USER MOD reduce.3.24.130724 H: found=0, std=0, add=957, rem=0, adj=29 USER MOD reduce.3.24.130724 removed 957 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 : A 1 GLY N :NH3+ -114:sc= 0.0575 (180deg=0) USER MOD Single : A 2 SER OG : rot 180:sc= 0 USER MOD Single : A 3 SER OG : rot 180:sc= 0 USER MOD Single : A 5 SER OG : rot 180:sc= -0.0151 USER MOD Single : A 6 SER OG : rot 8:sc= 0.0397 USER MOD Single : A 11 SER OG : rot 180:sc= 0.0103 USER MOD Single : A 12 THR OG1 : rot 41:sc= 0.403 USER MOD Single : A 14 HIS : no HD1:sc=-0.00586 X(o=-0.0059,f=-0.0023) USER MOD Single : A 17 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 22 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 23 LYS NZ :NH3+ -151:sc= 0 (180deg=-0.0251) USER MOD Single : A 25 ASN : amide:sc= 0.298 K(o=0.3,f=-6.5!) USER MOD Single : A 33 SER OG : rot 180:sc= 0 USER MOD Single : A 37 THR OG1 : rot 180:sc= 0 USER MOD Single : A 44 TYR OH : rot 180:sc= 0 USER MOD Single : A 49 TYR OH : rot 180:sc= 0 USER MOD Single : A 51 THR OG1 : rot 69:sc= 1.07 USER MOD Single : A 57 SER OG : rot 131:sc= 0.195 USER MOD Single : A 62 SER OG : rot 120:sc= -1.36 USER MOD Single : A 65 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 69 GLN : amide:sc= -0.208 K(o=-0.21,f=-1.9!) USER MOD Single : A 74 ASN : amide:sc= 0.376 K(o=0.38,f=-0.33) USER MOD Single : A 77 SER OG : rot 180:sc= -0.0927 USER MOD Single : A 80 ASN : amide:sc= 0.227 K(o=0.23,f=-4.4!) USER MOD Single : A 83 HIS : no HD1:sc= -1.09 X(o=-1.1,f=-0.75) USER MOD Single : A 91 LYS NZ :NH3+ 163:sc= -0.278 (180deg=-0.743) USER MOD Single : A 92 SER OG : rot 180:sc= 0 USER MOD Single : A 93 SER OG : rot 180:sc= 0 USER MOD Single : A 95 HIS : no HD1:sc=-0.00169 X(o=-0.0017,f=-0.0058) USER MOD Single : A 99 THR OG1 : rot 180:sc= -0.0926 USER MOD Single : A 101 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 108 HIS : no HD1:sc= -0.438 X(o=-0.44,f=-0.28) USER MOD Single : A 111 THR OG1 : rot 180:sc=-0.00177 USER MOD Single : A 112 THR OG1 : rot 180:sc= 0 USER MOD Single : A 116 THR OG1 : rot -42:sc= 1.05 USER MOD Single : A 117 LYS NZ :NH3+ -170:sc= 0.0809 (180deg=0.0579) USER MOD Single : A 121 SER OG : rot 180:sc=-0.000813 USER MOD Single : A 122 SER OG : rot 51:sc= 0.119 USER MOD Single : A 123 SER OG : rot 180:sc= 0 USER MOD Single : A 126 SER OG : rot 180:sc= 0.00768 USER MOD Single : A 127 SER OG : rot -171:sc= -0.979 USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 1 23.697 15.191 13.163 1.00 0.00 N ATOM 2 CA GLY A 1 23.035 16.504 12.934 1.00 0.00 C ATOM 3 C GLY A 1 22.073 16.473 11.763 1.00 0.00 C ATOM 4 O GLY A 1 22.092 15.540 10.960 1.00 0.00 O ATOM 0 H1 GLY A 1 23.388 14.801 14.076 1.00 0.00 H new ATOM 0 H2 GLY A 1 23.438 14.534 12.400 1.00 0.00 H new ATOM 0 H3 GLY A 1 24.729 15.320 13.173 1.00 0.00 H new ATOM 0 HA2 GLY A 1 22.496 16.798 13.835 1.00 0.00 H new ATOM 0 HA3 GLY A 1 23.795 17.264 12.755 1.00 0.00 H new ATOM 10 N SER A 2 21.229 17.496 11.664 1.00 0.00 N ATOM 11 CA SER A 2 20.256 17.582 10.583 1.00 0.00 C ATOM 12 C SER A 2 20.940 17.918 9.261 1.00 0.00 C ATOM 13 O SER A 2 20.489 17.502 8.194 1.00 0.00 O ATOM 14 CB SER A 2 19.195 18.636 10.905 1.00 0.00 C ATOM 15 OG SER A 2 18.082 18.057 11.563 1.00 0.00 O ATOM 0 H SER A 2 21.200 18.276 12.320 1.00 0.00 H new ATOM 0 HA SER A 2 19.773 16.610 10.485 1.00 0.00 H new ATOM 0 HB2 SER A 2 19.629 19.413 11.534 1.00 0.00 H new ATOM 0 HB3 SER A 2 18.866 19.118 9.984 1.00 0.00 H new ATOM 0 HG SER A 2 17.420 18.752 11.759 1.00 0.00 H new ATOM 21 N SER A 3 22.029 18.674 9.341 1.00 0.00 N ATOM 22 CA SER A 3 22.775 19.067 8.152 1.00 0.00 C ATOM 23 C SER A 3 21.903 19.889 7.208 1.00 0.00 C ATOM 24 O SER A 3 21.290 19.350 6.286 1.00 0.00 O ATOM 25 CB SER A 3 23.308 17.830 7.426 1.00 0.00 C ATOM 26 OG SER A 3 24.244 18.188 6.424 1.00 0.00 O ATOM 0 H SER A 3 22.415 19.027 10.217 1.00 0.00 H new ATOM 0 HA SER A 3 23.616 19.684 8.469 1.00 0.00 H new ATOM 0 HB2 SER A 3 23.779 17.158 8.144 1.00 0.00 H new ATOM 0 HB3 SER A 3 22.479 17.284 6.975 1.00 0.00 H new ATOM 0 HG SER A 3 24.570 17.379 5.977 1.00 0.00 H new ATOM 32 N GLY A 4 21.851 21.195 7.445 1.00 0.00 N ATOM 33 CA GLY A 4 21.050 22.070 6.609 1.00 0.00 C ATOM 34 C GLY A 4 19.898 22.701 7.365 1.00 0.00 C ATOM 35 O GLY A 4 19.778 23.925 7.419 1.00 0.00 O ATOM 0 H GLY A 4 22.349 21.664 8.201 1.00 0.00 H new ATOM 0 HA2 GLY A 4 21.684 22.856 6.198 1.00 0.00 H new ATOM 0 HA3 GLY A 4 20.659 21.502 5.765 1.00 0.00 H new ATOM 39 N SER A 5 19.050 21.863 7.953 1.00 0.00 N ATOM 40 CA SER A 5 17.901 22.346 8.710 1.00 0.00 C ATOM 41 C SER A 5 16.971 23.168 7.823 1.00 0.00 C ATOM 42 O SER A 5 17.247 23.378 6.643 1.00 0.00 O ATOM 43 CB SER A 5 18.366 23.188 9.901 1.00 0.00 C ATOM 44 OG SER A 5 19.618 22.734 10.388 1.00 0.00 O ATOM 0 H SER A 5 19.137 20.847 7.920 1.00 0.00 H new ATOM 0 HA SER A 5 17.350 21.481 9.078 1.00 0.00 H new ATOM 0 HB2 SER A 5 18.446 24.233 9.603 1.00 0.00 H new ATOM 0 HB3 SER A 5 17.623 23.139 10.697 1.00 0.00 H new ATOM 0 HG SER A 5 19.894 23.289 11.147 1.00 0.00 H new ATOM 50 N SER A 6 15.867 23.629 8.402 1.00 0.00 N ATOM 51 CA SER A 6 14.895 24.428 7.664 1.00 0.00 C ATOM 52 C SER A 6 14.326 25.540 8.540 1.00 0.00 C ATOM 53 O SER A 6 14.661 25.646 9.720 1.00 0.00 O ATOM 54 CB SER A 6 13.762 23.541 7.146 1.00 0.00 C ATOM 55 OG SER A 6 14.172 22.801 6.009 1.00 0.00 O ATOM 0 H SER A 6 15.623 23.463 9.379 1.00 0.00 H new ATOM 0 HA SER A 6 15.407 24.884 6.816 1.00 0.00 H new ATOM 0 HB2 SER A 6 13.443 22.857 7.933 1.00 0.00 H new ATOM 0 HB3 SER A 6 12.901 24.158 6.891 1.00 0.00 H new ATOM 0 HG SER A 6 15.136 22.916 5.874 1.00 0.00 H new ATOM 61 N GLY A 7 13.464 26.365 7.955 1.00 0.00 N ATOM 62 CA GLY A 7 12.863 27.457 8.698 1.00 0.00 C ATOM 63 C GLY A 7 13.873 28.519 9.087 1.00 0.00 C ATOM 64 O GLY A 7 14.759 28.270 9.905 1.00 0.00 O ATOM 0 H GLY A 7 13.171 26.297 6.980 1.00 0.00 H new ATOM 0 HA2 GLY A 7 12.076 27.912 8.097 1.00 0.00 H new ATOM 0 HA3 GLY A 7 12.390 27.063 9.597 1.00 0.00 H new ATOM 