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 Single : p 1 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : p 1 MET N :NH3+ -177:sc= -0.128 (180deg=-0.137) USER MOD Single : p 2 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : p 6 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : p 10 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : p 11 ASN : amide:sc= -0.187 K(o=-0.19,f=-1.2!) USER MOD Single : p 16 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : p 20 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : p 24 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : p 27 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : p 30 GLN : amide:sc= -0.0392 K(o=-0.039,f=-0.98) USER MOD Single : p 33 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : p 34 CYS SG : rot 32:sc= 0.158 USER MOD Single : p 36 CYS SG : rot 180:sc= 0 USER MOD Single : p 40 ASN : amide:sc= -0.0431 K(o=-0.043,f=-0.92) USER MOD Single : p 41 CYS SG : rot -7:sc=-0.00016 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= -1.88 K(o=-1.9,f=-7.6!) 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+ -158:sc= -2.99! (180deg=-3.73!) USER MOD Single : p 69 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : p 70 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : p 71 ASN :FLIP amide:sc=-0.00784 F(o=-0.58,f=-0.0078) 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 -7.632 23.656 5.669 1.00 0.00 N ATOM 2 CA MET p 1 -6.986 23.179 4.414 1.00 0.00 C ATOM 3 C MET p 1 -5.822 22.225 4.708 1.00 0.00 C ATOM 4 O MET p 1 -5.162 21.731 3.787 1.00 0.00 O ATOM 5 CB MET p 1 -6.488 24.377 3.591 1.00 0.00 C ATOM 6 CG MET p 1 -7.602 25.182 2.937 1.00 0.00 C ATOM 7 SD MET p 1 -6.977 26.580 1.984 1.00 0.00 S ATOM 8 CE MET p 1 -8.507 27.286 1.378 1.00 0.00 C ATOM 0 H1 MET p 1 -8.446 24.258 5.433 1.00 0.00 H new ATOM 0 H2 MET p 1 -7.955 22.839 6.225 1.00 0.00 H new ATOM 0 H3 MET p 1 -6.946 24.204 6.226 1.00 0.00 H new ATOM 0 HA MET p 1 -7.733 22.630 3.841 1.00 0.00 H new ATOM 0 HB2 MET p 1 -5.910 25.035 4.239 1.00 0.00 H new ATOM 0 HB3 MET p 1 -5.811 24.017 2.817 1.00 0.00 H new ATOM 0 HG2 MET p 1 -8.181 24.530 2.283 1.00 0.00 H new ATOM 0 HG3 MET p 1 -8.282 25.546 3.707 1.00 0.00 H new ATOM 0 HE1 MET p 1 -8.287 28.163 0.769 1.00 0.00 H new ATOM 0 HE2 MET p 1 -9.034 26.548 0.774 1.00 0.00 H new ATOM 0 HE3 MET p 1 -9.132 27.578 2.222 1.00 0.00 H new ATOM 20 N GLN p 2 -5.574 21.975 5.996 1.00 0.00 N ATOM 21 CA GLN p 2 -4.512 21.087 6.439 1.00 0.00 C ATOM 22 C GLN p 2 -5.083 19.825 7.106 1.00 0.00 C ATOM 23 O GLN p 2 -4.348 18.917 7.491 1.00 0.00 O ATOM 24 CB GLN p 2 -3.596 21.830 7.425 1.00 0.00 C ATOM 25 CG GLN p 2 -4.278 22.902 8.276 1.00 0.00 C ATOM 26 CD GLN p 2 -3.321 23.574 9.240 1.00 0.00 C ATOM 27 OE1 GLN p 2 -3.151 23.130 10.376 1.00 0.00 O ATOM 28 NE2 GLN p 2 -2.689 24.652 8.791 1.00 0.00 N ATOM 0 H GLN p 2 -6.110 22.388 6.759 1.00 0.00 H new ATOM 0 HA GLN p 2 -3.938 20.777 5.566 1.00 0.00 H new ATOM 0 HB2 GLN p 2 -3.139 21.098 8.091 1.00 0.00 H new ATOM 0 HB3 GLN p 2 -2.788 22.297 6.862 1.00 0.00 H new ATOM 0 HG2 GLN p 2 -4.718 23.655 7.622 1.00 0.00 H new ATOM 0 HG3 GLN p 2 -5.096 22.450 8.837 1.00 0.00 H new ATOM 0 HE21 GLN p 2 -2.860 24.985 7.842 1.00 0.00 H new ATOM 0 HE22 GLN p 2 -2.032 25.147 9.395 1.00 0.00 H new ATOM 37 N ALA p 3 -6.405 19.785 7.216 1.00 0.00 N ATOM 38 CA ALA p 3 -7.119 18.685 7.869 1.00 0.00 C ATOM 39 C ALA p 3 -7.528 17.605 6.883 1.00 0.00 C ATOM 40 O ALA p 3 -7.519 16.423 7.205 1.00 0.00 O ATOM 41 CB ALA p 3 -8.335 19.218 8.617 1.00 0.00 C ATOM 0 H ALA p 3 -7.018 20.516 6.855 1.00 0.00 H new ATOM 0 HA ALA p 3 -6.435 18.225 8.582 1.00 0.00 H new ATOM 0 HB1 ALA p 3 -8.857 18.391 9.098 1.00 0.00 H new ATOM 0 HB2 ALA p 3 -8.012 19.933 9.374 1.00 0.00 H new ATOM 0 HB3 ALA p 3 -9.006 19.712 7.915 1.00 0.00 H new ATOM 47 N LEU p 4 -7.959 18.065 5.720 1.00 0.00 N ATOM 48 CA LEU p 4 -8.419 17.245 4.627 1.00 0.00 C ATOM 49 C LEU p 4 -7.292 17.015 3.634 1.00 0.00 C ATOM 50 O LEU p 4 -6.868 15.889 3.389 1.00 0.00 O ATOM 51 CB LEU p 4 -9.596 17.975 3.973 1.00 0.00 C ATOM 52 CG LEU p 4 -10.544 17.144 3.120 1.00 0.00 C ATOM 53 CD1 LEU p 4 -11.871 17.856 3.065 1.00 0.00 C ATOM 54 CD2 LEU p 4 -9.985 16.957 1.719 1.00 0.00 C ATOM 0 H LEU p 4 -7.997 19.062 5.510 1.00 0.00 H new ATOM 0 HA LEU p 4 -8.739 16.265 4.980 1.00 0.00 H new ATOM 0 HB2 LEU p 4 -10.180 18.449 4.762 1.00 0.00 H new ATOM 0 HB3 LEU p 4 -9.194 18.774 3.350 1.00 0.00 H new ATOM 0 HG LEU p 4 -10.666 16.154 3.560 1.00 0.00 H new ATOM 0 HD11 LEU p 4 -12.569 17.279 2.458 1.00 0.00 H new ATOM 0 HD12 LEU p 4 -12.269 17.962 4.074 1.00 0.00 H new ATOM 0 HD13 LEU p 4 -11.736 18.843 2.623 1.00 0.00 H new ATOM 0 HD21 LEU p 4 -10.679 16.360 1.127 1.00 0.00 H new ATOM 0 HD22 LEU p 4 -9.851 17.931 1.248 1.00 0.00 H new ATOM 0 HD23 LEU p 4 -9.024 16.446 1.776 1.00 0.00 H new ATOM 66 N GLU p 5 -6.840 18.137 3.075 1.00 0.00 N ATOM 67 CA GLU p 5 -5.770 18.199 2.062 1.00 0.00 C ATOM 68 C GLU p 5 -4.449 17.650 2.568 1.00 0.00 C ATOM 69 O GLU p 5 -3.681 17.092 1.792 1.00 0.00 O ATOM 70 CB GLU p 5 -5.547 19.639 1.589 1.00 0.00 C ATOM 71 CG GLU p 5 -6.805 20.491 1.576 1.00 0.00 C ATOM 72 CD GLU p 5 -7.060 21.146 0.233 1.00 0.00 C ATOM 73 OE1 GLU p 5 -7.720 20.514 -0.620 1.00 0.00 O ATOM 74 OE2 GLU p 5 -6.601 22.290 0.033 1.00 0.00 O ATOM 0 H GLU p 5 -7.213 19.055 3.316 1.00 0.00 H new ATOM 0 HA GLU p 5 -6.108 17.575 1.234 1.00 0.00 H new ATOM 0 HB2 GLU p 5 -4.808 20.112 2.236 1.00 0.00 H new ATOM 0 HB3 GLU p 5 -5.125 19.619 0.584 1.00 0.00 H new ATOM 0 HG2 GLU p 5 -7.661 19.870 1.840 1.00 0.00 H new ATOM 0 HG3 GLU p 5 -6.723 21.263 2.341 1.00 0.00 H new ATOM 81 N LYS p 6 -4.208 17.826 3.862 1.00 0.00 N ATOM 82 CA LYS p 6 -2.977 17.342 4.501 1.00 0.00 C ATOM 83 C LYS p 6 -3.194 15.964 5.100 1.00 0.00 C ATOM 84 O LYS p 6 -2.248 15.315 5.528 1.00 0.00 O ATOM 85 CB LYS p 6 -2.460 18.306 5.557 1.00 0.00 C ATOM 86 CG LYS p 6 -1.547 19.390 4.999 1.00 0.00 C ATOM 87 CD LYS p 6 -0.751 20.074 6.102 1.00 0.00 C ATOM 88 CE LYS p 6 0.071 21.238 5.565 1.00 0.00 C ATOM 89 NZ LYS p 6 1.256 20.778 4.784 1.00 0.00 N ATOM 0 H LYS p 6 -4.849 18.302 4.497 1.00 0.00 H new ATOM 0 HA LYS p 6 -2.216 17.276 3.724 1.00 0.00 H new ATOM 0 HB2 LYS p 6 -3.308 18.777 6.053 1.00 0.00 H new ATOM 0 HB3 LYS p 6 -1.919 17.743 6.317 1.00 0.00 H new ATOM 0 HG2 LYS p 6 -0.862 18.952 4.273 1.00 0.00 H new ATOM 0 HG3 LYS p 6 -2.144 20.131 4.467 1.00 0.00 H new ATOM 0 HD2 LYS p 6 -1.433 20.435 6.872 1.00 0.00 H new ATOM 0 HD3 LYS p 6 -0.089 19.349 6.576 1.00 0.00 H new ATOM 0 HE2 LYS p 6 -0.558 21.864 4.932 1.00 0.00 H new ATOM 0 HE3 LYS p 6 0.405 21.859 6.396 1.00 0.00 H new ATOM 0 HZ1 LYS p 6 1.786 21.604 4.438 1.00 0.00 H new ATOM 0 HZ2 LYS p 6 1.871 20.202 5.394 1.00 0.00 H new ATOM 0 HZ3 LYS p 6 0.938 20.207 3.975 1.00 0.00 H new ATOM 103 N GLU p 7 -4.466 15.560 5.146 1.00 0.00 N ATOM 104 CA GLU p 7 -4.884 14.239 5.596 1.00 0.00 C ATOM 105 C GLU p 7 -4.875 13.345 4.363 1.00 0.00 C ATOM 106 O GLU p 7 -4.755 12.128 4.442 1.00 0.00 O ATOM 107 CB GLU p 7 -6.281 14.340 6.216 1.00 0.00 C ATOM 108 CG GLU p 7 -7.153 13.106 6.068 1.00 0.00 C ATOM 109 CD GLU p 7 -7.520 12.476 7.397 1.00 0.00 C ATOM 110 OE1 GLU p 7 -8.526 12.906 8.000 1.00 0.00 O ATOM 111 OE2 GLU p 7 -6.801 11.554 7.835 1.00 0.00 O ATOM 0 H GLU p 7 -5.245 16.156 4.866 1.00 0.00 H new ATOM 0 HA GLU p 7 -4.223 13.827 6.358 1.00 0.00 H new ATOM 0 HB2 GLU p 7 -6.173 14.562 7.278 1.00 0.00 H new ATOM 0 HB3 GLU p 7 -6.799 15.186 5.765 1.00 0.00 H new ATOM 0 HG2 GLU p 7 -8.065 13.375 5.535 1.00 0.00 H new ATOM 0 HG3 GLU p 7 -6.631 12.371 5.456 1.00 0.00 H new ATOM 118 N LEU p 8 -5.029 14.040 3.239 1.00 0.00 N ATOM 119 CA LEU p 8 -5.019 13.503 1.898 1.00 0.00 C ATOM 120 C LEU p 8 -3.595 13.626 1.365 1.00 0.00 C ATOM 121 O LEU p 8 -3.209 12.938 0.427 1.00 0.00 O ATOM 122 CB LEU p 8 -6.031 14.270 1.011 1.00 0.00 C ATOM 123 CG LEU p 8 -6.216 13.791 -0.449 1.00 0.00 C ATOM 124 CD1 LEU p 8 -5.302 14.568 -1.384 1.00 0.00 C ATOM 125 CD2 LEU p 8 -5.954 12.299 -0.578 1.00 0.00 C ATOM 0 H LEU p 8 -5.172 15.050 3.250 1.00 0.00 H new ATOM 0 HA LEU p 8 -5.321 12.456 1.891 1.00 0.00 H new ATOM 0 HB2 LEU p 8 -7.003 14.232 1.502 1.00 0.00 H new ATOM 0 HB3 LEU p 8 -5.728 15.317 0.985 1.00 0.00 H new ATOM 0 HG LEU p 8 -7.252 13.978 -0.732 1.00 0.00 H new ATOM 0 HD11 LEU p 8 -5.445 14.218 -2.406 1.00 0.00 H new ATOM 0 HD12 LEU p 8 -5.541 15.630 -1.327 1.00 0.00 H new ATOM 0 HD13 LEU p 8 -4.264 14.413 -1.090 1.00 0.00 H new ATOM 0 HD21 LEU p 8 -6.092 11.994 -1.615 1.00 0.00 H new ATOM 0 HD22 LEU p 8 -4.932 12.081 -0.269 1.00 0.00 H new ATOM 0 HD23 LEU p 8 -6.650 11.751 0.057 1.00 0.00 H new ATOM 137 N ALA p 9 -2.854 14.552 1.989 1.00 0.00 N ATOM 138 CA ALA p 9 -1.439 14.790 1.694 1.00 0.00 C ATOM 139 C ALA p 9 -0.640 13.903 2.624 1.00 0.00 C ATOM 140 O ALA p 9 0.532 13.604 2.389 1.00 0.00 O ATOM 141 CB ALA p 9 -1.026 16.244 1.859 1.00 0.00 C ATOM 0 H ALA p 9 -3.225 15.161 2.718 1.00 0.00 H new ATOM 0 HA ALA p 9 -1.251 14.555 0.647 1.00 0.00 H new ATOM 0 HB1 ALA p 9 0.033 16.350 1.625 1.00 0.00 H new ATOM 0 HB2 ALA p 9 -1.611 16.867 1.183 1.00 0.00 H new ATOM 0 HB3 ALA p 9 -1.204 16.558 2.887 1.00 0.00 H new ATOM 147 N GLN p 10 -1.334 13.501 3.700 1.00 0.00 N ATOM 148 CA GLN p 10 -0.823 12.580 4.692 1.00 0.00 C ATOM 149 C GLN p 10 -1.224 11.196 4.231 1.00 0.00 C ATOM 150 O GLN p 10 -0.530 10.231 4.482 1.00 0.00 O ATOM 151 