0 HE2 LYS p 76 -18.181 12.484 -8.297 1.00 0.00 H new ATOM 0 HE3 LYS p 76 -18.795 10.906 -7.847 1.00 0.00 H new ATOM 0 HZ1 LYS p 76 -20.528 12.282 -8.801 1.00 0.00 H new ATOM 0 HZ2 LYS p 76 -20.886 11.942 -7.176 1.00 0.00 H new ATOM 0 HZ3 LYS p 76 -20.290 13.471 -7.612 1.00 0.00 H new ATOM 1271 N LYS p 77 -15.548 13.522 -1.966 1.00 0.00 N ATOM 1272 CA LYS p 77 -15.826 14.182 -0.708 1.00 0.00 C ATOM 1273 C LYS p 77 -14.966 15.437 -0.588 1.00 0.00 C ATOM 1274 O LYS p 77 -15.257 16.325 0.220 1.00 0.00 O ATOM 1275 CB LYS p 77 -15.567 13.240 0.457 1.00 0.00 C ATOM 1276 CG LYS p 77 -16.785 12.434 0.873 1.00 0.00 C ATOM 1277 CD LYS p 77 -16.549 11.706 2.187 1.00 0.00 C ATOM 1278 CE LYS p 77 -17.769 10.901 2.606 1.00 0.00 C ATOM 1279 NZ LYS p 77 -17.546 10.184 3.892 1.00 0.00 N ATOM 0 H LYS p 77 -14.845 12.785 -1.906 1.00 0.00 H new ATOM 0 HA LYS p 77 -16.877 14.469 -0.681 1.00 0.00 H new ATOM 0 HB2 LYS p 77 -14.764 12.555 0.187 1.00 0.00 H new ATOM 0 HB3 LYS p 77 -15.217 13.820 1.311 1.00 0.00 H new ATOM 0 HG2 LYS p 77 -17.645 13.097 0.972 1.00 0.00 H new ATOM 0 HG3 LYS p 77 -17.028 11.711 0.094 1.00 0.00 H new ATOM 0 HD2 LYS p 77 -15.691 11.042 2.087 1.00 0.00 H new ATOM 0 HD3 LYS p 77 -16.304 12.429 2.965 1.00 0.00 H new ATOM 0 HE2 LYS p 77 -18.627 11.567 2.705 1.00 0.00 H new ATOM 0 HE3 LYS p 77 -18.014 10.180 1.826 1.00 0.00 H new ATOM 0 HZ1 LYS p 77 -18.401 9.647 4.143 1.00 0.00 H new ATOM 0 HZ2 LYS p 77 -16.744 9.530 3.790 1.00 0.00 H new ATOM 0 HZ3 LYS p 77 -17.338 10.873 4.642 1.00 0.00 H new ATOM 1293 N LEU p 78 -13.897 15.495 -1.409 1.00 0.00 N ATOM 1294 CA LEU p 78 -12.995 16.652 -1.442 1.00 0.00 C ATOM 1295 C LEU p 78 -13.659 17.834 -2.151 1.00 0.00 C ATOM 1296 O LEU p 78 -13.850 18.906 -1.570 1.00 0.00 O ATOM 1297 CB LEU p 78 -11.706 16.235 -2.166 1.00 0.00 C ATOM 1298 CG LEU p 78 -10.538 17.218 -2.158 1.00 0.00 C ATOM 1299 CD1 LEU p 78 -9.254 16.436 -2.267 1.00 0.00 C ATOM 1300 CD2 LEU p 78 -10.651 18.193 -3.319 1.00 0.00 C ATOM 0 H LEU p 78 -13.642 14.750 -2.057 1.00 0.00 H new ATOM 0 HA LEU p 78 -12.762 16.972 -0.426 1.00 0.00 H new ATOM 0 HB2 LEU p 78 -11.361 15.300 -1.724 1.00 0.00 H new ATOM 0 HB3 LEU p 78 -11.959 16.023 -3.205 1.00 0.00 H new ATOM 0 HG LEU p 78 -10.552 17.792 -1.232 1.00 0.00 H new ATOM 0 HD11 LEU p 78 -8.408 17.123 -2.263 1.00 0.00 H new ATOM 0 HD12 LEU p 78 -9.171 15.753 -1.422 1.00 0.00 H new ATOM 0 HD13 LEU p 78 -9.253 15.865 -3.196 1.00 0.00 H new ATOM 0 HD21 LEU p 78 -9.809 18.885 -3.296 1.00 0.00 H new ATOM 0 HD22 LEU p 78 -10.642 17.642 -4.259 1.00 0.00 H new ATOM 0 HD23 LEU p 78 -11.583 18.752 -3.235 1.00 0.00 H new ATOM 1312 N GLN p 79 -13.997 17.597 -3.412 1.00 0.00 N ATOM 1313 CA GLN p 79 -14.653 18.570 -4.276 1.00 0.00 C ATOM 1314 C GLN p 79 -16.134 18.705 -3.929 1.00 0.00 C ATOM 1315 O GLN p 79 -16.626 19.800 -3.644 1.00 0.00 O ATOM 1316 CB GLN p 79 -14.504 18.133 -5.735 1.00 0.00 C ATOM 1317 CG GLN p 79 -13.090 17.740 -6.143 1.00 0.00 C ATOM 1318 CD GLN p 79 -12.363 18.847 -6.881 1.00 0.00 C ATOM 1319 OE1 GLN p 79 -11.693 19.681 -6.272 1.00 0.00 O ATOM 1320 NE2 GLN p 79 -12.492 18.861 -8.203 1.00 0.00 N ATOM 0 H GLN p 79 -13.819 16.704 -3.872 1.00 0.00 H new ATOM 0 HA GLN p 79 -14.179 19.540 -4.126 1.00 0.00 H new ATOM 0 HB2 GLN p 79 -15.168 17.287 -5.916 1.00 0.00 H new ATOM 0 HB3 GLN p 79 -14.840 18.945 -6.379 1.00 0.00 H new ATOM 0 HG2 GLN p 79 -12.522 17.469 -5.253 1.00 0.00 H new ATOM 0 HG3 GLN p 79 -13.132 16.854 -6.776 1.00 0.00 H new ATOM 0 HE21 GLN p 79 -13.057 18.150 -8.668 1.00 0.00 H new ATOM 0 HE22 GLN p 79 -12.026 19.582 -8.753 1.00 0.00 H new ATOM 1329 N ALA p 80 -16.820 17.558 -3.959 1.00 0.00 N ATOM 1330 CA ALA p 80 -18.267 17.436 -3.656 1.00 0.00 C ATOM 1331 C ALA p 80 -19.135 18.265 -4.613 1.00 0.00 C ATOM 1332 O ALA p 80 -19.058 19.513 -4.564 1.00 0.00 O ATOM 1333 CB ALA p 80 -18.566 17.799 -2.198 1.00 0.00 C ATOM 1334 OXT ALA p 80 -19.885 17.654 -5.404 1.00 0.00 O ATOM 0 H ALA p 80 -16.386 16.667 -4.198 1.00 0.00 H new ATOM 0 HA ALA p 80 -18.529 16.389 -3.807 1.00 0.00 H new ATOM 0 HB1 ALA p 80 -19.635 17.699 -2.010 1.00 0.00 H new ATOM 0 HB2 ALA p 80 -18.017 17.129 -1.536 1.00 0.00 H new ATOM 0 HB3 ALA p 80 -18.259 18.828 -2.009 1.00 0.00 H new TER 1340 ALA p 80