68 N ASP A 8 13.738 29.704 8.502 1.00 0.00 N ATOM 69 CA ASP A 8 14.646 30.807 8.793 1.00 0.00 C ATOM 70 C ASP A 8 14.429 31.332 10.208 1.00 0.00 C ATOM 71 O ASP A 8 15.356 31.369 11.016 1.00 0.00 O ATOM 72 CB ASP A 8 14.449 31.938 7.780 1.00 0.00 C ATOM 73 CG ASP A 8 15.762 32.549 7.334 1.00 0.00 C ATOM 74 OD1 ASP A 8 16.656 31.789 6.906 1.00 0.00 O ATOM 75 OD2 ASP A 8 15.897 33.788 7.412 1.00 0.00 O ATOM 0 H ASP A 8 13.009 29.925 7.824 1.00 0.00 H new ATOM 0 HA ASP A 8 15.667 30.434 8.717 1.00 0.00 H new ATOM 0 HB2 ASP A 8 13.916 31.554 6.910 1.00 0.00 H new ATOM 0 HB3 ASP A 8 13.822 32.713 8.222 1.00 0.00 H new ATOM 80 N ARG A 9 13.196 31.736 10.501 1.00 0.00 N ATOM 81 CA ARG A 9 12.857 32.258 11.820 1.00 0.00 C ATOM 82 C ARG A 9 12.179 31.186 12.670 1.00 0.00 C ATOM 83 O ARG A 9 10.974 31.242 12.917 1.00 0.00 O ATOM 84 CB ARG A 9 11.951 33.484 11.687 1.00 0.00 C ATOM 85 CG ARG A 9 12.458 34.701 12.446 1.00 0.00 C ATOM 86 CD ARG A 9 12.235 35.985 11.661 1.00 0.00 C ATOM 87 NE ARG A 9 13.486 36.530 11.139 1.00 0.00 N ATOM 88 CZ ARG A 9 13.551 37.411 10.143 1.00 0.00 C ATOM 89 NH1 ARG A 9 12.443 37.848 9.559 1.00 0.00 N ATOM 90 NH2 ARG A 9 14.730 37.856 9.730 1.00 0.00 N ATOM 0 H ARG A 9 12.417 31.712 9.843 1.00 0.00 H new ATOM 0 HA ARG A 9 13.779 32.555 12.319 1.00 0.00 H new ATOM 0 HB2 ARG A 9 11.852 33.739 10.632 1.00 0.00 H new ATOM 0 HB3 ARG A 9 10.955 33.230 12.048 1.00 0.00 H new ATOM 0 HG2 ARG A 9 11.949 34.769 13.407 1.00 0.00 H new ATOM 0 HG3 ARG A 9 13.521 34.582 12.656 1.00 0.00 H new ATOM 0 HD2 ARG A 9 11.551 35.791 10.835 1.00 0.00 H new ATOM 0 HD3 ARG A 9 11.757 36.725 12.303 1.00 0.00 H new ATOM 0 HE ARG A 9 14.360 36.218 11.562 1.00 0.00 H new ATOM 0 HH11 ARG A 9 11.533 37.509 9.872 1.00 0.00 H new ATOM 0 HH12 ARG A 9 12.501 38.523 8.796 1.00 0.00 H new ATOM 0 HH21 ARG A 9 15.585 37.523 10.175 1.00 0.00 H new ATOM 0 HH22 ARG A 9 14.782 38.531 8.967 1.00 0.00 H new ATOM 104 N ARG A 10 12.962 30.207 13.112 1.00 0.00 N ATOM 105 CA ARG A 10 12.438 29.119 13.932 1.00 0.00 C ATOM 106 C ARG A 10 13.553 28.159 14.338 1.00 0.00 C ATOM 107 O ARG A 10 14.734 28.449 14.146 1.00 0.00 O ATOM 108 CB ARG A 10 11.346 28.360 13.176 1.00 0.00 C ATOM 109 CG ARG A 10 10.185 27.928 14.056 1.00 0.00 C ATOM 110 CD ARG A 10 8.999 28.869 13.916 1.00 0.00 C ATOM 111 NE ARG A 10 9.237 30.153 14.570 1.00 0.00 N ATOM 112 CZ ARG A 10 8.274 31.016 14.882 1.00 0.00 C ATOM 113 NH1 ARG A 10 7.006 30.737 14.599 1.00 0.00 N ATOM 114 NH2 ARG A 10 8.576 32.162 15.476 1.00 0.00 N ATOM 0 H ARG A 10 13.961 30.144 12.917 1.00 0.00 H new ATOM 0 HA ARG A 10 12.009 29.553 14.835 1.00 0.00 H new ATOM 0 HB2 ARG A 10 10.967 28.991 12.372 1.00 0.00 H new ATOM 0 HB3 ARG A 10 11.785 27.478 12.709 1.00 0.00 H new ATOM 0 HG2 ARG A 10 9.881 26.916 13.788 1.00 0.00 H new ATOM 0 HG3 ARG A 10 10.507 27.899 15.097 1.00 0.00 H new ATOM 0 HD2 ARG A 10 8.790 29.034 12.859 1.00 0.00 H new ATOM 0 HD3 ARG A 10 8.113 28.402 14.347 1.00 0.00 H new ATOM 0 HE ARG A 10 10.199 30.403 14.801 1.00 0.00 H new ATOM 0 HH11 ARG A 10 6.767 29.858 14.140 1.00 0.00 H new ATOM 0 HH12 ARG A 10 6.271 31.402 14.840 1.00 0.00 H new ATOM 0 HH21 ARG A 10 9.548 32.383 15.694 1.00 0.00 H new ATOM 0 HH22 ARG A 10 7.837 32.823 15.715 1.00 0.00 H new ATOM 128 N SER A 11 13.170 27.019 14.900 1.00 0.00 N ATOM 129 CA SER A 11 14.138 26.017 15.332 1.00 0.00 C ATOM 130 C SER A 11 13.741 24.627 14.842 1.00 0.00 C ATOM 131 O SER A 11 14.300 24.118 13.871 1.00 0.00 O ATOM 132 CB SER A 11 14.258 26.018 16.857 1.00 0.00 C ATOM 133 OG SER A 11 13.021 26.343 17.467 1.00 0.00 O ATOM 0 H SER A 11 12.196 26.765 15.067 1.00 0.00 H new ATOM 0 HA SER A 11 15.105 26.272 14.898 1.00 0.00 H new ATOM 0 HB2 SER A 11 14.589 25.037 17.199 1.00 0.00 H new ATOM 0 HB3 SER A 11 15.018 26.736 17.164 1.00 0.00 H new ATOM 0 HG SER A 11 13.125 26.335 18.441 1.00 0.00 H new ATOM 139 N THR A 12 12.771 24.020 15.519 1.00 0.00 N ATOM 140 CA THR A 12 12.300 22.690 15.151 1.00 0.00 C ATOM 141 C THR A 12 10.786 22.587 15.308 1.00 0.00 C ATOM 142 O THR A 12 10.265 22.604 16.424 1.00 0.00 O ATOM 143 CB THR A 12 12.987 21.627 16.011 1.00 0.00 C ATOM 144 OG1 THR A 12 12.844 21.926 17.387 1.00 0.00 O ATOM 145 CG2 THR A 12 14.466 21.488 15.722 1.00 0.00 C ATOM 0 H THR A 12 12.296 24.428 16.325 1.00 0.00 H new ATOM 0 HA THR A 12 12.552 22.519 14.104 1.00 0.00 H new ATOM 0 HB THR A 12 12.494 20.688 15.758 1.00 0.00 H new ATOM 0 HG1 THR A 12 11.933 22.244 17.560 1.00 0.00 H new ATOM 0 HG21 THR A 12 14.892 20.718 16.366 1.00 0.00 H new ATOM 0 HG22 THR A 12 14.608 21.208 14.678 1.00 0.00 H new ATOM 0 HG23 THR A 12 14.965 22.438 15.914 1.00 0.00 H new ATOM 153 N LEU A 13 10.085 22.481 14.184 1.00 0.00 N ATOM 154 CA LEU A 13 8.630 22.376 14.197 1.00 0.00 C ATOM 155 C LEU A 13 8.171 21.092 13.510 1.00 0.00 C ATOM 156 O LEU A 13 8.243 20.972 12.287 1.00 0.00 O ATOM 157 CB LEU A 13 8.006 23.592 13.510 1.00 0.00 C ATOM 158 CG LEU A 13 6.822 24.217 14.249 1.00 0.00 C ATOM 159 CD1 LEU A 13 6.291 25.421 13.486 1.00 0.00 C ATOM 160 CD2 LEU A 13 5.720 23.189 14.458 1.00 0.00 C ATOM 0 H LEU A 13 10.501 22.466 13.253 1.00 0.00 H new ATOM 0 HA LEU A 13 8.300 22.346 15.235 1.00 0.00 H new ATOM 0 HB2 LEU A 13 8.776 24.352 13.381 1.00 0.00 H new ATOM 0 HB3 LEU A 13 7.678 23.298 12.513 1.00 0.00 H new ATOM 0 HG LEU A 13 7.167 24.555 15.226 1.00 0.00 H new ATOM 0 HD11 LEU A 13 5.449 25.852 14.027 1.00 0.00 H new ATOM 0 HD12 LEU A 13 7.080 26.167 13.388 1.00 0.00 H new ATOM 0 HD13 LEU A 13 5.963 25.108 12.495 1.00 0.00 H new ATOM 0 HD21 LEU A 13 4.886 23.652 14.985 1.00 0.00 H new ATOM 0 HD22 LEU A 13 5.378 22.820 13.491 1.00 0.00 H new ATOM 0 HD23 LEU A 13 6.105 22.357 15.048 1.00 0.00 H new ATOM 172 N HIS A 14 7.699 20.138 14.305 1.00 0.00 N ATOM 173 CA HIS A 14 7.228 18.863 13.773 1.00 0.00 C ATOM 174 C HIS A 14 5.710 18.753 13.885 1.00 0.00 C ATOM 175 O HIS A 14 5.064 18.098 13.068 1.00 0.00 O ATOM 176 CB HIS A 14 7.891 17.701 14.514 1.00 0.00 C ATOM 177 CG HIS A 14 8.130 16.501 13.652 