CB GLN p 10 -1.389 12.914 6.079 1.00 0.00 C ATOM 152 CG GLN p 10 -1.652 11.724 6.991 1.00 0.00 C ATOM 153 CD GLN p 10 -0.754 11.710 8.213 1.00 0.00 C ATOM 154 OE1 GLN p 10 0.339 11.145 8.189 1.00 0.00 O ATOM 155 NE2 GLN p 10 -1.214 12.332 9.294 1.00 0.00 N ATOM 0 H GLN p 10 -2.282 13.821 3.896 1.00 0.00 H new ATOM 0 HA GLN p 10 0.261 12.647 4.787 1.00 0.00 H new ATOM 0 HB2 GLN p 10 -0.694 13.587 6.582 1.00 0.00 H new ATOM 0 HB3 GLN p 10 -2.323 13.460 5.948 1.00 0.00 H new ATOM 0 HG2 GLN p 10 -2.694 11.741 7.312 1.00 0.00 H new ATOM 0 HG3 GLN p 10 -1.507 10.802 6.428 1.00 0.00 H new ATOM 0 HE21 GLN p 10 -2.126 12.788 9.271 1.00 0.00 H new ATOM 0 HE22 GLN p 10 -0.655 12.353 10.147 1.00 0.00 H new ATOM 164 N ASN p 11 -2.369 11.166 3.533 1.00 0.00 N ATOM 165 CA ASN p 11 -2.930 9.953 2.919 1.00 0.00 C ATOM 166 C ASN p 11 -2.192 9.742 1.621 1.00 0.00 C ATOM 167 O ASN p 11 -2.182 8.649 1.058 1.00 0.00 O ATOM 168 CB ASN p 11 -4.432 10.069 2.644 1.00 0.00 C ATOM 169 CG ASN p 11 -5.159 8.734 2.734 1.00 0.00 C ATOM 170 OD1 ASN p 11 -4.824 7.876 3.554 1.00 0.00 O ATOM 171 ND2 ASN p 11 -6.162 8.553 1.881 1.00 0.00 N ATOM 0 H ASN p 11 -2.940 11.997 3.377 1.00 0.00 H new ATOM 0 HA ASN p 11 -2.809 9.115 3.605 1.00 0.00 H new ATOM 0 HB2 ASN p 11 -4.873 10.765 3.357 1.00 0.00 H new ATOM 0 HB3 ASN p 11 -4.582 10.492 1.651 1.00 0.00 H new ATOM 0 HD21 ASN p 11 -6.687 7.678 1.889 1.00 0.00 H new ATOM 0 HD22 ASN p 11 -6.407 9.289 1.218 1.00 0.00 H new ATOM 178 N GLU p 12 -1.586 10.852 1.166 1.00 0.00 N ATOM 179 CA GLU p 12 -0.752 10.910 0.016 1.00 0.00 C ATOM 180 C GLU p 12 0.607 10.450 0.480 1.00 0.00 C ATOM 181 O GLU p 12 1.339 9.795 -0.230 1.00 0.00 O ATOM 182 CB GLU p 12 -0.684 12.349 -0.419 1.00 0.00 C ATOM 183 CG GLU p 12 0.126 12.576 -1.647 1.00 0.00 C ATOM 184 CD GLU p 12 -0.682 13.103 -2.816 1.00 0.00 C ATOM 185 OE1 GLU p 12 -1.203 12.279 -3.597 1.00 0.00 O ATOM 186 OE2 GLU p 12 -0.792 14.339 -2.951 1.00 0.00 O ATOM 0 H GLU p 12 -1.686 11.756 1.629 1.00 0.00 H new ATOM 0 HA GLU p 12 -1.112 10.299 -0.812 1.00 0.00 H new ATOM 0 HB2 GLU p 12 -1.697 12.713 -0.592 1.00 0.00 H new ATOM 0 HB3 GLU p 12 -0.266 12.944 0.394 1.00 0.00 H new ATOM 0 HG2 GLU p 12 0.925 13.282 -1.420 1.00 0.00 H new ATOM 0 HG3 GLU p 12 0.601 11.639 -1.937 1.00 0.00 H new ATOM 193 N TRP p 13 0.873 10.863 1.717 1.00 0.00 N ATOM 194 CA TRP p 13 2.085 10.534 2.468 1.00 0.00 C ATOM 195 C TRP p 13 1.958 9.119 3.010 1.00 0.00 C ATOM 196 O TRP p 13 2.947 8.521 3.402 1.00 0.00 O ATOM 197 CB TRP p 13 2.320 11.523 3.614 1.00 0.00 C ATOM 198 CG TRP p 13 3.765 11.650 4.015 1.00 0.00 C ATOM 199 CD1 TRP p 13 4.680 12.523 3.500 1.00 0.00 C ATOM 200 CD2 TRP p 13 4.458 10.884 5.012 1.00 0.00 C ATOM 201 NE1 TRP p 13 5.896 12.347 4.112 1.00 0.00 N ATOM 202 CE2 TRP p 13 5.787 11.349 5.043 1.00 0.00 C ATOM 203 CE3 TRP p 13 4.087 9.851 5.883 1.00 0.00 C ATOM 204 CZ2 TRP p 13 6.743 10.819 5.907 1.00 0.00 C ATOM 205 CZ3 TRP p 13 5.038 9.327 6.739 1.00 0.00 C ATOM 206 CH2 TRP p 13 6.351 9.812 6.746 1.00 0.00 C ATOM 0 H TRP p 13 0.230 11.456 2.243 1.00 0.00 H new ATOM 0 HA TRP p 13 2.943 10.602 1.799 1.00 0.00 H new ATOM 0 HB2 TRP p 13 1.946 12.503 3.319 1.00 0.00 H new ATOM 0 HB3 TRP p 13 1.738 11.208 4.480 1.00 0.00 H new ATOM 0 HD1 TRP p 13 4.477 13.246 2.724 1.00 0.00 H new ATOM 0 HE1 TRP p 13 6.744 12.875 3.906 1.00 0.00 H new ATOM 0 HE3 TRP p 13 3.076 9.471 5.886 1.00 0.00 H new ATOM 0 HZ2 TRP p 13 7.757 11.190 5.914 1.00 0.00 H new ATOM 0 HZ3 TRP p 13 4.763 8.530 7.414 1.00 0.00 H new ATOM 0 HH2 TRP p 13 7.070 9.382 7.428 1.00 0.00 H new ATOM 217 N GLU p 14 0.703 8.641 3.071 1.00 0.00 N ATOM 218 CA GLU p 14 0.389 7.251 3.466 1.00 0.00 C ATOM 219 C GLU p 14 0.331 6.468 2.195 1.00 0.00 C ATOM 220 O GLU p 14 0.300 5.247 2.184 1.00 0.00 O ATOM 221 CB GLU p 14 -0.938 7.108 4.197 1.00 0.00 C ATOM 222 CG GLU p 14 -1.023 8.007 5.388 1.00 0.00 C ATOM 223 CD GLU p 14 -1.641 7.347 6.605 1.00 0.00 C ATOM 224 OE1 GLU p 14 -0.889 6.749 7.402 1.00 0.00 O ATOM 225 OE2 GLU p 14 -2.877 7.429 6.760 1.00 0.00 O ATOM 0 H GLU p 14 -0.120 9.201 2.850 1.00 0.00 H new ATOM 0 HA GLU p 14 1.151 6.900 4.162 1.00 0.00 H new ATOM 0 HB2 GLU p 14 -1.755 7.336 3.512 1.00 0.00 H new ATOM 0 HB3 GLU p 14 -1.067 6.073 4.514 1.00 0.00 H new ATOM 0 HG2 GLU p 14 -0.022 8.354 5.643 1.00 0.00 H new ATOM 0 HG3 GLU p 14 -1.609 8.888 5.126 1.00 0.00 H new ATOM 232 N LEU p 15 0.232 7.267 1.139 1.00 0.00 N ATOM 233 CA LEU p 15 0.253 6.814 -0.252 1.00 0.00 C ATOM 234 C LEU p 15 1.714 6.818 -0.710 1.00 0.00 C ATOM 235 O LEU p 15 2.099 6.109 -1.634 1.00 0.00 O ATOM 236 CB LEU p 15 -0.614 7.733 -1.146 1.00 0.00 C ATOM 237 CG LEU p 15 -0.755 7.375 -2.644 1.00 0.00 C ATOM 238 CD1 LEU p 15 0.299 8.105 -3.457 1.00 0.00 C ATOM 239 CD2 LEU p 15 -0.654 5.876 -2.870 1.00 0.00 C ATOM 0 H LEU p 15 0.132 8.278 1.227 1.00 0.00 H new ATOM 0 HA LEU p 15 -0.167 5.812 -0.334 1.00 0.00 H new ATOM 0 HB2 LEU p 15 -1.615 7.767 -0.716 1.00 0.00 H new ATOM 0 HB3 LEU p 15 -0.205 8.741 -1.082 1.00 0.00 H new ATOM 0 HG LEU p 15 -1.744 7.693 -2.974 1.00 0.00 H new ATOM 0 HD11 LEU p 15 0.190 7.846 -4.510 1.00 0.00 H new ATOM 0 HD12 LEU p 15 0.173 9.181 -3.333 1.00 0.00 H new ATOM 0 HD13 LEU p 15 1.291 7.814 -3.112 1.00 0.00 H new ATOM 0 HD21 LEU p 15 -0.757 5.661 -3.933 1.00 0.00 H new ATOM 0 HD22 LEU p 15 0.315 5.520 -2.520 1.00 0.00 H new ATOM 0 HD23 LEU p 15 -1.447 5.371 -2.319 1.00 0.00 H new ATOM 251 N GLN p 16 2.483 7.666 -0.022 1.00 0.00 N ATOM 252 CA GLN p 16 3.936 7.833 -0.212 1.00 0.00 C ATOM 253 C GLN p 16 4.603 6.917 0.764 1.00 0.00 C ATOM 254 O GLN p 16 5.727 6.487 0.574 1.00 0.00 O ATOM 255 CB GLN p 16 4.411 9.256 0.070 1.00 0.00 C ATOM 256 CG GLN p 16 3.747 10.277 -0.804 1.00 0.00 C ATOM 257 CD GLN p 16 4.729 11.151 -1.559 1.00 0.00 C ATOM 258 OE1 GLN p 16 5.139 12.206 -1.075 1.00 0.00 O ATOM 259 NE2 GLN p 16 5.112 10.716 -2.754 1.00 0.00 N ATOM 0 H GLN p 16 2.106 8.275 0.704 1.00 0.00 H new ATOM 0 HA GLN p 16 4.181 7.611 -1.251 1.00 0.00 H new ATOM 0 HB2 GLN p 16 4.217 9.498 1.115 1.00 0.00 H new ATOM 0 HB3 GLN p 16 5.490 9.309 -0.074 1.00 0.00 H new ATOM 0 HG2 GLN p 16 3.101 9.768 -1.519 1.00 0.00 H new ATOM 0 HG3 GLN p 16 3.106 10.910 -0.189 1.00 0.00 H new ATOM 0 HE21 GLN p 16 4.747 9.835 -3.117 1.00 0.00 H new ATOM 0 HE22 GLN p 16 5.771 11.262 -3.309 1.00 0.00 H new ATOM 268 N ALA p 17 3.863 6.718 1.850 1.00 0.00 N ATOM 269 CA ALA p 17 4.233 5.794 2.937 1.00 0.00 C ATOM 270 C ALA p 17 3.718 4.418 2.575 1.00 0.00 C ATOM 271 O ALA p 17 4.132 3.419 3.149 1.00 0.00 O ATOM 272 CB ALA p 17 3.697 6.215 4.298 1.00 0.00 C ATOM 0 H ALA p 17 2.976 7.196 2.010 1.00 0.00 H new ATOM 0 HA ALA p 17 5.319 5.801 3.032 1.00 0.00 H new ATOM 0 HB1 ALA p 17 4.007 5.490 5.051 1.00 0.00 H new ATOM 0 HB2 ALA p 17 4.091 7.198 4.556 1.00 0.00 H new ATOM 0 HB3 ALA p 17 2.608 6.259 4.263 1.00 0.00 H new ATOM 278 N LEU p 18 2.770 4.418 1.622 1.00 0.00 N ATOM 279 CA LEU p 18 2.194 3.219 1.036 1.00 0.00 C ATOM 280 C LEU p 18 3.129 2.836 -0.080 1.00 0.00 C ATOM 281 O LEU p 18 3.331 1.670 -0.383 1.00 0.00 O ATOM 282 CB LEU p 18 0.827 3.530 0.445 1.00 0.00 C ATOM 283 CG LEU p 18 -0.157 2.382 0.253 1.00 0.00 C ATOM 284 CD1 LEU p 18 -1.451 2.983 -0.218 1.00 0.00 C ATOM 285 CD2 LEU p 18 0.348 1.369 -0.764 1.00 0.00 C ATOM 0 H LEU p 18 2.381 5.278 1.236 1.00 0.00 H new ATOM 0 HA LEU p 18 2.073 2.429 1.777 1.00 0.00 H new ATOM 0 HB2 LEU p 18 0.350 4.273 1.084 1.00 0.00 H new ATOM 0 HB3 LEU p 18 0.984 3.999 -0.526 1.00 0.00 H new ATOM 0 HG LEU p 18 -0.285 1.846 1.194 1.00 0.00 H new ATOM 0 HD11 LEU p 18 -2.186 2.192 -0.368 1.00 0.00 H new ATOM 0 HD12 LEU p 18 -1.820 3.684 0.530 1.00 0.00 H new ATOM 0 HD13 LEU p 18 -1.287 3.509 -1.158 1.00 0.00 H new ATOM 0 HD21 LEU p 18 -0.382 0.567 -0.872 1.00 0.00 H new ATOM 0 HD22 LEU p 18 0.492 1.860 -1.726 1.00 0.00 H new ATOM 0 HD23 LEU p 18 1.296 0.953 -0.423 1.00 0.00 H new ATOM 297 N GLU p 19 3.638 3.906 -0.699 1.00 0.00 N ATOM 298 CA GLU p 19 4.613 3.875 -1.746 1.00 0.00 C ATOM 299 C GLU p 19 5.957 3.509 -1.145 1.00 0.00 C ATOM 300 O GLU p 19 6.731 2.777 -1.730 1.00 0.00 O ATOM 301 CB GLU p 19 4.664 5.269 -2.310 1.00 0.00 C ATOM 302 CG GLU p 19 5.389 5.374 -3.598 1.00 0.00 C ATOM 303 CD GLU p 19 4.474 5.517 -4.798 1.00 0.00 C ATOM 304 OE1 GLU p 19 4.002 4.481 -5.311 1.00 0.00 O ATOM 305 OE2 GLU p 19 4.230 6.665 -5.226 1.00 0.00 O ATOM 0 H GLU p 19 3.354 4.855 -0.457 1.00 0.00 H new ATOM 0 HA GLU p 19 4.368 3.148 -2.520 1.00 0.00 H new ATOM 0 HB2 GLU p 19 3.645 5.631 -2.448 1.00 0.00 H new ATOM 0 HB3 GLU p 19 5.140 5.927 -1.583 1.00 0.00 H new ATOM 0 HG2 GLU p 19 6.060 6.232 -3.559 1.00 0.00 H new ATOM 0 HG3 GLU p 19 6.011 4.488 -3.729 1.00 0.00 H new ATOM 312 N LYS p 20 6.200 4.118 0.013 1.00 0.00 N ATOM 313 CA LYS p 20 7.391 3.893 0.839 1.00 0.00 C ATOM 314 C LYS p 20 7.248 2.578 1.588 1.00 0.00 C ATOM 315 O LYS p 20 8.212 2.061 2.139 1.00 0.00 O ATOM 316 CB LYS p 20 7.576 5.032 1.833 1.00 0.00 C ATOM 317 CG LYS p 20 8.961 5.651 1.826 1.00 0.00 C ATOM 318 CD LYS p 20 9.767 5.228 3.044 1.00 0.00 C ATOM 319 CE LYS p 20 11.146 5.865 3.054 1.00 0.00 C ATOM 320 NZ LYS p 20 11.938 5.450 4.244 1.00 0.00 N ATOM 0 H LYS p 20 5.559 4.801 0.417 1.00 0.00 H new ATOM 0 HA LYS p 20 8.266 3.853 0.190 1.00 0.00 H new ATOM 0 HB2 LYS p 20 6.843 5.809 1.617 1.00 0.00 H new ATOM 0 HB3 LYS p 20 7.362 4.662 2.836 1.00 0.00 H new ATOM 0 HG2 LYS p 20 9.488 5.355 0.919 1.00 0.00 H new ATOM 0 HG3 LYS p 20 8.875 6.737 1.805 1.00 0.00 H new ATOM 0 HD2 LYS p 20 9.230 5.508 3.951 1.00 0.00 H new ATOM 0 HD3 LYS p 20 9.867 4.143 3.055 1.00 0.00 H new ATOM 0 HE2 LYS p 20 11.681 5.587 2.146 1.00 0.00 H new ATOM 0 HE3 LYS p 20 11.045 6.950 3.045 1.00 0.00 H new ATOM 0 HZ1 LYS p 20 12.873 5.905 4.215 1.00 0.00 H new ATOM 0 HZ2 LYS p 20 11.440 5.738 5.110 1.00 0.00 H new ATOM 0 HZ3 LYS p 20 12.056 4.417 4.239 1.00 0.00 H new ATOM 334 N GLU p 21 6.002 2.087 1.616 1.00 0.00 N ATOM 335 CA GLU p 21 5.648 0.800 2.190 1.00 0.00 C ATOM 336 C GLU p 21 5.758 -0.166 1.034 1.00 0.00 C ATOM 337 O GLU p 21 6.093 -1.343 1.188 1.00 0.00 O ATOM 338 CB GLU p 21 4.233 0.839 2.786 1.00 0.00 C ATOM 339 CG GLU p 21 3.428 -0.446 2.658 1.00 0.00 C ATOM 340 CD GLU p 21 3.092 -1.066 4.000 1.00 0.00 C ATOM 341 OE1 GLU p 21 2.052 -0.694 4.583 1.00 0.00 O ATOM 342 OE2 GLU p 21 3.872 -1.922 4.471 1.00 0.00 O ATOM 0 H GLU p 21 5.203 2.590 1.231 1.00 0.00 H new ATOM 0 HA GLU p 21 6.296 0.509 3.017 1.00 0.00 H new ATOM 0 HB2 GLU p 21 4.311 1.094 3.843 1.00 0.00 H new ATOM 0 HB3 GLU p 21 3.678 1.644 2.304 1.00 0.00 H new ATOM 0 HG2 GLU p 21 2.504 -0.238 2.118 1.00 0.00 H new ATOM 0 HG3 GLU p 21 3.991 -1.164 2.062 1.00 0.00 H new ATOM 349 N LEU p 22 5.450 0.404 -0.139 1.00 0.00 N ATOM 350 CA LEU p 22 5.572 -0.275 -1.404 1.00 0.00 C ATOM 351 C LEU p 22 7.050 -0.334 -1.731 1.00 0.00 C ATOM 352 O LEU p 22 7.590 -1.392 -2.038 1.00 0.00 O ATOM 353 CB LEU p 22 4.820 0.515 -2.477 1.00 0.00 C ATOM 354 CG LEU p 22 4.280 -0.255 -3.678 1.00 0.00 C ATOM 355 CD1 LEU p 22 3.513 0.712 -4.549 1.00 0.00 C ATOM 356 CD2 LEU p 22 5.402 -0.902 -4.471 1.00 0.00 C ATOM 0 H LEU p 22 5.107 1.361 -0.220 1.00 0.00 H new ATOM 0 HA LEU p 22 5.149 -1.279 -1.362 1.00 0.00 H new ATOM 0 HB2 LEU p 22 3.981 1.018 -1.996 1.00 0.00 H new ATOM 0 HB3 LEU p 22 5.487 1.293 -2.850 1.00 0.00 H new ATOM 0 HG LEU p 22 3.628 -1.056 -3.331 1.00 0.00 H new ATOM 0 HD11 LEU p 22 3.116 0.184 -5.416 1.00 0.00 H new ATOM 0 HD12 LEU p 22 2.690 1.142 -3.978 1.00 0.00 H new ATOM 0 HD13 LEU p 22 4.179 1.508 -4.882 1.00 0.00 H new ATOM 0 HD21 LEU p 22 4.983 -1.443 -5.320 1.00 0.00 H new ATOM 0 HD22 LEU p 22 6.083 -0.132 -4.832 1.00 0.00 H new ATOM 0 HD23 LEU p 22 5.946 -1.597 -3.831 1.00 0.00 H new ATOM 368 N ALA p 23 7.693 0.833 -1.595 1.00 0.00 N ATOM 369 CA ALA p 23 9.139 0.974 -1.835 1.00 0.00 C ATOM 370 C ALA p 23 9.955 0.280 -0.744 1.00 0.00 C ATOM 371 O ALA p 23 11.146 0.079 -0.904 1.00 0.00 O ATOM 372 CB ALA p 23 9.546 2.439 -1.943 1.00 0.00 C ATOM 0 H ALA p 23 7.233 1.700 -1.318 1.00 0.00 H new ATOM 0 HA ALA p 23 9.353 0.488 -2.787 1.00 0.00 H new ATOM 0 HB1 ALA p 23 10.619 2.506 -2.120 1.00 0.00 H new ATOM 0 HB2 ALA p 23 9.012 2.905 -2.771 1.00 0.00 H new ATOM 0 HB3 ALA p 23 9.298 2.955 -1.015 1.00 0.00 H new ATOM 378 N GLN p 24 9.277 -0.084 0.354 1.00 0.00 N ATOM 379 CA GLN p 24 9.877 -0.784 1.493 1.00 0.00 C ATOM 380 C GLN p 24 9.812 -2.290 1.256 1.00 0.00 C ATOM 381 O GLN p 24 10.549 -3.062 1.854 1.00 0.00 O ATOM 382 CB GLN p 24 9.103 -0.394 2.754 1.00 0.00 C ATOM 383 CG GLN p 24 9.065 -1.439 3.853 1.00 0.00 C ATOM 384 CD GLN p 24 9.646 -0.948 5.164 1.00 0.00 C ATOM 385 OE1 GLN p 24 8.936 -0.393 6.002 1.00 0.00 O ATOM 386 NE2 GLN p 24 10.945 -1.154 5.350 1.00 0.00 N ATOM 0 H GLN p 24 8.282 0.104 0.475 1.00 0.00 H new ATOM 0 HA GLN p 24 10.924 -0.506 1.612 1.00 0.00 H new ATOM 0 HB2 GLN p 24 9.542 0.517 3.160 1.00 0.00 H new ATOM 0 HB3 GLN p 24 8.078 -0.155 2.470 1.00 0.00 H new ATOM 0 HG2 GLN p 24 8.033 -1.750 4.014 1.00 0.00 H new ATOM 0 HG3 GLN p 24 9.616 -2.321 3.526 1.00 0.00 H new ATOM 0 HE21 GLN p 24 11.496 -1.618 4.628 1.00 0.00 H new ATOM 0 HE22 GLN p 24 11.391 -0.848 6.215 1.00 0.00 H new ATOM 395 N LEU p 25 8.883 -2.642 0.380 1.00 0.00 N ATOM 396 CA LEU p 25 8.594 -3.999 -0.059 1.00 0.00 C ATOM 397 C LEU p 25 9.548 -4.358 -1.191 1.00 0.00 C ATOM 398 O LEU p 25 10.059 -5.468 -1.276 1.00 0.00 O ATOM 399 CB LEU p 25 7.151 -4.014 -0.572 1.00 0.00 C ATOM 400 CG LEU p 25 6.415 -5.353 -0.621 1.00 0.00 C ATOM 401 CD1 LEU p 25 4.992 -5.081 -1.038 1.00 0.00 C ATOM 402 CD2 LEU p 25 7.065 -6.323 -1.599 1.00 0.00 C ATOM 0 H LEU p 25 8.279 -1.953 -0.067 1.00 0.00 H new ATOM 0 HA LEU p 25 8.717 -4.717 0.752 1.00 0.00 H new ATOM 0 HB2 LEU p 25 6.569 -3.337 0.053 1.00 0.00 H new ATOM 0 HB3 LEU p 25 7.151 -3.597 -1.579 1.00 0.00 H new ATOM 0 HG LEU p 25 6.455 -5.819 0.364 1.00 0.00 H new ATOM 0 HD11 LEU p 25 4.440 -6.020 -1.082 1.00 0.00 H new ATOM 0 HD12 LEU p 25 4.521 -4.417 -0.313 1.00 0.00 H new ATOM 0 HD13 LEU p 25 4.985 -4.609 -2.021 1.00 0.00 H new ATOM 0 HD21 LEU p 25 6.511 -7.262 -1.603 1.00 0.00 H new ATOM 0 HD22 LEU p 25 7.055 -5.892 -2.600 1.00 0.00 H new ATOM 0 HD23 LEU p 25 8.095 -6.511 -1.295 1.00 0.00 H new ATOM 414 N GLU p 26 9.701 -3.371 -2.064 1.00 0.00 N ATOM 415 CA GLU p 26 10.581 -3.382 -3.220 1.00 0.00 C ATOM 416 C GLU p 26 11.991 -3.167 -2.746 1.00 0.00 C ATOM 417 O GLU p 26 12.936 -3.543 -3.413 1.00 0.00 O ATOM 418 CB GLU p 26 10.214 -2.269 -4.193 1.00 0.00 C ATOM 419 CG GLU p 26 8.729 -2.139 -4.448 1.00 0.00 C ATOM 420 CD GLU p 26 8.370 -2.209 -5.920 1.00 0.00 C ATOM 421 OE1 GLU p 26 8.344 -1.147 -6.576 1.00 0.00 O ATOM 422 OE2 GLU p 26 8.112 -3.326 -6.417 1.00 0.00 O ATOM 0 H GLU p 26 9.186 -2.495 -1.978 1.00 0.00 H new ATOM 0 HA GLU p 26 10.482 -4.339 -3.733 1.00 0.00 H new ATOM 0 HB2 GLU p 26 10.590 -1.322 -3.804 1.00 0.00 H new ATOM 0 HB3 GLU p 26 10.721 -2.448 -5.141 1.00 0.00 H new ATOM 0 HG2 GLU p 26 8.204 -2.931 -3.914 1.00 0.00 H new ATOM 0 HG3 GLU p 26 8.378 -1.192 -4.039 1.00 0.00 H new ATOM 429 N LYS p 27 12.086 -2.476 -1.606 1.00 0.00 N ATOM 430 CA LYS p 27 13.368 -2.248 -0.923 1.00 0.00 C ATOM 431 C LYS p 27 13.627 -3.436 -0.023 1.00 0.00 C ATOM 432 O LYS p 27 14.769 -3.742 0.318 1.00 0.00 O ATOM 433 CB LYS p 27 13.405 -0.949 -0.120 1.00 0.00 C ATOM 434 CG LYS p 27 14.119 0.191 -0.835 1.00 0.00 C ATOM 435 CD LYS p 27 15.590 0.269 -0.449 1.00 0.00 C ATOM 436 CE LYS p 27 16.307 1.381 -1.197 1.00 0.00 C ATOM 437 NZ LYS p 27 17.759 1.424 -0.871 1.00 0.00 N ATOM 0 H LYS p 27 11.284 -2.061 -1.132 1.00 0.00 H new ATOM 0 HA LYS p 27 14.147 -2.144 -1.678 1.00 0.00 H new ATOM 0 HB2 LYS p 27 12.384 -0.642 0.105 1.00 0.00 H new ATOM 0 HB3 LYS p 27 13.900 -1.135 0.833 1.00 0.00 H new ATOM 0 HG2 LYS p 27 14.033 0.054 -1.913 1.00 0.00 H new ATOM 0 HG3 LYS p 27 13.630 1.134 -0.593 1.00 0.00 H new ATOM 0 HD2 LYS p 27 15.677 0.437 0.624 1.00 0.00 H new ATOM 0 HD3 LYS p 27 16.074 -0.684 -0.662 1.00 0.00 H new ATOM 0 HE2 LYS p 27 16.180 1.237 -2.270 1.00 0.00 H new ATOM 0 HE3 LYS p 27 15.851 2.339 -0.948 1.00 0.00 H new ATOM 0 HZ1 LYS p 27 18.211 2.196 -1.401 1.00 0.00 H new ATOM 0 HZ2 LYS p 27 17.881 1.587 0.149 1.00 0.00 H new ATOM 0 HZ3 LYS p 27 18.200 0.519 -1.132 1.00 0.00 H new ATOM 451 N GLU p 28 12.524 -4.094 0.367 1.00 0.00 N ATOM 452 CA GLU p 28 12.557 -5.310 1.117 1.00 0.00 C ATOM 453 C GLU p 28 12.999 -6.375 0.139 1.00 0.00 C ATOM 454 O GLU p 28 13.731 -7.310 0.457 1.00 0.00 O ATOM 455 CB GLU p 28 11.146 -5.578 1.581 1.00 0.00 C ATOM 456 CG GLU p 28 11.015 -6.760 2.467 1.00 0.00 C ATOM 457 CD GLU p 28 10.641 -6.410 3.895 1.00 0.00 C ATOM 458 OE1 GLU p 28 11.559 -6.181 4.710 1.00 0.00 O ATOM 459 OE2 GLU p 28 9.430 -6.365 4.197 1.00 0.00 O ATOM 0 H GLU p 28 11.580 -3.771 0.155 1.00 0.00 H new ATOM 0 HA GLU p 28 13.222 -5.279 1.980 1.00 0.00 H new ATOM 0 HB2 GLU p 28 10.775 -4.699 2.108 1.00 0.00 H new ATOM 0 HB3 GLU p 28 10.508 -5.719 0.708 1.00 0.00 H new ATOM 0 HG2 GLU p 28 10.259 -7.430 2.056 1.00 0.00 H new ATOM 0 HG3 GLU p 28 11.958 -7.307 2.471 1.00 0.00 H new ATOM 466 N LEU p 29 12.482 -6.172 -1.066 1.00 0.00 N ATOM 467 CA LEU p 29 12.772 -6.995 -2.219 1.00 0.00 C ATOM 468 C LEU p 29 14.162 -6.688 -2.773 1.00 0.00 C ATOM 469 O LEU p 29 14.935 -7.598 -3.086 1.00 0.00 O ATOM 470 CB LEU p 29 11.726 -6.697 -3.291 1.00 0.00 C ATOM 471 CG LEU p 29 11.285 -7.843 -4.197 1.00 0.00 C ATOM 472 CD1 LEU p 29 10.276 -7.298 -5.181 1.00 0.00 C ATOM 473 CD2 LEU p 29 12.464 -8.457 -4.933 1.00 0.00 C ATOM 0 H LEU p 29 11.834 -5.410 -1.267 1.00 0.00 H new ATOM 0 HA LEU p 29 12.745 -8.045 -1.928 1.00 0.00 H new ATOM 0 HB2 LEU p 29 10.839 -6.304 -2.793 1.00 0.00 H new ATOM 0 HB3 LEU p 29 12.115 -5.900 -3.925 1.00 0.00 H new ATOM 0 HG LEU p 29 10.841 -8.633 -3.592 1.00 0.00 H new ATOM 0 HD11 LEU p 29 9.944 -8.098 -5.842 1.00 0.00 H new ATOM 0 HD12 LEU p 29 9.420 -6.896 -4.639 1.00 0.00 H new ATOM 0 HD13 LEU p 29 10.736 -6.506 -5.772 1.00 0.00 H new ATOM 0 HD21 LEU p 29 12.113 -9.270 -5.569 1.00 0.00 H new ATOM 0 HD22 LEU p 29 12.945 -7.697 -5.549 1.00 0.00 H new ATOM 0 HD23 LEU p 29 13.182 -8.846 -4.210 1.00 0.00 H new ATOM 485 N GLN p 30 14.453 -5.391 -2.887 1.00 0.00 N ATOM 486 CA GLN p 30 15.742 -4.919 -3.439 1.00 0.00 C ATOM 487 C GLN p 30 16.944 -5.130 -2.502 1.00 0.00 C ATOM 488 O GLN p 30 17.995 -5.612 -2.934 1.00 0.00 O ATOM 489 CB GLN p 30 15.600 -3.439 -3.893 1.00 0.00 C ATOM 490 CG GLN p 30 16.507 -2.408 -3.217 1.00 0.00 C ATOM 491 CD GLN p 30 17.848 -2.262 -3.913 1.00 0.00 C ATOM 492 OE1 GLN p 30 18.815 -2.944 -3.573 1.00 0.00 O ATOM 493 NE2 GLN p 30 17.911 -1.370 -4.895 1.00 0.00 N ATOM 0 H GLN p 30 13.819 -4.642 -2.607 1.00 0.00 H new ATOM 0 HA GLN p 30 15.969 -5.541 -4.305 1.00 0.00 H new ATOM 0 HB2 GLN p 30 15.783 -3.396 -4.967 1.00 0.00 H new ATOM 0 HB3 GLN p 30 14.566 -3.135 -3.733 1.00 0.00 H new ATOM 0 HG2 GLN p 30 16.003 -1.442 -3.202 1.00 0.00 