1.00 0.00 C ATOM 178 ND1 HIS A 14 9.318 15.800 13.648 1.00 0.00 N ATOM 179 CD2 HIS A 14 7.323 15.875 12.762 1.00 0.00 C ATOM 180 CE1 HIS A 14 9.232 14.798 12.791 1.00 0.00 C ATOM 181 NE2 HIS A 14 8.032 14.821 12.242 1.00 0.00 N ATOM 0 H HIS A 14 7.632 20.223 15.319 1.00 0.00 H new ATOM 0 HA HIS A 14 7.501 18.815 12.719 1.00 0.00 H new ATOM 0 HB2 HIS A 14 8.842 18.038 14.925 1.00 0.00 H new ATOM 0 HB3 HIS A 14 7.263 17.413 15.358 1.00 0.00 H new ATOM 0 HD2 HIS A 14 6.311 16.153 12.509 1.00 0.00 H new ATOM 0 HE1 HIS A 14 10.011 14.082 12.576 1.00 0.00 H new ATOM 0 HE2 HIS A 14 7.687 14.162 11.544 1.00 0.00 H new ATOM 190 N LEU A 15 5.148 19.398 14.903 1.00 0.00 N ATOM 191 CA LEU A 15 3.706 19.371 15.122 1.00 0.00 C ATOM 192 C LEU A 15 2.960 19.921 13.910 1.00 0.00 C ATOM 193 O LEU A 15 2.909 21.133 13.698 1.00 0.00 O ATOM 194 CB LEU A 15 3.344 20.180 16.370 1.00 0.00 C ATOM 195 CG LEU A 15 1.990 19.836 16.993 1.00 0.00 C ATOM 196 CD1 LEU A 15 2.132 18.683 17.974 1.00 0.00 C ATOM 197 CD2 LEU A 15 1.396 21.055 17.682 1.00 0.00 C ATOM 0 H LEU A 15 5.669 19.945 15.588 1.00 0.00 H new ATOM 0 HA LEU A 15 3.405 18.334 15.270 1.00 0.00 H new ATOM 0 HB2 LEU A 15 4.121 20.030 17.120 1.00 0.00 H new ATOM 0 HB3 LEU A 15 3.350 21.239 16.112 1.00 0.00 H new ATOM 0 HG LEU A 15 1.312 19.527 16.197 1.00 0.00 H new ATOM 0 HD11 LEU A 15 1.159 18.452 18.407 1.00 0.00 H new ATOM 0 HD12 LEU A 15 2.514 17.806 17.452 1.00 0.00 H new ATOM 0 HD13 LEU A 15 2.825 18.963 18.767 1.00 0.00 H new ATOM 0 HD21 LEU A 15 0.433 20.792 18.120 1.00 0.00 H new ATOM 0 HD22 LEU A 15 2.071 21.394 18.468 1.00 0.00 H new ATOM 0 HD23 LEU A 15 1.258 21.854 16.953 1.00 0.00 H new ATOM 209 N LEU A 16 2.383 19.024 13.119 1.00 0.00 N ATOM 210 CA LEU A 16 1.639 19.420 11.929 1.00 0.00 C ATOM 211 C LEU A 16 0.149 19.539 12.233 1.00 0.00 C ATOM 212 O LEU A 16 -0.400 18.759 13.011 1.00 0.00 O ATOM 213 CB LEU A 16 1.866 18.410 10.801 1.00 0.00 C ATOM 214 CG LEU A 16 2.648 18.947 9.600 1.00 0.00 C ATOM 215 CD1 LEU A 16 1.851 20.024 8.883 1.00 0.00 C ATOM 216 CD2 LEU A 16 3.999 19.488 10.045 1.00 0.00 C ATOM 0 H LEU A 16 2.416 18.017 13.280 1.00 0.00 H new ATOM 0 HA LEU A 16 2.003 20.397 11.610 1.00 0.00 H new ATOM 0 HB2 LEU A 16 2.398 17.549 11.206 1.00 0.00 H new ATOM 0 HB3 LEU A 16 0.897 18.052 10.454 1.00 0.00 H new ATOM 0 HG LEU A 16 2.818 18.126 8.903 1.00 0.00 H new ATOM 0 HD11 LEU A 16 2.423 20.394 8.032 1.00 0.00 H new ATOM 0 HD12 LEU A 16 0.908 19.606 8.532 1.00 0.00 H new ATOM 0 HD13 LEU A 16 1.650 20.846 9.570 1.00 0.00 H new ATOM 0 HD21 LEU A 16 4.543 19.866 9.179 1.00 0.00 H new ATOM 0 HD22 LEU A 16 3.849 20.296 10.761 1.00 0.00 H new ATOM 0 HD23 LEU A 16 4.574 18.690 10.514 1.00 0.00 H new ATOM 228 N GLN A 17 -0.499 20.523 11.617 1.00 0.00 N ATOM 229 CA GLN A 17 -1.926 20.745 11.823 1.00 0.00 C ATOM 230 C GLN A 17 -2.753 19.926 10.837 1.00 0.00 C ATOM 231 O GLN A 17 -3.867 19.506 11.146 1.00 0.00 O ATOM 232 CB GLN A 17 -2.257 22.231 11.675 1.00 0.00 C ATOM 233 CG GLN A 17 -1.399 23.135 12.545 1.00 0.00 C ATOM 234 CD GLN A 17 -0.533 24.078 11.732 1.00 0.00 C ATOM 235 OE1 GLN A 17 -0.953 25.183 11.386 1.00 0.00 O ATOM 236 NE2 GLN A 17 0.684 23.646 11.421 1.00 0.00 N ATOM 0 H GLN A 17 -0.059 21.179 10.972 1.00 0.00 H new ATOM 0 HA GLN A 17 -2.177 20.422 12.833 1.00 0.00 H new ATOM 0 HB2 GLN A 17 -2.133 22.520 10.631 1.00 0.00 H new ATOM 0 HB3 GLN A 17 -3.306 22.388 11.926 1.00 0.00 H new ATOM 0 HG2 GLN A 17 -2.043 23.717 13.204 1.00 0.00 H new ATOM 0 HG3 GLN A 17 -0.762 22.522 13.182 1.00 0.00 H new ATOM 0 HE21 GLN A 17 0.992 22.723 11.728 1.00 0.00 H new ATOM 0 HE22 GLN A 17 1.311 24.237 10.875 1.00 0.00 H new ATOM 245 N GLY A 18 -2.200 19.705 9.649 1.00 0.00 N ATOM 246 CA GLY A 18 -2.901 18.938 8.635 1.00 0.00 C ATOM 247 C GLY A 18 -2.434 17.497 8.572 1.00 0.00 C ATOM 248 O GLY A 18 -1.279 17.225 8.249 1.00 0.00 O ATOM 0 H GLY A 18 -1.279 20.043 9.370 1.00 0.00 H new ATOM 0 HA2 GLY A 18 -3.971 18.961 8.841 1.00 0.00 H new ATOM 0 HA3 GLY A 18 -2.754 19.407 7.662 1.00 0.00 H new ATOM 252 N GLY A 19 -3.337 16.571 8.882 1.00 0.00 N ATOM 253 CA GLY A 19 -2.993 15.163 8.853 1.00 0.00 C ATOM 254 C GLY A 19 -4.185 14.281 8.533 1.00 0.00 C ATOM 255 O GLY A 19 -4.483 13.339 9.268 1.00 0.00 O ATOM 0 H GLY A 19 -4.300 16.772 9.152 1.00 0.00 H new ATOM 0 HA2 GLY A 19 -2.213 14.998 8.110 1.00 0.00 H new ATOM 0 HA3 GLY A 19 -2.579 14.873 9.819 1.00 0.00 H new ATOM 259 N ASP A 20 -4.868 14.587 7.435 1.00 0.00 N ATOM 260 CA ASP A 20 -6.034 13.816 7.020 1.00 0.00 C ATOM 261 C ASP A 20 -5.619 12.616 6.174 1.00 0.00 C ATOM 262 O ASP A 20 -5.249 12.764 5.009 1.00 0.00 O ATOM 263 CB ASP A 20 -7.002 14.700 6.232 1.00 0.00 C ATOM 264 CG ASP A 20 -8.302 13.989 5.910 1.00 0.00 C ATOM 265 OD1 ASP A 20 -8.323 13.205 4.937 1.00 0.00 O ATOM 266 OD2 ASP A 20 -9.297 14.216 6.628 1.00 0.00 O ATOM 0 H ASP A 20 -4.634 15.364 6.816 1.00 0.00 H new ATOM 0 HA ASP A 20 -6.535 13.450 7.916 1.00 0.00 H new ATOM 0 HB2 ASP A 20 -7.216 15.601 6.806 1.00 0.00 H new ATOM 0 HB3 ASP A 20 -6.526 15.019 5.305 1.00 0.00 H new ATOM 271 N GLU A 21 -5.685 11.429 6.768 1.00 0.00 N ATOM 272 CA GLU A 21 -5.317 10.203 6.068 1.00 0.00 C ATOM 273 C GLU A 21 -6.559 9.424 5.646 1.00 0.00 C ATOM 274 O GLU A 21 -7.490 9.250 6.431 1.00 0.00 O ATOM 275 CB GLU A 21 -4.431 9.330 6.958 1.00 0.00 C ATOM 276 CG GLU A 21 -2.962 9.724 6.927 1.00 0.00 C ATOM 277 CD GLU A 21 -2.419 10.064 8.302 1.00 0.00 C ATOM 278 OE1 GLU A 21 -3.215 10.492 9.165 1.00 0.00 O ATOM 279 OE2 GLU A 21 -1.199 9.903 8.515 1.00 0.00 O ATOM 0 H GLU A 21 -5.990 11.290 7.731 1.00 0.00 H new ATOM 0 HA GLU A 21 -4.761 10.478 5.172 1.00 0.00 H new ATOM 0 HB2 GLU A 21 -4.793 9.387 7.985 1.00 0.00 H new ATOM 0 HB3 GLU A 21 -4.527 8.291 6.644 1.00 0.00 H new ATOM 0 HG2 GLU A 21 -2.379 8.906 6.503 1.00 0.00 H new ATOM 0 HG3 GLU A 21 -2.834 10.582 6.268 1.00 0.00 H new ATOM 286 N LYS A 22 -6.564 8.959 4.401 1.00 0.00 N ATOM 287 CA LYS A 22 -7.692 8.199 3.874 1.00 0.00 C ATOM 288 C LYS A 22 -7.290 