H new ATOM 0 HG3 GLN p 30 16.671 -2.699 -2.179 1.00 0.00 H new ATOM 0 HE21 GLN p 30 17.085 -0.826 -5.144 1.00 0.00 H new ATOM 0 HE22 GLN p 30 18.786 -1.229 -5.400 1.00 0.00 H new ATOM 502 N ALA p 31 16.768 -4.772 -1.245 1.00 0.00 N ATOM 503 CA ALA p 31 17.842 -4.867 -0.244 1.00 0.00 C ATOM 504 C ALA p 31 17.875 -6.204 0.505 1.00 0.00 C ATOM 505 O ALA p 31 18.944 -6.806 0.643 1.00 0.00 O ATOM 506 CB ALA p 31 17.745 -3.712 0.743 1.00 0.00 C ATOM 0 H ALA p 31 15.888 -4.408 -0.879 1.00 0.00 H new ATOM 0 HA ALA p 31 18.779 -4.808 -0.798 1.00 0.00 H new ATOM 0 HB1 ALA p 31 18.545 -3.794 1.479 1.00 0.00 H new ATOM 0 HB2 ALA p 31 17.839 -2.767 0.208 1.00 0.00 H new ATOM 0 HB3 ALA p 31 16.781 -3.747 1.250 1.00 0.00 H new ATOM 512 N TRP p 32 16.712 -6.666 0.985 1.00 0.00 N ATOM 513 CA TRP p 32 16.634 -7.922 1.745 1.00 0.00 C ATOM 514 C TRP p 32 16.396 -9.140 0.845 1.00 0.00 C ATOM 515 O TRP p 32 16.803 -10.253 1.189 1.00 0.00 O ATOM 516 CB TRP p 32 15.530 -7.832 2.800 1.00 0.00 C ATOM 517 CG TRP p 32 15.972 -8.280 4.163 1.00 0.00 C ATOM 518 CD1 TRP p 32 15.927 -9.551 4.660 1.00 0.00 C ATOM 519 CD2 TRP p 32 16.523 -7.461 5.208 1.00 0.00 C ATOM 520 NE1 TRP p 32 16.415 -9.575 5.944 1.00 0.00 N ATOM 521 CE2 TRP p 32 16.788 -8.306 6.303 1.00 0.00 C ATOM 522 CE3 TRP p 32 16.821 -6.096 5.326 1.00 0.00 C ATOM 523 CZ2 TRP p 32 17.332 -7.834 7.494 1.00 0.00 C ATOM 524 CZ3 TRP p 32 17.361 -5.632 6.510 1.00 0.00 C ATOM 525 CH2 TRP p 32 17.613 -6.499 7.580 1.00 0.00 C ATOM 0 H TRP p 32 15.817 -6.192 0.862 1.00 0.00 H new ATOM 0 HA TRP p 32 17.600 -8.061 2.231 1.00 0.00 H new ATOM 0 HB2 TRP p 32 15.178 -6.802 2.860 1.00 0.00 H new ATOM 0 HB3 TRP p 32 14.683 -8.440 2.482 1.00 0.00 H new ATOM 0 HD1 TRP p 32 15.561 -10.413 4.122 1.00 0.00 H new ATOM 0 HE1 TRP p 32 16.488 -10.403 6.535 1.00 0.00 H new ATOM 0 HE3 TRP p 32 16.632 -5.419 4.506 1.00 0.00 H new ATOM 0 HZ2 TRP p 32 17.526 -8.500 8.322 1.00 0.00 H new ATOM 0 HZ3 TRP p 32 17.593 -4.582 6.612 1.00 0.00 H new ATOM 0 HH2 TRP p 32 18.038 -6.105 8.492 1.00 0.00 H new ATOM 536 N ASN p 33 15.731 -8.921 -0.310 1.00 0.00 N ATOM 537 CA ASN p 33 15.410 -9.988 -1.296 1.00 0.00 C ATOM 538 C ASN p 33 14.467 -11.049 -0.708 1.00 0.00 C ATOM 539 O ASN p 33 14.450 -11.274 0.506 1.00 0.00 O ATOM 540 CB ASN p 33 16.683 -10.660 -1.844 1.00 0.00 C ATOM 541 CG ASN p 33 17.521 -9.719 -2.691 1.00 0.00 C ATOM 542 OD1 ASN p 33 17.344 -9.636 -3.906 1.00 0.00 O ATOM 543 ND2 ASN p 33 18.437 -9.004 -2.050 1.00 0.00 N ATOM 0 H ASN p 33 15.399 -7.998 -0.590 1.00 0.00 H new ATOM 0 HA ASN p 33 14.896 -9.497 -2.123 1.00 0.00 H new ATOM 0 HB2 ASN p 33 17.284 -11.026 -1.011 1.00 0.00 H new ATOM 0 HB3 ASN p 33 16.403 -11.528 -2.441 1.00 0.00 H new ATOM 0 HD21 ASN p 33 19.029 -8.353 -2.566 1.00 0.00 H new ATOM 0 HD22 ASN p 33 18.549 -9.105 -1.041 1.00 0.00 H new ATOM 550 N CYS p 34 13.689 -11.694 -1.585 1.00 0.00 N ATOM 551 CA CYS p 34 12.736 -12.727 -1.173 1.00 0.00 C ATOM 552 C CYS p 34 13.349 -14.122 -1.281 1.00 0.00 C ATOM 553 O CYS p 34 13.909 -14.486 -2.320 1.00 0.00 O ATOM 554 CB CYS p 34 11.466 -12.647 -2.024 1.00 0.00 C ATOM 555 SG CYS p 34 11.756 -12.807 -3.802 1.00 0.00 S ATOM 0 H CYS p 34 13.702 -11.516 -2.589 1.00 0.00 H new ATOM 0 HA CYS p 34 12.480 -12.548 -0.129 1.00 0.00 H new ATOM 0 HB2 CYS p 34 10.779 -13.432 -1.707 1.00 0.00 H new ATOM 0 HB3 CYS p 34 10.972 -11.694 -1.832 1.00 0.00 H new ATOM 0 HG CYS p 34 12.771 -13.593 -4.007 1.00 0.00 H new ATOM 561 N ILE p 35 13.231 -14.892 -0.194 1.00 0.00 N ATOM 562 CA ILE p 35 13.761 -16.256 -0.138 1.00 0.00 C ATOM 563 C ILE p 35 12.628 -17.283 -0.332 1.00 0.00 C ATOM 564 O ILE p 35 11.459 -16.983 -0.070 1.00 0.00 O ATOM 565 CB ILE p 35 14.551 -16.498 1.201 1.00 0.00 C ATOM 566 CG1 ILE p 35 15.388 -17.790 1.148 1.00 0.00 C ATOM 567 CG2 ILE p 35 13.631 -16.513 2.426 1.00 0.00 C ATOM 568 CD1 ILE p 35 16.753 -17.615 0.509 1.00 0.00 C ATOM 0 H ILE p 35 12.769 -14.590 0.664 1.00 0.00 H new ATOM 0 HA ILE p 35 14.469 -16.389 -0.956 1.00 0.00 H new ATOM 0 HB ILE p 35 15.231 -15.653 1.305 1.00 0.00 H new ATOM 0 HG12 ILE p 35 15.519 -18.168 2.162 1.00 0.00 H new ATOM 0 HG13 ILE p 35 14.833 -18.548 0.594 1.00 0.00 H new ATOM 0 HG21 ILE p 35 14.224 -16.683 3.324 1.00 0.00 H new ATOM 0 HG22 ILE p 35 13.117 -15.555 2.507 1.00 0.00 H new ATOM 0 HG23 ILE p 35 12.896 -17.311 2.320 1.00 0.00 H new ATOM 0 HD11 ILE p 35 17.280 -18.569 0.510 1.00 0.00 H new ATOM 0 HD12 ILE p 35 16.633 -17.268 -0.517 1.00 0.00 H new ATOM 0 HD13 ILE p 35 17.328 -16.882 1.075 1.00 0.00 H new ATOM 580 N CYS p 36 12.994 -18.486 -0.791 1.00 0.00 N ATOM 581 CA CYS p 36 12.024 -19.558 -1.030 1.00 0.00 C ATOM 582 C CYS p 36 11.900 -20.487 0.181 1.00 0.00 C ATOM 583 O CYS p 36 10.789 -20.751 0.649 1.00 0.00 O ATOM 584 CB CYS p 36 12.414 -20.358 -2.278 1.00 0.00 C ATOM 585 SG CYS p 36 12.486 -19.375 -3.794 1.00 0.00 S ATOM 0 H CYS p 36 13.958 -18.740 -1.004 1.00 0.00 H new ATOM 0 HA CYS p 36 11.051 -19.095 -1.193 1.00 0.00 H new ATOM 0 HB2 CYS p 36 13.387 -20.820 -2.111 1.00 0.00 H new ATOM 0 HB3 CYS p 36 11.697 -21.167 -2.416 1.00 0.00 H new ATOM 0 HG CYS p 36 12.825 -20.138 -4.790 1.00 0.00 H new ATOM 591 N ASP p 37 13.046 -20.981 0.682 1.00 0.00 N ATOM 592 CA ASP p 37 13.067 -21.885 1.838 1.00 0.00 C ATOM 593 C ASP p 37 14.257 -21.592 2.749 1.00 0.00 C ATOM 594 O ASP p 37 15.401 -21.528 2.289 1.00 0.00 O ATOM 595 CB ASP p 37 13.119 -23.351 1.381 1.00 0.00 C ATOM 596 CG ASP p 37 11.823 -23.807 0.735 1.00 0.00 C ATOM 597 OD1 ASP p 37 10.938 -24.300 1.464 1.00 0.00 O ATOM 598 OD2 ASP p 37 11.696 -23.668 -0.499 1.00 0.00 O ATOM 0 H ASP p 37 13.968 -20.767 0.302 1.00 0.00 H new ATOM 0 HA ASP p 37 12.148 -21.717 2.400 1.00 0.00 H new ATOM 0 HB2 ASP p 37 13.938 -23.478 0.673 1.00 0.00 H new ATOM 0 HB3 ASP p 37 13.337 -23.988 2.239 1.00 0.00 H new ATOM 603 N ILE p 38 13.968 -21.410 4.044 1.00 0.00 N ATOM 604 CA ILE p 38 15.000 -21.132 5.050 1.00 0.00 C ATOM 605 C ILE p 38 14.624 -21.775 6.403 1.00 0.00 C ATOM 606 O ILE p 38 15.445 -22.464 7.014 1.00 0.00 O ATOM 607 CB ILE p 38 15.284 -19.584 5.188 1.00 0.00 C ATOM 608 CG1 ILE p 38 16.457 -19.300 6.147 1.00 0.00 C ATOM 609 CG2 ILE p 38 14.046 -18.787 5.615 1.00 0.00 C ATOM 610 CD1 ILE p 38 17.822 -19.378 5.490 1.00 0.00 C ATOM 0 H ILE p 38 13.021 -21.451 4.421 1.00 0.00 H new ATOM 0 HA ILE p 38 15.931 -21.586 4.712 1.00 0.00 H new ATOM 0 HB ILE p 38 15.562 -19.246 4.190 1.00 0.00 H new ATOM 0 HG12 ILE p 38 16.329 -18.307 6.578 1.00 0.00 H new ATOM 0 HG13 ILE p 38 16.420 -20.013 6.971 1.00 0.00 H new ATOM 0 HG21 ILE p 38 14.303 -17.731 5.693 1.00 0.00 H new ATOM 0 HG22 ILE p 38 13.257 -18.915 4.874 1.00 0.00 H new ATOM 0 HG23 ILE p 38 13.697 -19.148 6.582 1.00 0.00 H new ATOM 0 HD11 ILE p 38 18.594 -19.166 6.229 1.00 0.00 H new ATOM 0 HD12 ILE p 38 17.973 -20.378 5.083 1.00 0.00 H new ATOM 0 HD13 ILE p 38 17.880 -18.646 4.684 1.00 0.00 H new ATOM 622 N GLU p 39 13.382 -21.539 6.848 1.00 0.00 N ATOM 623 CA GLU p 39 12.880 -22.088 8.113 1.00 0.00 C ATOM 624 C GLU p 39 11.449 -22.604 7.951 1.00 0.00 C ATOM 625 O GLU p 39 11.126 -23.704 8.406 1.00 0.00 O ATOM 626 CB GLU p 39 12.930 -21.031 9.230 1.00 0.00 C ATOM 627 CG GLU p 39 14.339 -20.597 9.605 1.00 0.00 C ATOM 628 CD GLU p 39 14.388 -19.850 10.923 1.00 0.00 C ATOM 629 OE1 GLU p 39 14.557 -20.506 11.972 1.00 0.00 O ATOM 630 OE2 GLU p 39 14.256 -18.608 10.906 1.00 0.00 O ATOM 0 H GLU p 39 12.703 -20.967 6.346 1.00 0.00 H new ATOM 0 HA GLU p 39 13.526 -22.921 8.391 1.00 0.00 H new ATOM 0 HB2 GLU p 39 12.363 -20.156 8.914 1.00 0.00 H new ATOM 0 HB3 GLU p 39 12.435 -21.429 10.116 1.00 0.00 H new ATOM 0 HG2 GLU p 39 14.982 -21.475 9.665 1.00 0.00 H new ATOM 0 HG3 GLU p 39 14.741 -19.961 8.816 1.00 0.00 H new ATOM 637 N ASN p 40 10.593 -21.790 7.289 1.00 0.00 N ATOM 638 CA ASN p 40 9.169 -22.116 7.034 1.00 0.00 C ATOM 639 C ASN p 40 8.403 -22.412 8.336 1.00 0.00 C ATOM 640 O ASN p 40 8.564 -23.480 8.940 1.00 0.00 O ATOM 641 CB ASN p 40 9.035 -23.293 6.039 1.00 0.00 C ATOM 642 CG ASN p 40 7.715 -23.293 5.278 1.00 0.00 C ATOM 643 OD1 ASN p 40 7.165 -22.240 4.948 1.00 0.00 O ATOM 644 ND2 ASN p 40 7.199 -24.484 4.996 1.00 0.00 N ATOM 0 H ASN p 40 10.872 -20.883 6.915 1.00 0.00 H new ATOM 0 HA ASN p 40 8.716 -21.233 6.583 1.00 0.00 H new ATOM 0 HB2 ASN p 40 9.858 -23.251 5.325 1.00 0.00 H new ATOM 0 HB3 ASN p 40 9.132 -24.232 6.583 1.00 0.00 H new ATOM 0 HD21 ASN p 40 6.317 -24.550 4.489 1.00 0.00 H new ATOM 0 HD22 ASN p 40 7.685 -25.332 5.287 1.00 0.00 H new ATOM 651 N CYS p 41 7.581 -21.443 8.757 1.00 0.00 N ATOM 652 CA CYS p 41 6.775 -21.569 9.974 1.00 0.00 C ATOM 653 C CYS p 41 5.366 -21.026 9.746 1.00 0.00 C ATOM 654 O CYS p 41 5.182 -19.828 9.494 1.00 0.00 O ATOM 655 CB CYS p 41 7.442 -20.833 11.144 1.00 0.00 C ATOM 656 SG CYS p 41 9.093 -21.444 11.555 1.00 0.00 S ATOM 0 H CYS p 41 7.457 -20.557 8.267 1.00 0.00 H new ATOM 0 HA CYS p 41 6.704 -22.628 10.224 1.00 0.00 H new ATOM 0 HB2 CYS p 41 7.509 -19.772 10.901 1.00 0.00 H new ATOM 0 HB3 CYS p 41 6.805 -20.919 12.024 1.00 0.00 H new ATOM 0 HG CYS p 41 9.348 -22.509 10.855 1.00 0.00 H new ATOM 662 N SER p 42 4.375 -21.923 9.823 1.00 0.00 N ATOM 663 CA SER p 42 2.968 -21.558 9.629 1.00 0.00 C ATOM 664 C SER p 42 2.071 -22.254 10.654 1.00 0.00 C ATOM 665 O SER p 42 1.201 -21.616 11.253 1.00 0.00 O ATOM 666 CB SER p 42 2.511 -21.909 8.207 1.00 0.00 C ATOM 667 OG SER p 42 3.282 -21.219 7.238 1.00 0.00 O ATOM 0 H SER p 42 4.524 -22.913 10.020 1.00 0.00 H new ATOM 0 HA SER p 42 2.881 -20.481 9.773 1.00 0.00 H new ATOM 0 HB2 SER p 42 2.599 -22.984 8.048 1.00 0.00 H new ATOM 0 HB3 SER p 42 1.458 -21.654 8.087 1.00 0.00 H new ATOM 0 HG SER p 42 2.972 -21.461 6.340 1.00 0.00 H new ATOM 673 N ASN p 43 2.299 -23.576 10.849 1.00 0.00 N ATOM 674 CA ASN p 43 1.532 -24.429 11.796 1.00 0.00 C ATOM 675 C ASN p 43 0.088 -24.667 11.323 1.00 0.00 C ATOM 676 O ASN p 43 -0.332 -25.818 11.166 1.00 0.00 O ATOM 677 CB ASN p 43 1.543 -23.864 13.233 1.00 0.00 C ATOM 678 CG ASN p 43 2.922 -23.900 13.864 1.00 0.00 C ATOM 679 OD1 ASN p 43 3.299 -24.880 14.506 1.00 0.00 O ATOM 680 ND2 ASN p 43 3.683 -22.828 13.682 1.00 0.00 N ATOM 0 H ASN p 43 3.027 -24.087 10.350 1.00 0.00 H new ATOM 0 HA ASN p 43 2.043 -25.392 11.813 1.00 0.00 H new ATOM 0 HB2 ASN p 43 1.181 -22.836 13.218 1.00 0.00 H new ATOM 0 HB3 ASN p 43 0.850 -24.437 13.850 1.00 0.00 H new ATOM 0 HD21 ASN p 43 4.621 -22.795 14.082 1.00 0.00 H new ATOM 0 HD22 ASN p 43 3.330 -22.038 13.142 1.00 0.00 H new ATOM 687 N MET p 44 -0.661 -23.575 11.103 1.00 0.00 N ATOM 688 CA MET p 44 -2.053 -23.654 10.648 1.00 0.00 C ATOM 689 C MET p 44 -2.317 -22.634 9.544 1.00 0.00 C ATOM 690 O MET p 44 -1.979 -21.456 9.687 1.00 0.00 O ATOM 691 CB MET p 44 -3.022 -23.418 11.814 1.00 0.00 C ATOM 692 CG MET p 44 -3.108 -24.583 12.787 1.00 0.00 C ATOM 693 SD MET p 44 -4.262 -24.276 14.139 1.00 0.00 S ATOM 694 CE MET p 44 -4.123 -25.807 15.057 1.00 0.00 C ATOM 0 H MET p 44 -0.321 -22.623 11.235 1.00 0.00 H new ATOM 0 HA MET p 44 -2.218 -24.656 10.251 1.00 0.00 H new ATOM 0 HB2 MET p 44 -2.711 -22.526 12.357 1.00 0.00 H new ATOM 0 HB3 MET p 44 -4.016 -23.218 11.413 1.00 0.00 H new ATOM 0 HG2 MET p 44 -3.416 -25.479 12.248 1.00 0.00 H new ATOM 0 HG3 MET p 44 -2.118 -24.782 13.198 1.00 0.00 H new ATOM 0 HE1 MET p 44 -4.780 -25.771 15.926 1.00 0.00 H new ATOM 0 HE2 MET p 44 -4.412 -26.642 14.418 1.00 0.00 H new ATOM 0 HE3 MET p 44 -3.093 -25.942 15.386 1.00 0.00 H new ATOM 704 N ALA p 45 -2.928 -23.104 8.437 1.00 0.00 N ATOM 705 CA ALA p 45 -3.266 -22.266 7.261 1.00 0.00 C ATOM 706 C ALA p 45 -2.026 -21.542 6.679 1.00 0.00 C ATOM 707 O ALA p 45 -1.580 -20.536 7.244 1.00 0.00 O ATOM 708 CB ALA p 45 -4.373 -21.261 7.599 1.00 0.00 C ATOM 0 H ALA p 45 -3.203 -24.080 8.330 1.00 0.00 H new ATOM 0 HA ALA p 45 -3.636 -22.941 6.489 1.00 0.00 H new ATOM 0 HB1 ALA p 45 -4.600 -20.660 6.718 1.00 0.00 H new ATOM 0 HB2 ALA p 45 -5.268 -21.798 7.913 1.00 0.00 H new ATOM 0 HB3 ALA p 45 -4.039 -20.609 8.406 1.00 0.00 H new ATOM 714 N PRO p 46 -1.432 -22.049 5.548 1.00 0.00 N ATOM 715 CA PRO p 46 -0.251 -21.419 4.915 1.00 0.00 C ATOM 716 C PRO p 46 -0.586 -20.090 4.225 1.00 0.00 C ATOM 717 O PRO p 46 -1.762 -19.767 4.027 1.00 0.00 O ATOM 718 CB PRO p 46 0.216 -22.454 3.878 1.00 0.00 C ATOM 719 CG PRO p 46 -0.548 -23.703 4.163 1.00 0.00 C ATOM 720 CD PRO p 46 -1.830 -23.270 4.811 1.00 0.00 C ATOM 0 HA PRO p 46 0.508 -21.171 5.657 1.00 0.00 H new ATOM 0 HB2 PRO p 46 0.024 -22.103 2.864 1.00 0.00 H new ATOM 0 HB3 PRO p 46 1.289 -22.628 3.957 1.00 0.00 H new ATOM 0 HG2 PRO p 46 -0.744 -24.258 3.245 1.00 0.00 H new ATOM 0 HG3 PRO p 46 0.017 -24.364 4.821 1.00 0.00 H new ATOM 0 HD2 PRO p 46 -2.605 -23.062 4.074 1.00 0.00 H new ATOM 0 HD3 PRO p 46 -2.223 -24.036 5.480 1.00 0.00 H new ATOM 728 N LEU p 47 0.459 -19.331 3.863 1.00 0.00 N ATOM 729 CA LEU p 47 0.290 -18.027 3.205 1.00 0.00 C ATOM 730 C LEU p 47 1.264 -17.860 2.042 1.00 0.00 C ATOM 731 O LEU p 47 0.873 -17.467 0.940 1.00 0.00 O ATOM 732 CB LEU p 47 0.470 -16.877 4.217 1.00 0.00 C ATOM 733 CG LEU p 47 -0.436 -16.920 5.459 1.00 0.00 C ATOM 734 CD1 LEU p 47 0.119 -16.017 6.550 1.00 0.00 C ATOM 735 CD2 LEU p 47 -1.861 -16.510 5.112 1.00 0.00 C ATOM 0 H LEU p 47 1.431 -19.598 4.015 1.00 0.00 H new ATOM 0 HA LEU p 47 -0.724 -17.990 2.807 1.00 0.00 H new ATOM 0 HB2 LEU p 47 1.508 -16.872 4.550 1.00 0.00 H new ATOM 0 HB3 LEU p 47 0.297 -15.934 3.699 1.00 0.00 H new ATOM 0 HG LEU p 47 -0.457 -17.946 5.826 1.00 0.00 H new ATOM 0 HD11 LEU p 47 -0.533 -16.058 7.423 1.00 0.00 H new ATOM 0 HD12 LEU p 47 1.118 -16.353 6.827 1.00 0.00 H new ATOM 0 HD13 LEU p 47 0.170 -14.992 6.183 1.00 0.00 H new ATOM 0 HD21 LEU p 47 -2.480 -16.549 6.009 1.00 0.00 H new ATOM 0 HD22 LEU p 47 -1.861 -15.495 4.715 1.00 0.00 H new ATOM 0 HD23 LEU p 47 -2.264 -17.192 4.363 1.00 0.00 H new ATOM 747 N TYR p 48 2.538 -18.178 2.313 1.00 0.00 N ATOM 748 CA TYR p 48 3.653 -18.097 1.347 1.00 0.00 C ATOM 749 C TYR p 48 3.883 -16.673 0.830 1.00 0.00 C ATOM 750 O TYR p 48 2.936 -15.975 0.473 1.00 0.00 O ATOM 751 CB TYR p 48 3.417 -19.053 0.179 1.00 0.00 C ATOM 752 CG TYR p 48 3.583 -20.511 0.542 1.00 0.00 C ATOM 753 CD1 TYR p 48 2.530 -21.228 1.096 1.00 0.00 C ATOM 754 CD2 TYR p 48 4.787 -21.170 0.332 1.00 0.00 C ATOM 755 CE1 TYR p 48 2.673 -22.558 1.432 1.00 0.00 C ATOM 756 CE2 TYR p 48 4.938 -22.504 0.663 1.00 0.00 C ATOM 757 CZ TYR p 48 3.878 -23.193 1.214 1.00 0.00 C ATOM 758 OH TYR p 48 4.023 -24.520 1.547 1.00 0.00 O ATOM 0 H TYR p 48 2.833 -18.507 3.232 1.00 0.00 H new ATOM 0 HA TYR p 48 4.556 -18.393 1.880 1.00 0.00 H new ATOM 0 HB2 TYR p 48 2.410 -18.897 -0.209 1.00 0.00 H new ATOM 0 HB3 TYR p 48 4.110 -18.807 -0.626 1.00 0.00 H new ATOM 0 HD1 TYR p 48 1.584 -20.736 1.266 1.00 0.00 H new ATOM 0 HD2 TYR p 48 5.619 -20.632 -0.097 1.00 0.00 H new ATOM 0 HE1 TYR p 48 1.845 -23.100 1.864 1.00 0.00 H new ATOM 0 HE2 TYR p 48 5.880 -23.003 0.491 1.00 0.00 H new ATOM 0 HH TYR p 48 4.932 -24.815 1.328 1.00 0.00 H new ATOM 768 N SER p 49 5.162 -16.272 0.762 1.00 0.00 N ATOM 769 CA SER p 49 5.561 -14.928 0.300 1.00 0.00 C ATOM 770 C SER p 49 5.231 -14.671 -1.184 1.00 0.00 C ATOM 771 O SER p 49 5.386 -13.551 -1.674 1.00 0.00 O ATOM 772 CB SER p 49 7.060 -14.735 0.524 1.00 0.00 C ATOM 773 OG SER p 49 7.348 -14.492 1.890 1.00 0.00 O ATOM 0 H SER p 49 5.948 -16.866 1.024 1.00 0.00 H new ATOM 0 HA SER p 49 4.984 -14.211 0.884 1.00 0.00 H new ATOM 0 HB2 SER p 49 7.597 -15.622 0.189 1.00 0.00 H new ATOM 0 HB3 SER p 49 7.416 -13.900 -0.079 1.00 0.00 H new ATOM 0 HG SER p 49 8.314 -14.374 2.005 1.00 0.00 H new ATOM 779 N ASP p 50 4.771 -15.710 -1.876 1.00 0.00 N ATOM 780 CA ASP p 50 4.414 -15.617 -3.298 1.00 0.00 C ATOM 781 C ASP p 50 2.907 -15.413 -3.470 1.00 0.00 C ATOM 782 O ASP p 50 2.469 -14.648 -4.333 1.00 0.00 O ATOM 783 CB ASP p 50 4.862 -16.877 -4.048 1.00 0.00 C ATOM 784 CG ASP p 50 6.370 -16.976 -4.179 1.00 0.00 C ATOM 785 OD1 ASP p 50 7.008 -17.557 -3.275 1.00 0.00 O ATOM 786 OD2 ASP p 50 6.913 -16.474 -5.185 1.00 0.00 O ATOM 0 H ASP p 50 4.634 -16.637 -1.474 1.00 0.00 H new ATOM 0 HA ASP p 50 4.930 -14.754 -3.719 1.00 0.00 H new ATOM 0 HB2 ASP p 50 4.488 -17.758 -3.526 1.00 0.00 H new ATOM 0 HB3 ASP p 50 4.414 -16.882 -5.042 1.00 0.00 H new ATOM 791 N GLN p 51 2.134 -16.111 -2.632 1.00 0.00 N ATOM 792 CA GLN p 51 0.671 -16.047 -2.646 1.00 0.00 C ATOM 793 C GLN p 51 0.153 -14.973 -1.674 1.00 0.00 C ATOM 794 O GLN p 51 -1.044 -14.688 -1.642 1.00 0.00 O ATOM 795 CB GLN p 51 0.095 -17.424 -2.281 1.00 0.00 C ATOM 796 CG GLN p 51 -1.200 -17.788 -3.007 1.00 0.00 C ATOM 797 CD GLN p 51 -2.440 -17.280 -2.296 1.00 0.00 C ATOM 798 OE1 GLN p 51 -2.932 -16.190 -2.581 1.00 0.00 O ATOM 799 NE2 GLN p 51 -2.952 -18.073 -1.363 1.00 0.00 N ATOM 0 H GLN p 51 2.509 -16.739 -1.921 1.00 0.00 H new ATOM 0 HA GLN p 51 0.343 -15.771 -3.648 1.00 0.00 H new ATOM 0 HB2 GLN p 51 0.844 -18.185 -2.499 1.00 0.00 H new ATOM 0 HB3 GLN p 51 -0.086 -17.454 -1.207 1.00 0.00 H new ATOM 0 HG2 GLN p 51 -1.172 -17.377 -4.016 1.00 0.00 H new ATOM 0 HG3 GLN p 51 -1.263 -18.872 -3.106 1.00 0.00 H new ATOM 0 HE21 GLN p 51 -2.512 -18.970 -1.158 1.00 0.00 H new ATOM 0 HE22 GLN p 51 -3.786 -17.786 -0.851 1.00 0.00 H new ATOM 808 N ALA p 52 1.061 -14.412 -0.866 1.00 0.00 N ATOM 809 CA ALA p 52 0.709 -13.392 0.125 1.00 0.00 C ATOM 810 C ALA p 52 1.204 -11.982 -0.245 1.00 0.00 C ATOM 811 O ALA p 52 0.843 -11.010 0.415 1.00 0.00 O ATOM 812 CB ALA p 52 1.270 -13.808 1.477 1.00 0.00 C ATOM 0 H ALA p 52 2.052 -14.651 -0.881 1.00 0.00 H new ATOM 0 HA ALA p 52 -0.379 -13.329 0.158 1.00 0.00 H new ATOM 0 HB1 ALA p 52 1.015 -13.056 2.224 1.00 0.00 H new ATOM 0 HB2 ALA p 52 0.844 -14.768 1.768 1.00 0.00 H new ATOM 0 HB3 ALA p 52 2.354 -13.898 1.409 1.00 0.00 H new ATOM 818 N LEU p 53 2.056 -11.885 -1.265 1.00 0.00 N ATOM 819 CA LEU p 53 2.621 -10.623 -1.711 1.00 0.00 C ATOM 820 C LEU p 53 1.858 -10.040 -2.891 1.00 0.00 C ATOM 821 O LEU p 53 1.139 -9.049 -2.763 1.00 0.00 O ATOM 822 CB LEU p 53 4.097 -10.830 -2.072 1.00 0.00 C ATOM 823 CG LEU p 53 5.113 -10.448 -0.993 1.00 0.00 C ATOM 824 CD1 LEU p 53 6.518 -10.778 -1.460 1.00 0.00 C ATOM 825 CD2 LEU p 53 4.998 -8.974 -0.652 1.00 0.00 C ATOM 0 H LEU p 53 2.373 -12.690 -1.806 1.00 0.00 H new ATOM 0 HA LEU p 53 2.538 -9.904 -0.896 1.00 0.00 H new ATOM 0 HB2 LEU p 53 4.244 -11.880 -2.326 1.00 0.00 H new ATOM 0 HB3 LEU p 53 4.315 -10.251 -2.969 1.00 0.00 H new ATOM 0 HG LEU p 53 4.900 -11.024 -0.093 1.00 0.00 H new ATOM 0 HD11 LEU p 53 7.233 -10.502 -0.685 1.00 0.00 H new ATOM 0 HD12 LEU p 53 6.593 -11.847 -1.660 1.00 0.00 H new ATOM 0 HD13 LEU p 53 6.738 -10.222 -2.371 1.00 0.00 H new ATOM 0 HD21 LEU p 53 5.728 -8.720 0.117 1.00 0.00 H new ATOM 0 HD22 LEU p 53 5.189 -8.378 -1.544 1.00 0.00 H new ATOM 0 HD23 LEU p 53 3.994 -8.763 -0.283 1.00 0.00 H new ATOM 837 N LYS p 54 2.011 -10.714 -4.032 1.00 0.00 N ATOM 838 CA LYS p 