6.756 3.589 1.00 0.00 C ATOM 289 O LYS A 22 -6.179 6.489 3.131 1.00 0.00 O ATOM 290 CB LYS A 22 -8.224 8.854 2.598 1.00 0.00 C ATOM 291 CG LYS A 22 -9.546 8.274 2.123 1.00 0.00 C ATOM 292 CD LYS A 22 -9.986 8.896 0.808 1.00 0.00 C ATOM 293 CE LYS A 22 -9.664 7.991 -0.371 1.00 0.00 C ATOM 294 NZ LYS A 22 -10.645 8.152 -1.479 1.00 0.00 N ATOM 0 H LYS A 22 -5.800 9.095 3.739 1.00 0.00 H new ATOM 0 HA LYS A 22 -8.479 8.196 4.628 1.00 0.00 H new ATOM 0 HB2 LYS A 22 -8.347 9.923 2.772 1.00 0.00 H new ATOM 0 HB3 LYS A 22 -7.483 8.744 1.806 1.00 0.00 H new ATOM 0 HG2 LYS A 22 -9.449 7.195 2.002 1.00 0.00 H new ATOM 0 HG3 LYS A 22 -10.312 8.442 2.881 1.00 0.00 H new ATOM 0 HD2 LYS A 22 -11.058 9.090 0.837 1.00 0.00 H new ATOM 0 HD3 LYS A 22 -9.491 9.858 0.676 1.00 0.00 H new ATOM 0 HE2 LYS A 22 -8.662 8.215 -0.738 1.00 0.00 H new ATOM 0 HE3 LYS A 22 -9.657 6.952 -0.040 1.00 0.00 H new ATOM 0 HZ1 LYS A 22 -10.390 7.518 -2.263 1.00 0.00 H new ATOM 0 HZ2 LYS A 22 -11.598 7.914 -1.137 1.00 0.00 H new ATOM 0 HZ3 LYS A 22 -10.633 9.137 -1.812 1.00 0.00 H new ATOM 308 N LYS A 23 -8.201 5.828 3.862 1.00 0.00 N ATOM 309 CA LYS A 23 -7.943 4.411 3.635 1.00 0.00 C ATOM 310 C LYS A 23 -8.872 3.854 2.561 1.00 0.00 C ATOM 311 O LYS A 23 -10.055 4.192 2.514 1.00 0.00 O ATOM 312 CB LYS A 23 -8.117 3.623 4.935 1.00 0.00 C ATOM 313 CG LYS A 23 -7.639 2.184 4.843 1.00 0.00 C ATOM 314 CD LYS A 23 -8.027 1.389 6.080 1.00 0.00 C ATOM 315 CE LYS A 23 -6.919 1.405 7.121 1.00 0.00 C ATOM 316 NZ LYS A 23 -7.129 2.472 8.139 1.00 0.00 N ATOM 0 H LYS A 23 -9.126 6.032 4.241 1.00 0.00 H new ATOM 0 HA LYS A 23 -6.914 4.306 3.291 1.00 0.00 H new ATOM 0 HB2 LYS A 23 -7.571 4.128 5.732 1.00 0.00 H new ATOM 0 HB3 LYS A 23 -9.170 3.630 5.216 1.00 0.00 H new ATOM 0 HG2 LYS A 23 -8.066 1.713 3.958 1.00 0.00 H new ATOM 0 HG3 LYS A 23 -6.556 2.166 4.722 1.00 0.00 H new ATOM 0 HD2 LYS A 23 -8.938 1.805 6.510 1.00 0.00 H new ATOM 0 HD3 LYS A 23 -8.248 0.360 5.798 1.00 0.00 H new ATOM 0 HE2 LYS A 23 -6.872 0.435 7.616 1.00 0.00 H new ATOM 0 HE3 LYS A 23 -5.959 1.558 6.627 1.00 0.00 H new ATOM 0 HZ1 LYS A 23 -6.208 2.788 8.505 1.00 0.00 H new ATOM 0 HZ2 LYS A 23 -7.623 3.276 7.702 1.00 0.00 H new ATOM 0 HZ3 LYS A 23 -7.703 2.097 8.921 1.00 0.00 H new ATOM 330 N VAL A 24 -8.329 3.000 1.701 1.00 0.00 N ATOM 331 CA VAL A 24 -9.109 2.396 0.627 1.00 0.00 C ATOM 332 C VAL A 24 -8.952 0.879 0.619 1.00 0.00 C ATOM 333 O VAL A 24 -7.896 0.356 0.266 1.00 0.00 O ATOM 334 CB VAL A 24 -8.695 2.950 -0.748 1.00 0.00 C ATOM 335 CG1 VAL A 24 -9.648 2.464 -1.830 1.00 0.00 C ATOM 336 CG2 VAL A 24 -8.642 4.470 -0.718 1.00 0.00 C ATOM 0 H VAL A 24 -7.351 2.710 1.726 1.00 0.00 H new ATOM 0 HA VAL A 24 -10.152 2.650 0.814 1.00 0.00 H new ATOM 0 HB VAL A 24 -7.697 2.579 -0.982 1.00 0.00 H new ATOM 0 HG11 VAL A 24 -9.339 2.866 -2.795 1.00 0.00 H new ATOM 0 HG12 VAL A 24 -9.630 1.375 -1.868 1.00 0.00 H new ATOM 0 HG13 VAL A 24 -10.659 2.802 -1.603 1.00 0.00 H new ATOM 0 HG21 VAL A 24 -8.348 4.843 -1.699 1.00 0.00 H new ATOM 0 HG22 VAL A 24 -9.625 4.863 -0.460 1.00 0.00 H new ATOM 0 HG23 VAL A 24 -7.915 4.794 0.027 1.00 0.00 H new ATOM 346 N ASN A 25 -10.011 0.178 1.013 1.00 0.00 N ATOM 347 CA ASN A 25 -9.991 -1.280 1.051 1.00 0.00 C ATOM 348 C ASN A 25 -10.392 -1.866 -0.298 1.00 0.00 C ATOM 349 O ASN A 25 -11.477 -1.587 -0.809 1.00 0.00 O ATOM 350 CB ASN A 25 -10.931 -1.795 2.144 1.00 0.00 C ATOM 351 CG ASN A 25 -12.356 -1.315 1.954 1.00 0.00 C ATOM 352 OD1 ASN A 25 -12.594 -0.247 1.389 1.00 0.00 O ATOM 353 ND2 ASN A 25 -13.314 -2.103 2.427 1.00 0.00 N ATOM 0 H ASN A 25 -10.893 0.596 1.310 1.00 0.00 H new ATOM 0 HA ASN A 25 -8.973 -1.599 1.276 1.00 0.00 H new ATOM 0 HB2 ASN A 25 -10.915 -2.885 2.149 1.00 0.00 H new ATOM 0 HB3 ASN A 25 -10.567 -1.466 3.117 1.00 0.00 H new ATOM 0 HD21 ASN A 25 -14.292 -1.832 2.329 1.00 0.00 H new ATOM 0 HD22 ASN A 25 -13.072 -2.980 2.888 1.00 0.00 H new ATOM 360 N LEU A 26 -9.511 -2.680 -0.870 1.00 0.00 N ATOM 361 CA LEU A 26 -9.773 -3.307 -2.160 1.00 0.00 C ATOM 362 C LEU A 26 -9.746 -4.827 -2.042 1.00 0.00 C ATOM 363 O LEU A 26 -8.683 -5.430 -1.896 1.00 0.00 O ATOM 364 CB LEU A 26 -8.743 -2.845 -3.193 1.00 0.00 C ATOM 365 CG LEU A 26 -8.630 -1.330 -3.365 1.00 0.00 C ATOM 366 CD1 LEU A 26 -7.505 -0.984 -4.328 1.00 0.00 C ATOM 367 CD2 LEU A 26 -9.949 -0.751 -3.853 1.00 0.00 C ATOM 0 H LEU A 26 -8.609 -2.921 -0.460 1.00 0.00 H new ATOM 0 HA LEU A 26 -10.767 -3.004 -2.488 1.00 0.00 H new ATOM 0 HB2 LEU A 26 -7.766 -3.236 -2.909 1.00 0.00 H new ATOM 0 HB3 LEU A 26 -8.995 -3.287 -4.157 1.00 0.00 H new ATOM 0 HG LEU A 26 -8.398 -0.889 -2.395 1.00 0.00 H new ATOM 0 HD11 LEU A 26 -7.440 0.099 -4.438 1.00 0.00 H new ATOM 0 HD12 LEU A 26 -6.562 -1.367 -3.938 1.00 0.00 H new ATOM 0 HD13 LEU A 26 -7.706 -1.436 -5.299 1.00 0.00 H new ATOM 0 HD21 LEU A 26 -9.851 0.328 -3.970 1.00 0.00 H new ATOM 0 HD22 LEU A 26 -10.210 -1.198 -4.812 1.00 0.00 H new ATOM 0 HD23 LEU A 26 -10.732 -0.968 -3.127 1.00 0.00 H new ATOM 379 N VAL A 27 -10.923 -5.441 -2.105 1.00 0.00 N ATOM 380 CA VAL A 27 -11.035 -6.891 -2.006 1.00 0.00 C ATOM 381 C VAL A 27 -10.982 -7.542 -3.384 1.00 0.00 C ATOM 382 O VAL A 27 -11.855 -7.317 -4.222 1.00 0.00 O ATOM 383 CB VAL A 27 -12.341 -7.307 -1.304 1.00 0.00 C ATOM 384 CG1 VAL A 27 -12.347 -8.804 -1.030 1.00 0.00 C ATOM 385 CG2 VAL A 27 -12.528 -6.522 -0.015 1.00 0.00 C ATOM 0 H VAL A 27 -11.813 -4.957 -2.224 1.00 0.00 H new ATOM 0 HA VAL A 27 -10.187 -7.234 -1.412 1.00 0.00 H new ATOM 0 HB VAL A 27 -13.176 -7.078 -1.966 1.00 0.00 H new ATOM 0 HG11 VAL A 27 -13.278 -9.079 -0.534 1.00 0.00 H new ATOM 0 HG12 VAL A 27 -12.264 -9.347 -1.972 1.00 0.00 H new ATOM 0 HG13 VAL A 27 -11.504 -9.060 -0.388 1.00 0.00 H new ATOM 0 HG21 VAL A 27 -13.456 -6.830 0.467 1.00 0.00 H new ATOM 0 HG22 VAL A 27 -11.690 -6.716 0.654 1.00 0.00 H new ATOM 0 HG23 VAL A 27 -12.572 -5.457 -0.241 1.00 0.00 H new ATOM 395 N LEU A 28 -9.952 -8.350 -3.611 1.00 0.00 N ATOM 396 CA LEU A 28 -9.785 -9.035 -4.889 1.00 0.00 C ATOM 397 C LEU A 28 -10.213 -10.495 -4.782 1.00 0.00 C ATOM 398 O LEU A 28 -10.252 -11.063 -3.692 1.00 0.00 O ATOM 399 CB LEU A 28 -8.330 -8.948 -5.350 1.00 0.00 C ATOM 400 CG LEU A 28 -7.735 -7.540 -5.360 1.00 0.00 C ATOM 401 CD1 LEU A 28 -6.234 -7.595 -5.597 1.00 0.00 C ATOM 402 CD2 LEU A 28 -8.411 -6.684 -6.420 1.00 0.00 C ATOM 0 H LEU A 28 -9.221 -8.547 -2.928 1.00 0.00 H new ATOM 0 HA LEU A 28 -10.421 -8.543 -5.625 1.00 0.00 H new ATOM 0 HB2 LEU A 28 -7.721 -9.578 -4.701 1.00 0.00 H new ATOM 0 HB3 LEU A 28 -8.258 -9.363 -6.355 1.00 0.00 H new ATOM 0 HG LEU A 28 -7.912 -7.086 -4.385 1.00 0.00 H new ATOM 0 HD11 LEU A 28 -5.829 -6.583 -5.601 1.00 0.00 H new ATOM 0 HD12 LEU A 28 -5.761 -8.172 -4.802 1.00 0.00 H new ATOM 0 HD13 LEU A 28 -6.035 -8.069 -6.558 1.00 0.00 H new ATOM 0 HD21 LEU A 28 -7.975 -5.685 -6.413 1.00 0.00 H new ATOM 0 HD22 LEU A 28 -8.265 -7.137 -7.401 1.00 0.00 H new ATOM 0 HD23 LEU A 28 -9.478 -6.616 -6.207 1.00 0.00 H new ATOM 414 N GLY A 29 -10.532 -11.097 -5.924 1.00 0.00 N ATOM 415 CA GLY A 29 -10.952 -12.485 -5.938 1.00 0.00 C ATOM 416 C GLY A 29 -9.794 -13.443 -5.738 1.00 0.00 C ATOM 417 O GLY A 29 -9.810 -14.264 -4.821 1.00 0.00 O ATOM 0 H GLY A 29 -10.507 -10.648 -6.839 1.00 0.00 H new ATOM 0 HA2 GLY A 29 -11.692 -12.645 -5.154 1.00 0.00 H new ATOM 0 HA3 GLY A 29 -11.441 -12.704 -6.887 1.00 0.00 H new ATOM 421 N ASP A 30 -8.786 -13.337 -6.599 1.00 0.00 N ATOM 422 CA ASP A 30 -7.615 -14.200 -6.513 1.00 0.00 C ATOM 423 C ASP A 30 -6.465 -13.640 -7.344 1.00 0.00 C ATOM 424 O ASP A 30 -5.653 -14.392 -7.885 1.00 0.00 O ATOM 425 CB ASP A 30 -7.963 -15.616 -6.982 1.00 0.00 C ATOM 426 CG ASP A 30 -7.781 -16.649 -5.887 1.00 0.00 C ATOM 427 OD1 ASP A 30 -8.733 -16.863 -5.107 1.00 0.00 O ATOM 428 OD2 ASP A 30 -6.685 -17.245 -5.809 1.00 0.00 O ATOM 0 H ASP A 30 -8.758 -12.662 -7.363 1.00 0.00 H new ATOM 0 HA ASP A 30 -7.298 -14.240 -5.471 1.00 0.00 H new ATOM 0 HB2 ASP A 30 -8.996 -15.637 -7.329 1.00 0.00 H new ATOM 0 HB3 ASP A 30 -7.335 -15.878 -7.833 1.00 0.00 H new ATOM 433 N GLY A 31 -6.400 -12.316 -7.440 1.00 0.00 N ATOM 434 CA GLY A 31 -5.346 -11.678 -8.206 1.00 0.00 C ATOM 435 C GLY A 31 -5.885 -10.805 -9.323 1.00 0.00 C ATOM 436 O GLY A 31 -5.415 -10.876 -10.457 1.00 0.00 O ATOM 0 H GLY A 31 -7.059 -11.673 -7.001 1.00 0.00 H new ATOM 0 HA2 GLY A 31 -4.733 -11.072 -7.539 1.00 0.00 H new ATOM 0 HA3 GLY A 31 -4.695 -12.443 -8.629 1.00 0.00 H new ATOM 440 N ARG A 32 -6.875 -9.978 -9.000 1.00 0.00 N ATOM 441 CA ARG A 32 -7.478 -9.088 -9.985 1.00 0.00 C ATOM 442 C ARG A 32 -6.613 -7.848 -10.217 1.00 0.00 C ATOM 443 O ARG A 32 -6.929 -7.012 -11.065 1.00 0.00 O ATOM 444 CB ARG A 32 -8.878 -8.669 -9.535 1.00 0.00 C ATOM 445 CG ARG A 32 -9.876 -9.815 -9.508 1.00 0.00 C ATOM 446 CD ARG A 32 -11.309 -9.309 -9.568 1.00 0.00 C ATOM 447 NE ARG A 32 -11.852 -9.043 -8.238 1.00 0.00 N ATOM 448 CZ ARG A 32 -13.154 -8.991 -7.964 1.00 0.00 C ATOM 449 NH1 ARG A 32 -14.050 -9.180 -8.925 1.00 0.00 N ATOM 450 NH2 ARG A 32 -13.561 -8.747 -6.726 1.00 0.00 N ATOM 0 H ARG A 32 -7.276 -9.906 -8.065 1.00 0.00 H new ATOM 0 HA ARG A 32 -7.551 -9.633 -10.926 1.00 0.00 H new ATOM 0 HB2 ARG A 32 -8.814 -8.230 -8.539 1.00 0.00 H new ATOM 0 HB3 ARG A 32 -9.248 -7.891 -10.203 1.00 0.00 H new ATOM 0 HG2 ARG A 32 -9.689 -10.481 -10.350 1.00 0.00 H new ATOM 0 HG3 ARG A 32 -9.734 -10.401 -8.600 1.00 0.00 H new ATOM 0 HD2 ARG A 32 -11.347 -8.397 -10.164 1.00 0.00 H new ATOM 0 HD3 ARG A 32 -11.933 -10.046 -10.073 1.00 0.00 H new ATOM 0 HE ARG A 32 -11.195 -8.888 -7.474 1.00 0.00 H new ATOM 0 HH11 ARG A 32 -13.742 -9.366 -9.880 1.00 0.00 H new ATOM 0 HH12 ARG A 32 -15.046 -9.139 -8.709 1.00 0.00 H new ATOM 0 HH21 ARG A 32 -12.877 -8.599 -5.984 1.00 0.00 H new ATOM 0 HH22 ARG A 32 -14.558 -8.707 -6.516 1.00 0.00 H new ATOM 464 N SER A 33 -5.522 -7.732 -9.463 1.00 0.00 N ATOM 465 CA SER A 33 -4.619 -6.594 -9.595 1.00 0.00 C ATOM 466 C SER A 33 -5.348 -5.284 -9.311 1.00 0.00 C ATOM 467 O SER A 33 -6.549 -5.276 -9.042 1.00 0.00 O ATOM 468 CB SER A 33 -4.012 -6.559 -10.998 1.00 0.00 C ATOM 469 OG SER A 33 -3.440 -7.810 -11.340 1.00 0.00 O ATOM 0 H SER A 33 -5.243 -8.412 -8.756 1.00 0.00 H new ATOM 0 HA SER A 33 -3.820 -6.710 -8.863 1.00 0.00 H new ATOM 0 HB2 SER A 33 -4.782 -6.298 -11.724 1.00 0.00 H new ATOM 0 HB3 SER A 33 -3.250 -5.782 -11.048 1.00 0.00 H new ATOM 0 HG SER A 33 -3.061 -7.761 -12.242 1.00 0.00 H new ATOM 475 N LEU A 34 -4.612 -4.180 -9.373 1.00 0.00 N ATOM 476 CA LEU A 34 -5.186 -2.863 -9.121 1.00 0.00 C ATOM 477 C LEU A 34 -5.189 -2.020 -10.393 1.00 0.00 C ATOM 478 O LEU A 34 -6.215 -1.454 -10.772 1.00 0.00 O ATOM 479 CB LEU A 34 -4.403 -2.144 -8.022 1.00 0.00 C ATOM 480 CG LEU A 34 -4.217 -2.943 -6.732 1.00 0.00 C ATOM 481 CD1 LEU A 34 -2.853 -2.664 -6.120 1.00 0.00 C ATOM 482 CD2 LEU A 34 -5.325 -2.618 -5.740 1.00 0.00 C ATOM 0 H LEU A 34 -3.617 -4.171 -9.596 1.00 0.00 H new ATOM 0 HA LEU A 34 -6.216 -3.000 -8.793 1.00 0.00 H new ATOM 0 HB2 LEU A 34 -3.420 -1.878 -8.412 1.00 0.00 H new ATOM 0 HB3 LEU A 34 -4.914 -1.211 -7.783 1.00 0.00 H new ATOM 0 HG LEU A 34 -4.272 -4.004 -6.975 1.00 0.00 H new ATOM 0 HD11 LEU A 34 -2.741 -3.242 -5.203 1.00 0.00 H new ATOM 0 HD12 LEU A 34 -2.073 -2.948 -6.826 1.00 0.00 H new ATOM 0 HD13 LEU A 34 -2.767 -1.602 -5.892 1.00 0.00 H new ATOM 0 HD21 LEU A 34 -5.177 -3.195 -4.827 1.00 0.00 H new ATOM 0 HD22 LEU A 34 -5.302 -1.554 -5.504 1.00 0.00 H new ATOM 0 HD23 LEU A 34 -6.291 -2.871 -6.177 1.00 0.00 H new ATOM 494 N GLY A 35 -4.035 -1.942 -11.048 1.00 0.00 N ATOM 495 CA GLY A 35 -3.926 -1.166 -12.269 1.00 0.00 C ATOM 496 C GLY A 35 -3.453 0.251 -12.014 1.00 0.00 C ATOM 497 O GLY A 35 -4.055 1.210 -12.496 1.00 0.00 O ATOM 0 H GLY A 35 -3.173 -2.403 -10.755 1.00 0.00 H new ATOM 0 HA2 GLY A 35 -3.233 -1.660 -12.950 1.00 0.00 H new ATOM 0 HA3 GLY A 35 -4.896 -1.138 -12.766 1.00 0.00 H new ATOM 501 N LEU A 36 -2.371 0.383 -11.253 1.00 0.00 N ATOM 502 CA LEU A 36 -1.817 1.694 -10.935 1.00 0.00 C ATOM 503 C LEU A 36 -0.303 