54 1.369 -10.336 -5.308 1.00 0.00 C ATOM 839 C LYS p 54 -0.159 -10.427 -5.230 1.00 0.00 C ATOM 840 O LYS p 54 -0.863 -9.939 -6.112 1.00 0.00 O ATOM 841 CB LYS p 54 1.881 -11.230 -6.443 1.00 0.00 C ATOM 842 CG LYS p 54 3.308 -10.923 -6.870 1.00 0.00 C ATOM 843 CD LYS p 54 3.758 -11.830 -8.002 1.00 0.00 C ATOM 844 CE LYS p 54 5.184 -11.522 -8.428 1.00 0.00 C ATOM 845 NZ LYS p 54 5.633 -12.400 -9.544 1.00 0.00 N ATOM 0 H LYS p 54 2.591 -11.550 -4.105 1.00 0.00 H new ATOM 0 HA LYS p 54 1.633 -9.298 -5.509 1.00 0.00 H new ATOM 0 HB2 LYS p 54 1.822 -12.272 -6.127 1.00 0.00 H new ATOM 0 HB3 LYS p 54 1.222 -11.121 -7.305 1.00 0.00 H new ATOM 0 HG2 LYS p 54 3.378 -9.882 -7.186 1.00 0.00 H new ATOM 0 HG3 LYS p 54 3.977 -11.043 -6.018 1.00 0.00 H new ATOM 0 HD2 LYS p 54 3.688 -12.871 -7.686 1.00 0.00 H new ATOM 0 HD3 LYS p 54 3.089 -11.710 -8.854 1.00 0.00 H new ATOM 0 HE2 LYS p 54 5.253 -10.479 -8.737 1.00 0.00 H new ATOM 0 HE3 LYS p 54 5.852 -11.647 -7.576 1.00 0.00 H new ATOM 0 HZ1 LYS p 54 6.610 -12.158 -9.805 1.00 0.00 H new ATOM 0 HZ2 LYS p 54 5.592 -13.394 -9.242 1.00 0.00 H new ATOM 0 HZ3 LYS p 54 5.011 -12.262 -10.366 1.00 0.00 H new ATOM 859 N LYS p 55 -0.632 -11.069 -4.164 1.00 0.00 N ATOM 860 CA LYS p 55 -2.037 -11.259 -3.883 1.00 0.00 C ATOM 861 C LYS p 55 -2.519 -10.181 -2.937 1.00 0.00 C ATOM 862 O LYS p 55 -3.634 -9.684 -3.077 1.00 0.00 O ATOM 863 CB LYS p 55 -2.272 -12.644 -3.295 1.00 0.00 C ATOM 864 CG LYS p 55 -2.602 -13.710 -4.334 1.00 0.00 C ATOM 865 CD LYS p 55 -4.096 -13.786 -4.617 1.00 0.00 C ATOM 866 CE LYS p 55 -4.410 -14.841 -5.665 1.00 0.00 C ATOM 867 NZ LYS p 55 -5.870 -14.930 -5.942 1.00 0.00 N ATOM 0 H LYS p 55 -0.023 -11.480 -3.456 1.00 0.00 H new ATOM 0 HA LYS p 55 -2.604 -11.185 -4.811 1.00 0.00 H new ATOM 0 HB2 LYS p 55 -1.382 -12.950 -2.745 1.00 0.00 H new ATOM 0 HB3 LYS p 55 -3.088 -12.588 -2.575 1.00 0.00 H new ATOM 0 HG2 LYS p 55 -2.068 -13.492 -5.259 1.00 0.00 H new ATOM 0 HG3 LYS p 55 -2.249 -14.680 -3.983 1.00 0.00 H new ATOM 0 HD2 LYS p 55 -4.631 -14.016 -3.696 1.00 0.00 H new ATOM 0 HD3 LYS p 55 -4.453 -12.814 -4.959 1.00 0.00 H new ATOM 0 HE2 LYS p 55 -3.879 -14.606 -6.587 1.00 0.00 H new ATOM 0 HE3 LYS p 55 -4.045 -15.810 -5.325 1.00 0.00 H new ATOM 0 HZ1 LYS p 55 -6.043 -15.660 -6.662 1.00 0.00 H new ATOM 0 HZ2 LYS p 55 -6.375 -15.179 -5.068 1.00 0.00 H new ATOM 0 HZ3 LYS p 55 -6.214 -14.012 -6.291 1.00 0.00 H new ATOM 881 N LYS p 56 -1.657 -9.832 -1.964 1.00 0.00 N ATOM 882 CA LYS p 56 -1.966 -8.745 -1.000 1.00 0.00 C ATOM 883 C LYS p 56 -1.785 -7.383 -1.687 1.00 0.00 C ATOM 884 O LYS p 56 -2.190 -6.335 -1.177 1.00 0.00 O ATOM 885 CB LYS p 56 -1.083 -8.827 0.244 1.00 0.00 C ATOM 886 CG LYS p 56 -1.658 -9.706 1.352 1.00 0.00 C ATOM 887 CD LYS p 56 -2.603 -8.931 2.263 1.00 0.00 C ATOM 888 CE LYS p 56 -3.197 -9.826 3.341 1.00 0.00 C ATOM 889 NZ LYS p 56 -4.143 -9.085 4.219 1.00 0.00 N ATOM 0 H LYS p 56 -0.751 -10.277 -1.820 1.00 0.00 H new ATOM 0 HA LYS p 56 -3.001 -8.861 -0.677 1.00 0.00 H new ATOM 0 HB2 LYS p 56 -0.104 -9.213 -0.042 1.00 0.00 H new ATOM 0 HB3 LYS p 56 -0.928 -7.821 0.635 1.00 0.00 H new ATOM 0 HG2 LYS p 56 -2.191 -10.547 0.908 1.00 0.00 H new ATOM 0 HG3 LYS p 56 -0.843 -10.122 1.944 1.00 0.00 H new ATOM 0 HD2 LYS p 56 -2.065 -8.106 2.729 1.00 0.00 H new ATOM 0 HD3 LYS p 56 -3.405 -8.493 1.669 1.00 0.00 H new ATOM 0 HE2 LYS p 56 -3.716 -10.663 2.873 1.00 0.00 H new ATOM 0 HE3 LYS p 56 -2.394 -10.247 3.946 1.00 0.00 H new ATOM 0 HZ1 LYS p 56 -4.525 -9.730 4.940 1.00 0.00 H new ATOM 0 HZ2 LYS p 56 -3.643 -8.302 4.686 1.00 0.00 H new ATOM 0 HZ3 LYS p 56 -4.923 -8.705 3.646 1.00 0.00 H new ATOM 903 N LEU p 57 -1.154 -7.467 -2.857 1.00 0.00 N ATOM 904 CA LEU p 57 -0.871 -6.364 -3.755 1.00 0.00 C ATOM 905 C LEU p 57 -2.003 -6.307 -4.740 1.00 0.00 C ATOM 906 O LEU p 57 -2.514 -5.243 -5.083 1.00 0.00 O ATOM 907 CB LEU p 57 0.437 -6.626 -4.496 1.00 0.00 C ATOM 908 CG LEU p 57 1.679 -5.884 -4.005 1.00 0.00 C ATOM 909 CD1 LEU p 57 2.014 -6.246 -2.564 1.00 0.00 C ATOM 910 CD2 LEU p 57 2.825 -6.235 -4.926 1.00 0.00 C ATOM 0 H LEU p 57 -0.811 -8.357 -3.217 1.00 0.00 H new ATOM 0 HA LEU p 57 -0.775 -5.426 -3.207 1.00 0.00 H new ATOM 0 HB2 LEU p 57 0.643 -7.695 -4.450 1.00 0.00 H new ATOM 0 HB3 LEU p 57 0.287 -6.375 -5.546 1.00 0.00 H new ATOM 0 HG LEU p 57 1.493 -4.810 -4.022 1.00 0.00 H new ATOM 0 HD11 LEU p 57 2.903 -5.699 -2.249 1.00 0.00 H new ATOM 0 HD12 LEU p 57 1.177 -5.981 -1.918 1.00 0.00 H new ATOM 0 HD13 LEU p 57 2.202 -7.317 -2.492 1.00 0.00 H new ATOM 0 HD21 LEU p 57 3.727 -5.718 -4.598 1.00 0.00 H new ATOM 0 HD22 LEU p 57 2.995 -7.311 -4.902 1.00 0.00 H new ATOM 0 HD23 LEU p 57 2.581 -5.929 -5.943 1.00 0.00 H new ATOM 922 N ALA p 58 -2.358 -7.515 -5.200 1.00 0.00 N ATOM 923 CA ALA p 58 -3.503 -7.709 -6.116 1.00 0.00 C ATOM 924 C ALA p 58 -4.813 -7.381 -5.394 1.00 0.00 C ATOM 925 O ALA p 58 -5.847 -7.138 -6.022 1.00 0.00 O ATOM 926 CB ALA p 58 -3.551 -9.127 -6.658 1.00 0.00 C ATOM 0 H ALA p 58 -1.871 -8.377 -4.955 1.00 0.00 H new ATOM 0 HA ALA p 58 -3.373 -7.032 -6.960 1.00 0.00 H new ATOM 0 HB1 ALA p 58 -4.405 -9.232 -7.327 1.00 0.00 H new ATOM 0 HB2 ALA p 58 -2.633 -9.338 -7.206 1.00 0.00 H new ATOM 0 HB3 ALA p 58 -3.650 -9.830 -5.831 1.00 0.00 H new ATOM 932 N GLN p 59 -4.725 -7.389 -4.058 1.00 0.00 N ATOM 933 CA GLN p 59 -5.807 -7.067 -3.165 1.00 0.00 C ATOM 934 C GLN p 59 -5.717 -5.582 -2.820 1.00 0.00 C ATOM 935 O GLN p 59 -6.699 -4.963 -2.440 1.00 0.00 O ATOM 936 CB GLN p 59 -5.661 -7.946 -1.921 1.00 0.00 C ATOM 937 CG GLN p 59 -6.402 -7.445 -0.707 1.00 0.00 C ATOM 938 CD GLN p 59 -7.315 -8.488 -0.091 1.00 0.00 C ATOM 939 OE1 GLN p 59 -8.487 -8.594 -0.453 1.00 0.00 O ATOM 940 NE2 GLN p 59 -6.783 -9.264 0.846 1.00 0.00 N ATOM 0 H GLN p 59 -3.863 -7.630 -3.569 1.00 0.00 H new ATOM 0 HA GLN p 59 -6.782 -7.254 -3.615 1.00 0.00 H new ATOM 0 HB2 GLN p 59 -6.015 -8.949 -2.158 1.00 0.00 H new ATOM 0 HB3 GLN p 59 -4.603 -8.031 -1.675 1.00 0.00 H new ATOM 0 HG2 GLN p 59 -5.680 -7.116 0.041 1.00 0.00 H new ATOM 0 HG3 GLN p 59 -6.993 -6.573 -0.985 1.00 0.00 H new ATOM 0 HE21 GLN p 59 -5.807 -9.142 1.116 1.00 0.00 H new ATOM 0 HE22 GLN p 59 -7.350 -9.982 1.296 1.00 0.00 H new ATOM 949 N LEU p 60 -4.494 -5.065 -2.947 1.00 0.00 N ATOM 950 CA LEU p 60 -4.165 -3.656 -2.707 1.00 0.00 C ATOM 951 C LEU p 60 -4.415 -2.847 -3.989 1.00 0.00 C ATOM 952 O LEU p 60 -4.487 -1.623 -3.974 1.00 0.00 O ATOM 953 CB LEU p 60 -2.690 -3.540 -2.262 1.00 0.00 C ATOM 954 CG LEU p 60 -2.190 -2.153 -1.803 1.00 0.00 C ATOM 955 CD1 LEU p 60 -1.556 -1.425 -2.974 1.00 0.00 C ATOM 956 CD2 LEU p 60 -3.321 -1.325 -1.209 1.00 0.00 C ATOM 0 H LEU p 60 -3.687 -5.624 -3.225 1.00 0.00 H new ATOM 0 HA LEU p 60 -4.798 -3.256 -1.915 1.00 0.00 H new ATOM 0 HB2 LEU p 60 -2.529 -4.243 -1.444 1.00 0.00 H new ATOM 0 HB3 LEU p 60 -2.062 -3.866 -3.091 1.00 0.00 H new ATOM 0 HG LEU p 60 -1.443 -2.297 -1.022 1.00 0.00 H new ATOM 0 HD11 LEU p 60 -1.204 -0.447 -2.647 1.00 0.00 H new ATOM 0 HD12 LEU p 60 -0.714 -2.006 -3.351 1.00 0.00 H new ATOM 0 HD13 LEU p 60 -2.294 -1.299 -3.767 1.00 0.00 H new ATOM 0 HD21 LEU p 60 -2.936 -0.355 -0.896 1.00 0.00 H new ATOM 0 HD22 LEU p 60 -4.099 -1.182 -1.958 1.00 0.00 H new ATOM 0 HD23 LEU p 60 -3.739 -1.845 -0.347 1.00 0.00 H new ATOM 968 N LYS p 61 -4.527 -3.597 -5.072 1.00 0.00 N ATOM 969 CA LYS p 61 -4.796 -3.116 -6.416 1.00 0.00 C ATOM 970 C LYS p 61 -6.290 -3.208 -6.631 1.00 0.00 C ATOM 971 O LYS p 61 -6.892 -2.442 -7.387 1.00 0.00 O ATOM 972 CB LYS p 61 -4.040 -3.978 -7.428 1.00 0.00 C ATOM 973 CG LYS p 61 -2.782 -3.319 -7.974 1.00 0.00 C ATOM 974 CD LYS p 61 -3.067 -2.516 -9.236 1.00 0.00 C ATOM 975 CE LYS p 61 -1.832 -1.768 -9.710 1.00 0.00 C ATOM 976 NZ LYS p 61 -2.103 -0.968 -10.937 1.00 0.00 N ATOM 0 H LYS p 61 -4.427 -4.611 -5.035 1.00 0.00 H new ATOM 0 HA LYS p 61 -4.464 -2.086 -6.547 1.00 0.00 H new ATOM 0 HB2 LYS p 61 -3.769 -4.923 -6.957 1.00 0.00 H new ATOM 0 HB3 LYS p 61 -4.705 -4.215 -8.258 1.00 0.00 H new ATOM 0 HG2 LYS p 61 -2.356 -2.663 -7.214 1.00 0.00 H new ATOM 0 HG3 LYS p 61 -2.036 -4.083 -8.190 1.00 0.00 H new ATOM 0 HD2 LYS p 61 -3.413 -3.185 -10.024 1.00 0.00 H new ATOM 0 HD3 LYS p 61 -3.872 -1.807 -9.043 1.00 0.00 H new ATOM 0 HE2 LYS p 61 -1.481 -1.108 -8.917 1.00 0.00 H new ATOM 0 HE3 LYS p 61 -1.031 -2.480 -9.910 1.00 0.00 H new ATOM 0 HZ1 LYS p 61 -1.236 -0.473 -11.228 1.00 0.00 H new ATOM 0 HZ2 LYS p 61 -2.414 -1.600 -11.702 1.00 0.00 H new ATOM 0 HZ3 LYS p 61 -2.849 -0.271 -10.739 1.00 0.00 H new ATOM 990 N TRP p 62 -6.858 -4.191 -5.923 1.00 0.00 N ATOM 991 CA TRP p 62 -8.289 -4.432 -5.885 1.00 0.00 C ATOM 992 C TRP p 62 -8.871 -3.516 -4.826 1.00 0.00 C ATOM 993 O TRP p 62 -10.026 -3.090 -4.911 1.00 0.00 O ATOM 994 CB TRP p 62 -8.593 -5.894 -5.564 1.00 0.00 C ATOM 995 CG TRP p 62 -9.543 -6.530 -6.538 1.00 0.00 C ATOM 996 CD1 TRP p 62 -9.212 -7.173 -7.695 1.00 0.00 C ATOM 997 CD2 TRP p 62 -10.977 -6.584 -6.446 1.00 0.00 C ATOM 998 NE1 TRP p 62 -10.346 -7.623 -8.329 1.00 0.00 N ATOM 999 CE2 TRP p 62 -11.440 -7.275 -7.582 1.00 0.00 C ATOM 1000 CE3 TRP p 62 -11.914 -6.117 -5.515 1.00 0.00 C ATOM 1001 CZ2 TRP p 62 -12.795 -7.509 -7.812 1.00 0.00 C ATOM 1002 CZ3 TRP p 62 -13.256 -6.350 -5.746 1.00 0.00 C ATOM 1003 CH2 TRP p 62 -13.685 -7.040 -6.886 1.00 0.00 C ATOM 0 H TRP p 62 -6.321 -4.846 -5.355 1.00 0.00 H new ATOM 0 HA TRP p 62 -8.734 -4.226 -6.859 1.00 0.00 H new ATOM 0 HB2 TRP p 62 -7.661 -6.458 -5.555 