1.703 -11.113 1.00 0.00 C ATOM 504 O LEU A 36 0.395 0.810 -10.630 1.00 0.00 O ATOM 505 CB LEU A 36 -2.176 2.087 -9.501 1.00 0.00 C ATOM 506 CG LEU A 36 -3.638 1.858 -9.113 1.00 0.00 C ATOM 507 CD1 LEU A 36 -3.745 1.440 -7.654 1.00 0.00 C ATOM 508 CD2 LEU A 36 -4.460 3.111 -9.372 1.00 0.00 C ATOM 0 H LEU A 36 -1.861 -0.401 -10.846 1.00 0.00 H new ATOM 0 HA LEU A 36 -2.249 2.420 -11.623 1.00 0.00 H new ATOM 0 HB2 LEU A 36 -1.542 1.523 -8.817 1.00 0.00 H new ATOM 0 HB3 LEU A 36 -1.939 3.142 -9.360 1.00 0.00 H new ATOM 0 HG LEU A 36 -4.036 1.052 -9.730 1.00 0.00 H new ATOM 0 HD11 LEU A 36 -4.792 1.282 -7.397 1.00 0.00 H new ATOM 0 HD12 LEU A 36 -3.189 0.515 -7.499 1.00 0.00 H new ATOM 0 HD13 LEU A 36 -3.330 2.223 -7.020 1.00 0.00 H new ATOM 0 HD21 LEU A 36 -5.497 2.930 -9.090 1.00 0.00 H new ATOM 0 HD22 LEU A 36 -4.062 3.936 -8.781 1.00 0.00 H new ATOM 0 HD23 LEU A 36 -4.411 3.366 -10.431 1.00 0.00 H new ATOM 520 N THR A 37 0.201 2.718 -11.808 1.00 0.00 N ATOM 521 CA THR A 37 1.633 2.843 -12.049 1.00 0.00 C ATOM 522 C THR A 37 2.276 3.774 -11.027 1.00 0.00 C ATOM 523 O THR A 37 2.381 4.980 -11.248 1.00 0.00 O ATOM 524 CB THR A 37 1.889 3.366 -13.464 1.00 0.00 C ATOM 525 OG1 THR A 37 1.192 2.588 -14.420 1.00 0.00 O ATOM 526 CG2 THR A 37 3.354 3.360 -13.847 1.00 0.00 C ATOM 0 H THR A 37 -0.362 3.466 -12.214 1.00 0.00 H new ATOM 0 HA THR A 37 2.082 1.855 -11.947 1.00 0.00 H new ATOM 0 HB THR A 37 1.534 4.397 -13.460 1.00 0.00 H new ATOM 0 HG1 THR A 37 1.367 2.939 -15.318 1.00 0.00 H new ATOM 0 HG21 THR A 37 3.466 3.742 -14.861 1.00 0.00 H new ATOM 0 HG22 THR A 37 3.913 3.992 -13.157 1.00 0.00 H new ATOM 0 HG23 THR A 37 3.739 2.341 -13.799 1.00 0.00 H new ATOM 534 N ILE A 38 2.707 3.205 -9.905 1.00 0.00 N ATOM 535 CA ILE A 38 3.339 3.984 -8.848 1.00 0.00 C ATOM 536 C ILE A 38 4.739 4.432 -9.256 1.00 0.00 C ATOM 537 O ILE A 38 5.283 3.966 -10.257 1.00 0.00 O ATOM 538 CB ILE A 38 3.434 3.180 -7.536 1.00 0.00 C ATOM 539 CG1 ILE A 38 4.219 1.887 -7.760 1.00 0.00 C ATOM 540 CG2 ILE A 38 2.042 2.877 -7.001 1.00 0.00 C ATOM 541 CD1 ILE A 38 4.986 1.427 -6.539 1.00 0.00 C ATOM 0 H ILE A 38 2.630 2.208 -9.705 1.00 0.00 H new ATOM 0 HA ILE A 38 2.712 4.860 -8.685 1.00 0.00 H new ATOM 0 HB ILE A 38 3.964 3.779 -6.796 1.00 0.00 H new ATOM 0 HG12 ILE A 38 3.528 1.100 -8.063 1.00 0.00 H new ATOM 0 HG13 ILE A 38 4.917 2.033 -8.584 1.00 0.00 H new ATOM 0 HG21 ILE A 38 2.124 2.309 -6.074 1.00 0.00 H new ATOM 0 HG22 ILE A 38 1.515 3.811 -6.808 1.00 0.00 H new ATOM 0 HG23 ILE A 38 1.489 2.293 -7.737 1.00 0.00 H new ATOM 0 HD11 ILE A 38 5.519 0.505 -6.770 1.00 0.00 H new ATOM 0 HD12 ILE A 38 5.701 2.196 -6.247 1.00 0.00 H new ATOM 0 HD13 ILE A 38 4.291 1.248 -5.719 1.00 0.00 H new ATOM 553 N ARG A 39 5.314 5.341 -8.476 1.00 0.00 N ATOM 554 CA ARG A 39 6.649 5.853 -8.757 1.00 0.00 C ATOM 555 C ARG A 39 7.441 6.043 -7.467 1.00 0.00 C ATOM 556 O ARG A 39 6.888 5.967 -6.370 1.00 0.00 O ATOM 557 CB ARG A 39 6.561 7.180 -9.514 1.00 0.00 C ATOM 558 CG ARG A 39 5.751 7.094 -10.796 1.00 0.00 C ATOM 559 CD ARG A 39 6.490 6.313 -11.871 1.00 0.00 C ATOM 560 NE ARG A 39 5.815 6.389 -13.165 1.00 0.00 N ATOM 561 CZ ARG A 39 6.039 5.543 -14.167 1.00 0.00 C ATOM 562 NH1 ARG A 39 6.915 4.555 -14.029 1.00 0.00 N ATOM 563 NH2 ARG A 39 5.383 5.682 -15.312 1.00 0.00 N ATOM 0 H ARG A 39 4.876 5.738 -7.645 1.00 0.00 H new ATOM 0 HA ARG A 39 7.168 5.122 -9.378 1.00 0.00 H new ATOM 0 HB2 ARG A 39 6.116 7.932 -8.862 1.00 0.00 H new ATOM 0 HB3 ARG A 39 7.569 7.521 -9.752 1.00 0.00 H new ATOM 0 HG2 ARG A 39 4.793 6.616 -10.591 1.00 0.00 H new ATOM 0 HG3 ARG A 39 5.534 8.099 -11.159 1.00 0.00 H new ATOM 0 HD2 ARG A 39 7.504 6.700 -11.968 1.00 0.00 H new ATOM 0 HD3 ARG A 39 6.575 5.270 -11.567 1.00 0.00 H new ATOM 0 HE ARG A 39 5.133 7.134 -13.308 1.00 0.00 H new ATOM 0 HH11 ARG A 39 7.421 4.441 -13.151 1.00 0.00 H new ATOM 0 HH12 ARG A 39 7.082 3.910 -14.801 1.00 0.00 H new ATOM 0 HH21 ARG A 39 4.707 6.438 -15.424 1.00 0.00 H new ATOM 0 HH22 ARG A 39 5.555 5.033 -16.080 1.00 0.00 H new ATOM 577 N GLY A 40 8.740 6.292 -7.607 1.00 0.00 N ATOM 578 CA GLY A 40 9.586 6.489 -6.444 1.00 0.00 C ATOM 579 C GLY A 40 9.786 5.215 -5.649 1.00 0.00 C ATOM 580 O GLY A 40 9.070 4.232 -5.846 1.00 0.00 O ATOM 0 H GLY A 40 9.221 6.361 -8.504 1.00 0.00 H new ATOM 0 HA2 GLY A 40 10.556 6.869 -6.765 1.00 0.00 H new ATOM 0 HA3 GLY A 40 9.142 7.249 -5.801 1.00 0.00 H new ATOM 584 N GLY A 41 10.762 5.229 -4.746 1.00 0.00 N ATOM 585 CA GLY A 41 11.036 4.061 -3.932 1.00 0.00 C ATOM 586 C GLY A 41 12.193 4.280 -2.975 1.00 0.00 C ATOM 587 O GLY A 41 12.647 5.409 -2.788 1.00 0.00 O ATOM 0 H GLY A 41 11.368 6.029 -4.564 1.00 0.00 H new ATOM 0 HA2 GLY A 41 10.143 3.800 -3.364 1.00 0.00 H new ATOM 0 HA3 GLY A 41 11.260 3.214 -4.581 1.00 0.00 H new ATOM 591 N ALA A 42 12.669 3.198 -2.368 1.00 0.00 N ATOM 592 CA ALA A 42 13.779 3.278 -1.426 1.00 0.00 C ATOM 593 C ALA A 42 15.107 3.443 -2.156 1.00 0.00 C ATOM 594 O ALA A 42 15.999 4.153 -1.690 1.00 0.00 O ATOM 595 CB ALA A 42 13.810 2.039 -0.542 1.00 0.00 C ATOM 0 H ALA A 42 12.304 2.256 -2.511 1.00 0.00 H new ATOM 0 HA ALA A 42 13.629 4.156 -0.798 1.00 0.00 H new ATOM 0 HB1 ALA A 42 14.643 2.111 0.157 1.00 0.00 H new ATOM 0 HB2 ALA A 42 12.875 1.965 0.014 1.00 0.00 H new ATOM 0 HB3 ALA A 42 13.933 1.152 -1.163 1.00 0.00 H new ATOM 601 N GLU A 43 15.233 2.784 -3.303 1.00 0.00 N ATOM 602 CA GLU A 43 16.454 2.859 -4.098 1.00 0.00 C ATOM 603 C GLU A 43 16.742 4.296 -4.517 1.00 0.00 C ATOM 604 O GLU A 43 17.843 4.806 -4.309 1.00 0.00 O ATOM 605 CB GLU A 43 16.337 1.967 -5.336 1.00 0.00 C ATOM 606 CG GLU A 43 17.645 1.303 -5.734 1.00 0.00 C ATOM 607 CD GLU A 43 17.561 0.609 -7.079 1.00 0.00 C ATOM 608 OE1 GLU A 43 16.848 -0.412 -7.177 1.00 0.00 O ATOM 609 OE2 GLU A 43 18.210 1.085 -8.034 1.00 0.00 O ATOM 0 H GLU A 43 14.505 2.192 -3.703 1.00 0.00 H new ATOM 0 HA GLU A 43 17.282 2.507 -3.482 1.00 0.00 H new ATOM 0 HB2 GLU A 43 15.590 1.196 -5.148 1.00 0.00 H new ATOM 0 HB3 GLU A 43 15.974 2.565 -6.172 1.00 0.00 H new ATOM 0 HG2 GLU A 43 18.434 2.054 -5.765 1.00 0.00 H new ATOM 0 HG3 GLU A 43 17.926 0.577 -4.971 1.00 0.00 H new ATOM 616 N TYR A 44 15.745 4.945 -5.110 1.00 0.00 N ATOM 617 CA TYR A 44 15.891 6.325 -5.558 1.00 0.00 C ATOM 618 C TYR A 44 15.822 7.291 -4.380 1.00 0.00 C ATOM 619 O TYR A 44 16.425 8.364 -4.408 1.00 0.00 O ATOM 620 CB TYR A 44 14.806 6.669 -6.579 1.00 0.00 C ATOM 621 CG TYR A 44 14.884 5.848 -7.847 1.00 0.00 C ATOM 622 CD1 TYR A 44 15.645 6.275 -8.928 1.00 0.00 C ATOM 623 CD2 TYR A 44 14.195 4.647 -7.961 1.00 0.00 C ATOM 624 CE1 TYR A 44 15.718 5.528 -10.088 1.00 0.00 C ATOM 625 CE2 TYR A 44 14.264 3.893 -9.118 1.00 0.00 C ATOM 626 CZ TYR A 44 15.027 4.338 -10.178 1.00 0.00 C ATOM 627 OH TYR A 44 15.097 3.591 -11.331 1.00 0.00 O ATOM 0 H TYR A 44 14.828 4.537 -5.291 1.00 0.00 H new ATOM 0 HA TYR A 44 16.869 6.426 -6.029 1.00 0.00 H new ATOM 0 HB2 TYR A 44 13.828 6.522 -6.121 1.00 0.00 H new ATOM 0 HB3 TYR A 44 14.882 7.726 -6.835 1.00 0.00 H new ATOM 0 HD1 TYR A 44 16.188 7.206 -8.861 1.00 0.00 H new ATOM 0 HD2 TYR A 44 13.596 4.297 -7.133 1.00 0.00 H new ATOM 0 HE1 TYR A 44 16.313 5.874 -10.920 1.00 0.00 H new ATOM 0 HE2 TYR A 44 13.724 2.961 -9.192 1.00 0.00 H new ATOM 0 HH TYR A 44 14.554 2.782 -11.230 1.00 0.00 H new ATOM 637 N GLY A 45 15.082 6.904 -3.346 1.00 0.00 N ATOM 638 CA GLY A 45 14.947 7.748 -2.174 1.00 0.00 C ATOM 639 C GLY A 45 13.706 8.616 -2.225 1.00 0.00 C ATOM 640 O GLY A 45 13.684 9.714 -1.670 1.00 0.00 O ATOM 0 H GLY A 45 14.574 6.021 -3.299 1.00 0.00 H new ATOM 0 HA2 GLY A 45 14.913 7.123 -1.282 1.00 0.00 H new ATOM 0 HA3 GLY A 45 15.828 8.384 -2.084 1.00 0.00 H new ATOM 644 N LEU A 46 12.670 8.123 -2.896 1.00 0.00 N ATOM 645 CA LEU A 46 11.418 8.860 -3.020 1.00 0.00 C ATOM 646 C LEU A 46 10.250 8.048 -2.471 1.00 0.00 C ATOM 647 O LEU A 46 10.330 6.825 -2.359 1.00 0.00 O ATOM 648 CB LEU A 46 11.159 9.220 -4.485 1.00 0.00 C ATOM 649 CG LEU A 46 9.942 10.112 -4.726 1.00 0.00 C ATOM 650 CD1 LEU A 46 10.130 11.466 -4.059 1.00 0.00 C ATOM 651 CD2 LEU A 46 9.692 10.280 -6.217 1.00 0.00 C ATOM 0 H LEU A 46 12.673 7.216 -3.362 1.00 0.00 H new ATOM 0 HA LEU A 46 11.505 9.776 -2.436 1.00 0.00 H new ATOM 0 HB2 LEU A 46 12.042 9.721 -4.882 1.00 0.00 H new ATOM 0 HB3 LEU A 46 11.033 8.298 -5.053 1.00 0.00 H new ATOM 0 HG LEU A 46 9.070 9.631 -4.283 1.00 0.00 H new ATOM 0 HD11 LEU A 46 9.253 12.087 -4.242 1.00 0.00 H new ATOM 0 HD12 LEU A 46 10.259 11.328 -2.986 1.00 0.00 H new ATOM 0 HD13 LEU A 46 11.013 11.955 -4.471 1.00 0.00 H new ATOM 0 HD21 LEU A 46 8.822 10.918 -6.370 1.00 0.00 H new ATOM 0 HD22 LEU A 46 10.564 10.738 -6.683 1.00 0.00 H new ATOM 0 HD23 LEU A 46 9.510 9.304 -6.668 1.00 0.00 H new ATOM 663 N GLY A 47 9.165 8.736 -2.130 1.00 0.00 N ATOM 664 CA GLY A 47 7.997 8.062 -1.596 1.00 0.00 C ATOM 665 C GLY A 47 7.337 7.153 -2.614 1.00 0.00 C ATOM 666 O GLY A 47 8.004 6.595 -3.484 1.00 0.00 O ATOM 0 H GLY A 47 9.074 9.748 -2.214 1.00 0.00 H new ATOM 0 HA2 GLY A 47 8.286 7.476 -0.724 1.00 0.00 H new ATOM 0 HA3 GLY A 47 7.276 8.805 -1.256 1.00 0.00 H new ATOM 670 N ILE A 48 6.020 7.002 -2.503 1.00 0.00 N ATOM 671 CA ILE A 48 5.269 6.154 -3.420 1.00 0.00 C ATOM 672 C ILE A 48 4.059 6.892 -3.985 1.00 0.00 C ATOM 673 O ILE A 48 2.985 6.892 -3.384 1.00 0.00 O ATOM 674 CB ILE A 48 4.791 4.863 -2.729 1.00 0.00 C ATOM 675 CG1 ILE A 48 5.950 4.200 -1.982 1.00 0.00 C ATOM 676 CG2 ILE A 48 4.193 3.905 -3.748 1.00 0.00 C ATOM 677 CD1 ILE A 48 7.062 3.725 -2.891 1.00 0.00 C ATOM 0 H ILE A 48 5.452 7.456 -1.787 1.00 0.00 H new ATOM 0 HA ILE A 48 5.945 5.892 -4.234 1.00 0.00 H new ATOM 0 HB ILE A 48 4.017 5.121 -2.006 1.00 0.00 H new ATOM 0 HG12 ILE A 48 6.359 4.908 -1.261 1.00 0.00 H new ATOM 0 HG13 ILE A 48 5.568 3.351 -1.415 1.00 0.00 H new ATOM 0 HG21 ILE A 48 3.860 2.998 -3.243 1.00 0.00 H new ATOM 0 HG22 ILE A 48 3.343 4.380 -4.239 1.00 0.00 H new ATOM 0 HG23 ILE A 48 4.946 3.650 -4.493 1.00 0.00 H new ATOM 0 HD11 ILE A 48 7.849 3.266 -2.293 1.00 0.00 H new ATOM 0 HD12 ILE A 48 6.668 2.993 -3.596 1.00 0.00 H new ATOM 0 HD13 ILE A 48 7.471 4.573 -3.439 1.00 0.00 H new ATOM 689 N TYR A 49 4.242 7.520 -5.142 1.00 0.00 N ATOM 690 CA TYR A 49 3.166 8.261 -5.787 1.00 0.00 C ATOM 691 C TYR A 49 2.391 7.369 -6.751 1.00 0.00 C ATOM 692 O TYR A 49 2.665 6.174 -6.862 1.00 0.00 O ATOM 693 CB TYR A 49 3.728 9.472 -6.534 1.00 0.00 C ATOM 694 CG TYR A 49 4.377 10.495 -5.627 1.00 0.00 C ATOM 695 CD1 TYR A 49 3.609 11.419 -4.931 1.00 0.00 C ATOM 696 CD2 TYR A 49 5.756 10.535 -5.469 1.00 0.00 C ATOM 697 CE1 TYR A 49 4.198 12.355 -4.101 1.00 0.00 C ATOM 698 CE2 TYR A 49 6.352 11.467 -4.641 1.00 0.00 C ATOM 699 CZ TYR A 49 5.569 12.374 -3.959 1.00 0.00 C ATOM 700 OH TYR A 49 6.159 13.304 -3.134 1.00 0.00 O ATOM 0 H TYR A 49 5.126 7.530 -5.651 1.00 0.00 H new ATOM 0 HA TYR A 49 2.482 8.606 -5.012 1.00 0.00 H new ATOM 0 HB2 TYR A 49 4.461 9.130 -7.265 1.00 0.00 H new ATOM 0 HB3 TYR A 49 2.923 9.951 -7.091 1.00 0.00 H new ATOM 0 HD1 TYR A 49 2.535 11.406 -5.040 1.00 0.00 H new ATOM 0 HD2 TYR A 49 6.373 9.826 -6.002 1.00 0.00 H new ATOM 0 HE1 TYR A 49 3.587 13.068 -3.567 1.00 0.00 H new ATOM 0 HE2 TYR A 49 7.426 11.485 -4.529 1.00 0.00 H new ATOM 0 HH TYR A 49 7.131 13.181 -3.145 1.00 0.00 H new ATOM 710 N ILE A 50 1.424 7.956 -7.448 1.00 0.00 N ATOM 711 CA ILE A 50 0.610 7.215 -8.403 1.00 0.00 C ATOM 712 C ILE A 50 0.501 7.961 -9.728 1.00 0.00 C ATOM 713 O ILE A 50 0.002 9.085 -9.780 1.00 0.00 O ATOM 714 CB ILE A 50 -0.807 6.958 -7.854 1.00 0.00 C ATOM 715 CG1 ILE A 50 -0.733 6.392 -6.435 1.00 0.00 C ATOM 716 CG2 ILE A 50 -1.567 6.011 -8.770 1.00 0.00 C ATOM 717 CD1 ILE A 50 -2.088 6.204 -5.788 1.00 0.00 C ATOM 0 H ILE A 50 1.185 8.944 -7.369 1.00 0.00 H new ATOM 0 HA ILE A 50 1.107 6.259 -8.567 1.00 0.00 H new ATOM 0 HB ILE A 50 -1.344 7.906 -7.819 1.00 0.00 H new ATOM 0 HG12 ILE A 50 -0.216 5.433 -6.462 1.00 0.00 H new ATOM 0 HG13 ILE A 50 -0.134 7.060 -5.817 1.00 0.00 H new ATOM 0 HG21 ILE A 50 -2.566 5.840 -8.368 