1.00 0.00 H new ATOM 0 HB3 TRP p 62 -9.014 -5.959 -4.561 1.00 0.00 H new ATOM 0 HD1 TRP p 62 -8.205 -7.309 -8.060 1.00 0.00 H new ATOM 0 HE1 TRP p 62 -10.369 -8.133 -9.212 1.00 0.00 H new ATOM 0 HE3 TRP p 62 -11.593 -5.584 -4.632 1.00 0.00 H new ATOM 0 HZ2 TRP p 62 -13.130 -8.042 -8.690 1.00 0.00 H new ATOM 0 HZ3 TRP p 62 -13.987 -5.994 -5.035 1.00 0.00 H new ATOM 0 HH2 TRP p 62 -14.741 -7.205 -7.037 1.00 0.00 H new ATOM 1014 N LYS p 63 -8.029 -3.225 -3.817 1.00 0.00 N ATOM 1015 CA LYS p 63 -8.400 -2.285 -2.749 1.00 0.00 C ATOM 1016 C LYS p 63 -8.102 -0.853 -3.193 1.00 0.00 C ATOM 1017 O LYS p 63 -8.614 0.089 -2.622 1.00 0.00 O ATOM 1018 CB LYS p 63 -7.668 -2.586 -1.442 1.00 0.00 C ATOM 1019 CG LYS p 63 -8.495 -3.373 -0.432 1.00 0.00 C ATOM 1020 CD LYS p 63 -9.267 -2.455 0.506 1.00 0.00 C ATOM 1021 CE LYS p 63 -10.007 -3.242 1.576 1.00 0.00 C ATOM 1022 NZ LYS p 63 -10.774 -2.350 2.487 1.00 0.00 N ATOM 0 H LYS p 63 -7.095 -3.625 -3.721 1.00 0.00 H new ATOM 0 HA LYS p 63 -9.468 -2.401 -2.563 1.00 0.00 H new ATOM 0 HB2 LYS p 63 -6.760 -3.146 -1.667 1.00 0.00 H new ATOM 0 HB3 LYS p 63 -7.358 -1.645 -0.987 1.00 0.00 H new ATOM 0 HG2 LYS p 63 -9.193 -4.022 -0.961 1.00 0.00 H new ATOM 0 HG3 LYS p 63 -7.838 -4.019 0.151 1.00 0.00 H new ATOM 0 HD2 LYS p 63 -8.578 -1.755 0.979 1.00 0.00 H new ATOM 0 HD3 LYS p 63 -9.979 -1.862 -0.068 1.00 0.00 H new ATOM 0 HE2 LYS p 63 -10.688 -3.949 1.102 1.00 0.00 H new ATOM 0 HE3 LYS p 63 -9.293 -3.827 2.156 1.00 0.00 H new ATOM 0 HZ1 LYS p 63 -11.265 -2.924 3.202 1.00 0.00 H new ATOM 0 HZ2 LYS p 63 -10.122 -1.692 2.959 1.00 0.00 H new ATOM 0 HZ3 LYS p 63 -11.473 -1.810 1.937 1.00 0.00 H new ATOM 1036 N LEU p 64 -7.250 -0.740 -4.223 1.00 0.00 N ATOM 1037 CA LEU p 64 -6.842 0.531 -4.858 1.00 0.00 C ATOM 1038 C LEU p 64 -7.976 1.094 -5.670 1.00 0.00 C ATOM 1039 O LEU p 64 -8.194 2.274 -5.777 1.00 0.00 O ATOM 1040 CB LEU p 64 -5.698 0.228 -5.807 1.00 0.00 C ATOM 1041 CG LEU p 64 -4.646 1.294 -5.950 1.00 0.00 C ATOM 1042 CD1 LEU p 64 -3.677 1.174 -4.804 1.00 0.00 C ATOM 1043 CD2 LEU p 64 -3.962 1.122 -7.286 1.00 0.00 C ATOM 0 H LEU p 64 -6.810 -1.553 -4.653 1.00 0.00 H new ATOM 0 HA LEU p 64 -6.554 1.247 -4.089 1.00 0.00 H new ATOM 0 HB2 LEU p 64 -5.212 -0.689 -5.474 1.00 0.00 H new ATOM 0 HB3 LEU p 64 -6.117 0.027 -6.793 1.00 0.00 H new ATOM 0 HG LEU p 64 -5.085 2.291 -5.919 1.00 0.00 H new ATOM 0 HD11 LEU p 64 -2.908 1.942 -4.895 1.00 0.00 H new ATOM 0 HD12 LEU p 64 -4.210 1.304 -3.862 1.00 0.00 H new ATOM 0 HD13 LEU p 64 -3.210 0.189 -4.824 1.00 0.00 H new ATOM 0 HD21 LEU p 64 -3.196 1.889 -7.404 1.00 0.00 H new ATOM 0 HD22 LEU p 64 -3.499 0.136 -7.334 1.00 0.00 H new ATOM 0 HD23 LEU p 64 -4.697 1.217 -8.086 1.00 0.00 H new ATOM 1055 N GLN p 65 -8.631 0.167 -6.271 1.00 0.00 N ATOM 1056 CA GLN p 65 -9.807 0.359 -7.079 1.00 0.00 C ATOM 1057 C GLN p 65 -10.968 0.669 -6.135 1.00 0.00 C ATOM 1058 O GLN p 65 -12.028 1.117 -6.540 1.00 0.00 O ATOM 1059 CB GLN p 65 -10.019 -0.940 -7.873 1.00 0.00 C ATOM 1060 CG GLN p 65 -11.449 -1.223 -8.271 1.00 0.00 C ATOM 1061 CD GLN p 65 -11.597 -1.629 -9.724 1.00 0.00 C ATOM 1062 OE1 GLN p 65 -11.779 -0.786 -10.601 1.00 0.00 O ATOM 1063 NE2 GLN p 65 -11.520 -2.929 -9.985 1.00 0.00 N ATOM 0 H GLN p 65 -8.352 -0.812 -6.215 1.00 0.00 H new ATOM 0 HA GLN p 65 -9.721 1.185 -7.785 1.00 0.00 H new ATOM 0 HB2 GLN p 65 -9.409 -0.900 -8.775 1.00 0.00 H new ATOM 0 HB3 GLN p 65 -9.652 -1.776 -7.277 1.00 0.00 H new ATOM 0 HG2 GLN p 65 -11.845 -2.016 -7.637 1.00 0.00 H new ATOM 0 HG3 GLN p 65 -12.053 -0.335 -8.086 1.00 0.00 H new ATOM 0 HE21 GLN p 65 -11.368 -3.593 -9.226 1.00 0.00 H new ATOM 0 HE22 GLN p 65 -11.613 -3.263 -10.944 1.00 0.00 H new ATOM 1072 N ALA p 66 -10.736 0.290 -4.891 1.00 0.00 N ATOM 1073 CA ALA p 66 -11.658 0.508 -3.789 1.00 0.00 C ATOM 1074 C ALA p 66 -11.253 1.707 -2.948 1.00 0.00 C ATOM 1075 O ALA p 66 -12.106 2.402 -2.408 1.00 0.00 O ATOM 1076 CB ALA p 66 -11.790 -0.739 -2.929 1.00 0.00 C ATOM 0 H ALA p 66 -9.880 -0.190 -4.611 1.00 0.00 H new ATOM 0 HA ALA p 66 -12.635 0.725 -4.222 1.00 0.00 H new ATOM 0 HB1 ALA p 66 -12.486 -0.546 -2.113 1.00 0.00 H new ATOM 0 HB2 ALA p 66 -12.164 -1.563 -3.537 1.00 0.00 H new ATOM 0 HB3 ALA p 66 -10.815 -1.004 -2.520 1.00 0.00 H new ATOM 1082 N LEU p 67 -9.932 1.919 -2.843 1.00 0.00 N ATOM 1083 CA LEU p 67 -9.347 2.986 -2.051 1.00 0.00 C ATOM 1084 C LEU p 67 -9.169 4.219 -2.905 1.00 0.00 C ATOM 1085 O LEU p 67 -9.372 5.337 -2.446 1.00 0.00 O ATOM 1086 CB LEU p 67 -8.018 2.499 -1.445 1.00 0.00 C ATOM 1087 CG LEU p 67 -6.713 2.985 -2.102 1.00 0.00 C ATOM 1088 CD1 LEU p 67 -6.276 4.310 -1.515 1.00 0.00 C ATOM 1089 CD2 LEU p 67 -5.620 1.950 -1.954 1.00 0.00 C ATOM 0 H LEU p 67 -9.239 1.340 -3.317 1.00 0.00 H new ATOM 0 HA LEU p 67 -10.010 3.255 -1.229 1.00 0.00 H new ATOM 0 HB2 LEU p 67 -7.998 2.798 -0.397 1.00 0.00 H new ATOM 0 HB3 LEU p 67 -8.019 1.409 -1.466 1.00 0.00 H new ATOM 0 HG LEU p 67 -6.904 3.130 -3.165 1.00 0.00 H new ATOM 0 HD11 LEU p 67 -5.352 4.633 -1.994 1.00 0.00 H new ATOM 0 HD12 LEU p 67 -7.053 5.056 -1.683 1.00 0.00 H new ATOM 0 HD13 LEU p 67 -6.108 4.196 -0.444 1.00 0.00 H new ATOM 0 HD21 LEU p 67 -4.707 2.315 -2.425 1.00 0.00 H new ATOM 0 HD22 LEU p 67 -5.433 1.767 -0.896 1.00 0.00 H new ATOM 0 HD23 LEU p 67 -5.930 1.022 -2.434 1.00 0.00 H new ATOM 1101 N LYS p 68 -8.737 3.977 -4.140 1.00 0.00 N ATOM 1102 CA LYS p 68 -8.557 5.036 -5.132 1.00 0.00 C ATOM 1103 C LYS p 68 -9.907 5.393 -5.702 1.00 0.00 C ATOM 1104 O LYS p 68 -10.071 6.469 -6.263 1.00 0.00 O ATOM 1105 CB LYS p 68 -7.566 4.676 -6.244 1.00 0.00 C ATOM 1106 CG LYS p 68 -6.120 4.988 -5.891 1.00 0.00 C ATOM 1107 CD LYS p 68 -5.210 4.884 -7.107 1.00 0.00 C ATOM 1108 CE LYS p 68 -3.758 5.189 -6.756 1.00 0.00 C ATOM 1109 NZ LYS p 68 -3.126 4.094 -5.965 1.00 0.00 N ATOM 0 H LYS p 68 -8.502 3.045 -4.481 1.00 0.00 H new ATOM 0 HA LYS p 68 -8.115 5.895 -4.627 1.00 0.00 H new ATOM 0 HB2 LYS p 68 -7.656 3.613 -6.470 1.00 0.00 H new ATOM 0 HB3 LYS p 68 -7.836 5.218 -7.150 1.00 0.00 H new ATOM 0 HG2 LYS p 68 -6.056 5.993 -5.473 1.00 0.00 H new ATOM 0 HG3 LYS p 68 -5.777 4.299 -5.119 1.00 0.00 H new ATOM 0 HD2 LYS p 68 -5.279 3.881 -7.528 1.00 0.00 H new ATOM 0 HD3 LYS p 68 -5.551 5.577 -7.876 1.00 0.00 H new ATOM 0 HE2 LYS p 68 -3.190 5.347 -7.673 1.00 0.00 H new ATOM 0 HE3 LYS p 68 -3.711 6.118 -6.188 1.00 0.00 H new ATOM 0 HZ1 LYS p 68 -2.310 4.471 -5.441 1.00 0.00 H new ATOM 0 HZ2 LYS p 68 -3.819 3.706 -5.294 1.00 0.00 H new ATOM 0 HZ3 LYS p 68 -2.807 3.341 -6.608 1.00 0.00 H new ATOM 1123 N LYS p 69 -10.864 4.448 -5.582 1.00 0.00 N ATOM 1124 CA LYS p 69 -12.245 4.717 -5.958 1.00 0.00 C ATOM 1125 C LYS p 69 -12.905 5.392 -4.767 1.00 0.00 C ATOM 1126 O LYS p 69 -13.963 6.007 -4.882 1.00 0.00 O ATOM 1127 CB LYS p 69 -12.996 3.450 -6.328 1.00 0.00 C ATOM 1128 CG LYS p 69 -13.344 3.367 -7.805 1.00 0.00 C ATOM 1129 CD LYS p 69 -14.677 2.667 -8.029 1.00 0.00 C ATOM 1130 CE LYS p 69 -15.030 2.583 -9.507 1.00 0.00 C ATOM 1131 NZ LYS p 69 -15.445 3.903 -10.065 1.00 0.00 N ATOM 0 H LYS p 69 -10.696 3.505 -5.230 1.00 0.00 H new ATOM 0 HA LYS p 69 -12.267 5.354 -6.842 1.00 0.00 H new ATOM 0 HB2 LYS p 69 -12.392 2.585 -6.055 1.00 0.00 H new ATOM 0 HB3 LYS p 69 -13.913 3.396 -5.742 1.00 0.00 H new ATOM 0 HG2 LYS p 69 -13.385 4.371 -8.227 1.00 0.00 H new ATOM 0 HG3 LYS p 69 -12.557 2.830 -8.335 1.00 0.00 H new ATOM 0 HD2 LYS p 69 -14.635 1.663 -7.608 1.00 0.00 H new ATOM 0 HD3 LYS p 69 -15.463 3.203 -7.497 1.00 0.00 H new ATOM 0 HE2 LYS p 69 -14.170 2.210 -10.063 1.00 0.00 H new ATOM 0 HE3 LYS p 69 -15.836 1.863 -9.646 1.00 0.00 H new ATOM 0 HZ1 LYS p 69 -15.676 3.797 -11.074 1.00 0.00 H new ATOM 0 HZ2 LYS p 69 -16.282 4.249 -9.553 1.00 0.00 H new ATOM 0 HZ3 LYS p 69 -14.667 4.585 -9.958 1.00 0.00 H new ATOM 1145 N LYS p 70 -12.231 5.224 -3.616 1.00 0.00 N ATOM 1146 CA LYS p 70 -12.609 5.839 -2.353 1.00 0.00 C ATOM 1147 C LYS p 70 -11.872 7.161 -2.236 1.00 0.00 C ATOM 1148 O LYS p 70 -12.288 8.061 -1.511 1.00 0.00 O ATOM 1149 CB LYS p 70 -12.247 4.944 -1.178 1.00 0.00 C ATOM 1150 CG LYS p 70 -13.443 4.336 -0.464 1.00 0.00 C ATOM 1151 CD LYS p 70 -13.837 5.143 0.764 1.00 0.00 C ATOM 1152 CE LYS p 70 -15.027 4.523 1.478 1.00 0.00 C ATOM 1153 NZ LYS p 70 -15.430 5.313 2.674 1.00 0.00 N ATOM 0 H LYS p 70 -11.394 4.644 -3.547 1.00 0.00 H new ATOM 0 HA LYS p 70 -13.688 5.993 -2.333 1.00 0.00 H new ATOM 0 HB2 LYS p 70 -11.603 4.139 -1.534 1.00 0.00 H new ATOM 0 HB3 LYS p 70 -11.666 5.523 -0.460 1.00 0.00 H new ATOM 0 HG2 LYS p 70 -14.288 4.283 -1.151 1.00 0.00 H new ATOM 0 HG3 LYS p 70 -13.208 3.314 -0.167 1.00 0.00 H new ATOM 0 HD2 LYS p 70 -12.991 5.203 1.449 1.00 0.00 H new ATOM 0 HD3 LYS p 70 -14.080 6.163 0.468 1.00 0.00 H new ATOM 0 HE2 LYS p 70 -15.868 4.454 0.788 1.00 0.00 H new ATOM 0 HE3 LYS p 70 -14.779 3.506 1.781 1.00 0.00 H new ATOM 0 HZ1 LYS p 70 -16.245 4.857 3.133 1.00 0.00 H new ATOM 0 HZ2 LYS p 70 -14.636 5.358 3.344 1.00 0.00 H new ATOM 0 HZ3 LYS p 70 -15.692 6.276 2.382 1.00 0.00 H new ATOM 1167 N ASN p 71 -10.743 7.223 -2.960 1.00 0.00 N ATOM 1168 CA ASN p 71 -9.905 8.420 -3.055 1.00 0.00 C ATOM 1169 C ASN p 71 -10.396 9.240 -4.245 1.00 0.00 C ATOM 1170 O ASN p 71 -10.036 10.400 -4.409 1.00 0.00 O ATOM 1171 CB ASN p 71 -8.423 8.070 -3.225 1.00 0.00 C ATOM 1172 CG ASN p 71 -7.506 9.112 -2.613 1.00 0.00 C ATOM 1173 OD1 ASN p 71 -7.131 10.109 -3.406 1.00 0.00 O flip ATOM 1174 ND2 ASN p 71 -7.140 9.023 -1.441 1.00 0.00 N flip ATOM 0 H ASN p 71 -10.387 6.434 -3.499 1.00 0.00 H new ATOM 0 HA ASN p 71 -9.987 8.990 -2.130 1.00 0.00 H new ATOM 0 HB2 ASN p 71 -8.226 7.102 -2.764 1.00 0.00 H new ATOM 0 HB3 ASN p 71 -8.196 7.970 -4.286 1.00 0.00 H new ATOM 0 HD21 ASN p 71 -7.452 8.240 -0.867 1.00 0.00 H new ATOM 0 HD22 ASN p 71 -6.524 9.733 -1.044 1.00 0.00 H new ATOM 1181 N ALA p 72 -11.204 8.559 -5.075 1.00 0.00 N ATOM 1182 CA ALA p 72 -11.879 9.125 -6.237 1.00 0.00 C ATOM 1183 C ALA p 72 -13.239 9.560 -5.755 1.00 0.00 C ATOM 1184 O ALA p 72 -13.904 10.387 -6.366 1.00 0.00 O ATOM 1185 CB ALA p 72 -12.019 8.124 -7.376 1.00 0.00 C ATOM 0 H ALA p 72 -11.407 7.568 -4.944 1.00 0.00 H new ATOM 0 HA ALA p 72 -11.297 9.954 -6.641 1.00 0.00 H new ATOM 0 HB1 ALA p 72 -12.528 8.597 -8.216 1.00 0.00 H new ATOM 0 HB2 ALA p 72 -11.030 7.792 -7.692 1.00 0.00 H new ATOM 0 HB3 ALA p 72 -12.599 7.266 -7.037 1.00 0.00 H new ATOM 1191 N GLN p 73 -13.621 8.925 -4.630 1.00 0.00 N ATOM 1192 CA GLN p 73 -14.820 9.184 -3.901 1.00 0.00 C ATOM 1193 C GLN p 73 -14.527 10.359 -3.000 1.00 0.00 C ATOM 1194 O GLN p 73 -15.378 11.191 -2.719 1.00 0.00 O ATOM 1195 CB GLN p 73 -15.098 7.956 -3.075 1.00 0.00 C ATOM 1196 CG GLN p 73 -16.370 8.013 -2.307 1.00 0.00 C ATOM 1197 CD GLN p 73 -17.399 6.995 -2.762 1.00 0.00 C ATOM 1198 OE1 GLN p 73 -18.212 7.270 -3.643 1.00 0.00 O ATOM 1199 NE2 GLN p 73 -17.367 5.811 -2.161 1.00 0.00 N ATOM 0 H GLN p 73 -13.057 8.188 -4.207 1.00 0.00 H new ATOM 0 HA GLN p 73 -15.675 9.404 -4.540 1.00 0.00 H new ATOM 0 HB2 GLN p 73 -15.122 7.087 -3.733 1.00 0.00 H new ATOM 0 HB3 GLN p 73 -14.273 7.806 -2.379 1.00 0.00 H new ATOM 0 HG2 GLN p 73 -16.155 7.853 -1.251 1.00 0.00 H new ATOM 0 HG3 GLN p 73 -16.795 9.013 -2.397 1.00 0.00 H new ATOM 0 HE21 GLN p 73 -16.675 5.626 -1.435 1.00 0.00 H new ATOM 0 HE22 GLN p 73 -18.034 5.087 -2.426 1.00 0.00 H new ATOM 1208 N LEU p 74 -13.284 10.326 -2.528 1.00 0.00 N ATOM 1209 CA LEU p 74 -12.692 11.363 -1.699 1.00 0.00 C ATOM 1210 C LEU p 74 -12.302 12.522 -2.597 1.00 0.00 C ATOM 1211 O LEU p 74 -12.296 13.656 -2.186 1.00 0.00 O ATOM 1212 CB LEU p 74 -11.465 10.825 -0.969 1.00 0.00 C ATOM 1213 CG LEU p 74 -11.068 11.536 0.327 1.00 0.00 C ATOM 1214 CD1 LEU p 74 -11.981 11.148 1.487 1.00 0.00 C ATOM 1215 CD2 LEU p 74 -9.631 11.191 0.641 1.00 0.00 C ATOM 0 H LEU p 74 -12.646 9.554 -2.719 1.00 0.00 H new ATOM 0 HA LEU p 74 -13.410 11.695 -0.949 1.00 0.00 H new ATOM 0 HB2 LEU p 74 -11.639 9.774 -0.740 1.00 0.00 H new ATOM 0 HB3 LEU p 74 -10.617 10.866 -1.653 1.00 0.00 H new ATOM 0 HG LEU p 74 -11.174 12.612 0.189 1.00 0.00 H new ATOM 0 HD11 LEU p 74 -11.667 11.673 2.389 1.00 0.00 H new ATOM 0 HD12 LEU p 74 -13.009 11.420 1.248 1.00 0.00 H new ATOM 0 HD13 LEU p 74 -11.920 10.073 1.654 1.00 0.00 H new ATOM 0 HD21 LEU p 74 -9.330 11.689 1.563 1.00 0.00 H new ATOM 0 HD22 LEU p 74 -9.534 10.112 0.764 1.00 0.00 H new ATOM 0 HD23 LEU p 74 -8.990 11.522 -0.176 1.00 0.00 H new ATOM 1227 N LYS p 75 -12.011 12.187 -3.851 1.00 0.00 N ATOM 1228 CA LYS p 75 -11.678 13.162 -4.885 1.00 0.00 C ATOM 1229 C LYS p 75 -12.989 13.678 -5.421 1.00 0.00 C ATOM 1230 O LYS p 75 -13.075 14.749 -6.026 1.00 0.00 O ATOM 1231 CB LYS p 75 -10.867 12.523 -6.007 1.00 0.00 C ATOM 1232 CG LYS p 75 -9.496 13.143 -6.222 1.00 0.00 C ATOM 1233 CD LYS p 75 -9.422 13.889 -7.544 1.00 0.00 C ATOM 1234 CE LYS p 75 -8.044 14.488 -7.767 1.00 0.00 C ATOM 1235 NZ LYS p 75 -7.957 15.215 -9.063 1.00 0.00 N ATOM 0 H LYS p 75 -12.000 11.222 -4.181 1.00 0.00 H new ATOM 0 HA LYS p 75 -11.068 13.965 -4.472 1.00 0.00 H new ATOM 0 HB2 LYS p 75 -10.743 11.462 -5.790 1.00 0.00 H new ATOM 0 HB3 LYS p 75 -11.434 12.594 -6.935 1.00 0.00 H new ATOM 0 HG2 LYS p 75 -9.273 13.828 -5.404 1.00 0.00 H new ATOM 0 HG3 LYS p 75 -8.735 12.363 -6.201 1.00 0.00 H new ATOM 0 HD2 LYS p 75 -9.661 13.208 -8.361 1.00 0.00 H new ATOM 0 HD3 LYS p 75 -10.171 14.681 -7.559 1.00 0.00 H new ATOM 0 HE2 LYS p 75 -7.809 15.171 -6.951 1.00 0.00 H new ATOM 0 HE3 LYS p 75 -7.296 13.696 -7.744 1.00 0.00 H new ATOM 0 HZ1 LYS p 75 -7.001 15.609 -9.177 1.00 0.00 H new ATOM 0 HZ2 LYS p 75 -8.156 14.558 -9.844 1.00 0.00 H new ATOM 0 HZ3 LYS p 75 -8.653 15.988 -9.075 1.00 0.00 H new ATOM 1249 N LYS p 76 -14.015 12.855 -5.165 1.00 0.00 N ATOM 1250 CA LYS p 76 -15.389 13.179 -5.519 1.00 0.00 C ATOM 1251 C LYS p 76 -16.003 13.929 -4.362 1.00 0.00 C ATOM 1252 O LYS p 76 -16.853 14.805 -4.547 1.00 0.00 O ATOM 1253 CB LYS p 76 -16.194 11.923 -5.824 1.00 0.00 C ATOM 1254 CG LYS p 76 -16.475 11.709 -7.304 1.00 0.00 C ATOM 1255 CD LYS p 76 -17.829 12.274 -7.707 1.00 0.00 C ATOM 1256 CE LYS p 76 -18.109 12.053 -9.185 1.00 0.00 C ATOM 1257 NZ LYS p 76 -19.433 12.603 -9.588 1.00 0.00 N ATOM 0 H LYS p 76 -13.908 11.950 -4.707 1.00 0.00 H new ATOM 0 HA LYS p 76 -15.399 13.792 -6.420 1.00 0.00 H new ATOM 0 HB2 LYS p 76 -15.656 11.057 -5.438 1.00 0.00 H new ATOM 0 HB3 LYS p 76 -17.142 11.973 -5.289 1.00 0.00 H new ATOM 0 HG2 LYS p 76 -15.692 12.184 -7.895 1.00 0.00 H new ATOM 0 HG3 LYS p 76 -16.443 10.643 -7.530 1.00 0.00 H new ATOM 0 HD2 LYS p 76 -18.612 11.803 -7.113 1.00 0.00 H new ATOM 0 HD3 LYS p 76 -17.859 13.341 -7.486 1.00 0.00 H new ATOM 0 HE2 LYS p 76 -17.325 12.524 -9.777 1.00 0.00 H new ATOM 0 HE3 LYS p 76 -18.077 10.986 -9.405 1.00 0.00 H new ATOM 0 HZ1 LYS p 76 -19.586 12.432 -10.602 1.00 0.00 H new ATOM 0 HZ2 LYS p 76 -20.184 12.136 -9.041 1.00 0.00 H new ATOM 0 HZ3 LYS p 76 -19.455 13.626 -9.402 1.00 0.00 H new ATOM 1271 N LYS p 77 -15.551 13.559 -3.156 1.00 0.00 N ATOM 1272 CA LYS p 77 -15.986 14.221 -1.942 1.00 0.00 C ATOM 1273 C LYS p 77 -15.114 15.442 -1.672 1.00 0.00 C ATOM 1274 O LYS p 77 -15.491 16.321 -0.892 1.00 0.00 O ATOM 1275 CB LYS p 77 -15.944 13.260 -0.762 1.00 0.00 C ATOM 1276 CG LYS p 77 -17.264 12.561 -0.497 1.00 0.00 C ATOM 1277 CD LYS p 77 -17.282 11.904 0.873 1.00 0.00 C ATOM 1278 CE LYS p 77 -18.611 11.218 1.145 1.00 0.00 C ATOM 1279 NZ LYS p 77 -18.641 10.580 2.490 1.00 0.00 N ATOM 0 H LYS p 77 -14.883 12.802 -3.006 1.00 0.00 H new ATOM 0 HA LYS p 77 -17.017 14.550 -2.073 1.00 0.00 H new ATOM 0 HB2 LYS p 77 -15.175 12.509 -0.944 1.00 0.00 H new ATOM 0 HB3 LYS p 77 -15.648 13.809 0.132 1.00 0.00 H new ATOM 0 HG2 LYS p 77 -18.079 13.282 -0.567 1.00 0.00 H new ATOM 0 HG3 LYS p 77 -17.438 11.808 -1.265 1.00 0.00 H new ATOM 0 HD2 LYS p 77 -16.475 11.174 0.938 1.00 0.00 H new ATOM 0 HD3 LYS p 77 -17.095 12.655 1.640 1.00 0.00 H new ATOM 0 HE2 LYS p 77 -19.418 11.947 1.071 1.00 0.00 H new ATOM 0 HE3 LYS p 77 -18.793 10.463 0.381 1.00 0.00 H new ATOM 0 HZ1 LYS p 77 -19.564 10.123 2.637 1.00 0.00 H new ATOM 0 HZ2 LYS p 77 -17.887 9.866 2.552 1.00 0.00 H new ATOM 0 HZ3 LYS p 77 -18.493 11.305 3.221 1.00 0.00 H new ATOM 1293 N LEU p 78 -13.938 15.482 -2.329 1.00 0.00 N ATOM 1294 CA LEU p 78 -13.001 16.609 -2.203 1.00 0.00 C ATOM 1295 C LEU p 78 -13.640 17.940 -2.604 1.00 0.00 C ATOM 1296 O LEU p 78 -13.727 18.874 -1.803 1.00 0.00 O ATOM 1297 CB LEU p 78 -11.779 16.355 -3.091 1.00 0.00 C ATOM 1298 CG LEU p 78 -10.447 16.154 -2.372 1.00 0.00 C ATOM 1299 CD1 LEU p 78 -9.408 15.657 -3.359 1.00 0.00 C ATOM 1300 CD2 LEU p 78 -9.988 17.451 -1.731 1.00 0.00 C ATOM 0 H LEU p 78 -13.616 14.743 -2.954 1.00 0.00 H new ATOM 0 HA LEU p 78 -12.711 16.679 -1.155 1.00 0.00 H new ATOM 0 HB2 LEU p 78 -11.976 15.472 -3.699 1.00 0.00 H new ATOM 0 HB3 LEU p 78 -11.674 17.196 -3.776 1.00 0.00 H new ATOM 0 HG LEU p 78 -10.577 15.412 -1.584 1.00 0.00 H new ATOM 0 HD11 LEU p 78 -8.457 15.514 -2.845 1.00 0.00 H new ATOM 0 HD12 LEU p 78 -9.736 14.709 -3.786 1.00 0.00 H new ATOM 0 HD13 LEU p 78 -9.283 16.390 -4.156 1.00 0.00 H new ATOM 0 HD21 LEU p 78 -9.037 17.289 -1.223 1.00 0.00 H new ATOM 0 HD22 LEU p 78 -9.863 18.213 -2.500 1.00 0.00 H new ATOM 0 HD23 LEU p 78 -10.733 17.784 -1.009 1.00 0.00 H new ATOM 1312 N GLN p 79 -14.074 17.990 -3.854 1.00 0.00 N ATOM 1313 CA GLN p 79 -14.724 19.156 -4.437 1.00 0.00 C ATOM 1314 C GLN p 79 -16.242 19.095 -4.273 1.00 0.00 C ATOM 1315 O GLN p 79 -16.885 20.095 -3.946 1.00 0.00 O ATOM 1316 CB GLN p 79 -14.352 19.281 -5.925 1.00 0.00 C ATOM 1317 CG GLN p 79 -14.212 17.959 -6.680 1.00 0.00 C ATOM 1318 CD GLN p 79 -13.844 18.157 -8.138 1.00 0.00 C ATOM 1319 OE1 GLN p 79 -14.716 18.269 -9.000 1.00 0.00 O ATOM 1320 NE2 GLN p 79 -12.547 18.203 -8.421 1.00 0.00 N ATOM 0 H GLN p 79 -13.983 17.209 -4.504 1.00 0.00 H new ATOM 0 HA GLN p 79 -14.369 20.038 -3.903 1.00 0.00 H new ATOM 0 HB2 GLN p 79 -15.111 19.885 -6.422 1.00 0.00 H new ATOM 0 HB3 GLN p 79 -13.411 19.825 -6.002 1.00 0.00 H new ATOM 0 HG2 GLN p 79 -13.450 17.347 -6.196 1.00 0.00 H new ATOM 0 HG3 GLN p 79 -15.150 17.408 -6.617 1.00 0.00 H new ATOM 0 HE21 GLN p 79 -11.858 18.106 -7.675 1.00 0.00 H new ATOM 0 HE22 GLN p 79 -12.240 18.336 -9.384 1.00 0.00 H new ATOM 1329 N ALA p 80 -16.789 17.896 -4.503 1.00 0.00 N ATOM 1330 CA ALA p 80 -18.239 17.604 -4.405 1.00 0.00 C ATOM 1331 C ALA p 80 -19.067 18.435 -5.394 1.00 0.00 C ATOM 1332 O ALA p 80 -19.648 17.835 -6.324 1.00 0.00 O ATOM 1333 CB ALA p 80 -18.755 17.789 -2.973 1.00 0.00 C ATOM 1334 OXT ALA p 80 -19.122 19.674 -5.237 1.00 0.00 O ATOM 0 H ALA p 80 -16.234 17.082 -4.767 1.00 0.00 H new ATOM 0 HA ALA p 80 -18.363 16.556 -4.677 1.00 0.00 H new ATOM 0 HB1 ALA p 80 -19.821 17.566 -2.939 1.00 0.00 H new ATOM 0 HB2 ALA p 80 -18.222 17.114 -2.304 1.00 0.00 H new ATOM 0 HB3 ALA p 80 -18.589 18.819 -2.657 1.00 0.00 H new TER 1340 ALA p 80