1.00 0.00 H new ATOM 0 HG22 ILE A 50 -1.646 6.452 -9.764 1.00 0.00 H new ATOM 0 HG23 ILE A 50 -1.034 5.062 -8.835 1.00 0.00 H new ATOM 0 HD11 ILE A 50 -1.959 5.800 -4.784 1.00 0.00 H new ATOM 0 HD12 ILE A 50 -2.600 7.165 -5.729 1.00 0.00 H new ATOM 0 HD13 ILE A 50 -2.683 5.512 -6.384 1.00 0.00 H new ATOM 729 N THR A 51 0.974 7.330 -10.798 1.00 0.00 N ATOM 730 CA THR A 51 0.930 7.935 -12.124 1.00 0.00 C ATOM 731 C THR A 51 0.410 6.942 -13.159 1.00 0.00 C ATOM 732 O THR A 51 0.982 6.796 -14.238 1.00 0.00 O ATOM 733 CB THR A 51 2.320 8.430 -12.526 1.00 0.00 C ATOM 734 OG1 THR A 51 3.156 7.344 -12.883 1.00 0.00 O ATOM 735 CG2 THR A 51 3.020 9.207 -11.432 1.00 0.00 C ATOM 0 H THR A 51 1.392 6.400 -10.773 1.00 0.00 H new ATOM 0 HA THR A 51 0.246 8.783 -12.088 1.00 0.00 H new ATOM 0 HB THR A 51 2.154 9.096 -13.373 1.00 0.00 H new ATOM 0 HG1 THR A 51 2.837 6.948 -13.721 1.00 0.00 H new ATOM 0 HG21 THR A 51 4.000 9.528 -11.784 1.00 0.00 H new ATOM 0 HG22 THR A 51 2.425 10.081 -11.169 1.00 0.00 H new ATOM 0 HG23 THR A 51 3.140 8.572 -10.554 1.00 0.00 H new ATOM 743 N GLY A 52 -0.680 6.261 -12.821 1.00 0.00 N ATOM 744 CA GLY A 52 -1.259 5.290 -13.732 1.00 0.00 C ATOM 745 C GLY A 52 -2.589 4.751 -13.241 1.00 0.00 C ATOM 746 O GLY A 52 -2.779 4.551 -12.040 1.00 0.00 O ATOM 0 H GLY A 52 -1.172 6.364 -11.934 1.00 0.00 H new ATOM 0 HA2 GLY A 52 -1.397 5.752 -14.710 1.00 0.00 H new ATOM 0 HA3 GLY A 52 -0.563 4.462 -13.866 1.00 0.00 H new ATOM 750 N VAL A 53 -3.510 4.517 -14.169 1.00 0.00 N ATOM 751 CA VAL A 53 -4.828 3.998 -13.826 1.00 0.00 C ATOM 752 C VAL A 53 -5.424 3.203 -14.982 1.00 0.00 C ATOM 753 O VAL A 53 -5.603 3.728 -16.082 1.00 0.00 O ATOM 754 CB VAL A 53 -5.798 5.133 -13.446 1.00 0.00 C ATOM 755 CG1 VAL A 53 -7.102 4.564 -12.908 1.00 0.00 C ATOM 756 CG2 VAL A 53 -5.155 6.068 -12.432 1.00 0.00 C ATOM 0 H VAL A 53 -3.368 4.679 -15.166 1.00 0.00 H new ATOM 0 HA VAL A 53 -4.694 3.341 -12.967 1.00 0.00 H new ATOM 0 HB VAL A 53 -6.024 5.709 -14.343 1.00 0.00 H new ATOM 0 HG11 VAL A 53 -7.774 5.381 -12.645 1.00 0.00 H new ATOM 0 HG12 VAL A 53 -7.569 3.941 -13.671 1.00 0.00 H new ATOM 0 HG13 VAL A 53 -6.898 3.962 -12.022 1.00 0.00 H new ATOM 0 HG21 VAL A 53 -5.855 6.863 -12.176 1.00 0.00 H new ATOM 0 HG22 VAL A 53 -4.897 5.508 -11.533 1.00 0.00 H new ATOM 0 HG23 VAL A 53 -4.252 6.503 -12.860 1.00 0.00 H new ATOM 766 N ASP A 54 -5.727 1.934 -14.729 1.00 0.00 N ATOM 767 CA ASP A 54 -6.303 1.067 -15.750 1.00 0.00 C ATOM 768 C ASP A 54 -7.785 1.376 -15.955 1.00 0.00 C ATOM 769 O ASP A 54 -8.490 1.727 -15.009 1.00 0.00 O ATOM 770 CB ASP A 54 -6.125 -0.401 -15.361 1.00 0.00 C ATOM 771 CG ASP A 54 -4.837 -0.991 -15.903 1.00 0.00 C ATOM 772 OD1 ASP A 54 -3.825 -0.262 -15.952 1.00 0.00 O ATOM 773 OD2 ASP A 54 -4.842 -2.181 -16.280 1.00 0.00 O ATOM 0 H ASP A 54 -5.583 1.483 -13.825 1.00 0.00 H new ATOM 0 HA ASP A 54 -5.779 1.253 -16.687 1.00 0.00 H new ATOM 0 HB2 ASP A 54 -6.133 -0.490 -14.275 1.00 0.00 H new ATOM 0 HB3 ASP A 54 -6.971 -0.978 -15.734 1.00 0.00 H new ATOM 778 N PRO A 55 -8.278 1.249 -17.199 1.00 0.00 N ATOM 779 CA PRO A 55 -9.682 1.517 -17.521 1.00 0.00 C ATOM 780 C PRO A 55 -10.614 0.425 -17.007 1.00 0.00 C ATOM 781 O PRO A 55 -10.611 -0.697 -17.515 1.00 0.00 O ATOM 782 CB PRO A 55 -9.692 1.552 -19.050 1.00 0.00 C ATOM 783 CG PRO A 55 -8.559 0.674 -19.452 1.00 0.00 C ATOM 784 CD PRO A 55 -7.507 0.836 -18.388 1.00 0.00 C ATOM 0 HA PRO A 55 -10.039 2.436 -17.056 1.00 0.00 H new ATOM 0 HB2 PRO A 55 -10.638 1.186 -19.449 1.00 0.00 H new ATOM 0 HB3 PRO A 55 -9.559 2.567 -19.424 1.00 0.00 H new ATOM 0 HG2 PRO A 55 -8.879 -0.365 -19.528 1.00 0.00 H new ATOM 0 HG3 PRO A 55 -8.172 0.961 -20.430 1.00 0.00 H new ATOM 0 HD2 PRO A 55 -6.967 -0.095 -18.213 1.00 0.00 H new ATOM 0 HD3 PRO A 55 -6.767 1.586 -18.667 1.00 0.00 H new ATOM 792 N GLY A 56 -11.409 0.758 -15.997 1.00 0.00 N ATOM 793 CA GLY A 56 -12.335 -0.206 -15.431 1.00 0.00 C ATOM 794 C GLY A 56 -11.653 -1.185 -14.496 1.00 0.00 C ATOM 795 O GLY A 56 -12.029 -2.355 -14.431 1.00 0.00 O ATOM 0 H GLY A 56 -11.429 1.679 -15.559 1.00 0.00 H new ATOM 0 HA2 GLY A 56 -13.119 0.323 -14.889 1.00 0.00 H new ATOM 0 HA3 GLY A 56 -12.820 -0.756 -16.237 1.00 0.00 H new ATOM 799 N SER A 57 -10.648 -0.707 -13.770 1.00 0.00 N ATOM 800 CA SER A 57 -9.913 -1.549 -12.833 1.00 0.00 C ATOM 801 C SER A 57 -10.492 -1.432 -11.427 1.00 0.00 C ATOM 802 O SER A 57 -11.381 -0.620 -11.177 1.00 0.00 O ATOM 803 CB SER A 57 -8.432 -1.163 -12.822 1.00 0.00 C ATOM 804 OG SER A 57 -8.248 0.134 -12.280 1.00 0.00 O ATOM 0 H SER A 57 -10.324 0.259 -13.812 1.00 0.00 H new ATOM 0 HA SER A 57 -10.009 -2.584 -13.160 1.00 0.00 H new ATOM 0 HB2 SER A 57 -7.868 -1.889 -12.236 1.00 0.00 H new ATOM 0 HB3 SER A 57 -8.037 -1.196 -13.837 1.00 0.00 H new ATOM 0 HG SER A 57 -7.539 0.108 -11.604 1.00 0.00 H new ATOM 810 N GLU A 58 -9.981 -2.251 -10.513 1.00 0.00 N ATOM 811 CA GLU A 58 -10.448 -2.240 -9.132 1.00 0.00 C ATOM 812 C GLU A 58 -10.138 -0.905 -8.464 1.00 0.00 C ATOM 813 O GLU A 58 -10.935 -0.390 -7.680 1.00 0.00 O ATOM 814 CB GLU A 58 -9.802 -3.381 -8.343 1.00 0.00 C ATOM 815 CG GLU A 58 -10.439 -4.736 -8.603 1.00 0.00 C ATOM 816 CD GLU A 58 -11.939 -4.728 -8.377 1.00 0.00 C ATOM 817 OE1 GLU A 58 -12.372 -4.316 -7.280 1.00 0.00 O ATOM 818 OE2 GLU A 58 -12.679 -5.134 -9.297 1.00 0.00 O ATOM 0 H GLU A 58 -9.244 -2.930 -10.704 1.00 0.00 H new ATOM 0 HA GLU A 58 -11.529 -2.380 -9.139 1.00 0.00 H new ATOM 0 HB2 GLU A 58 -8.743 -3.432 -8.595 1.00 0.00 H new ATOM 0 HB3 GLU A 58 -9.866 -3.157 -7.278 1.00 0.00 H new ATOM 0 HG2 GLU A 58 -10.231 -5.040 -9.629 1.00 0.00 H new ATOM 0 HG3 GLU A 58 -9.981 -5.480 -7.951 1.00 0.00 H new ATOM 825 N ALA A 59 -8.973 -0.347 -8.779 1.00 0.00 N ATOM 826 CA ALA A 59 -8.556 0.928 -8.210 1.00 0.00 C ATOM 827 C ALA A 59 -9.321 2.087 -8.840 1.00 0.00 C ATOM 828 O ALA A 59 -9.578 3.100 -8.192 1.00 0.00 O ATOM 829 CB ALA A 59 -7.058 1.122 -8.390 1.00 0.00 C ATOM 0 H ALA A 59 -8.301 -0.759 -9.426 1.00 0.00 H new ATOM 0 HA ALA A 59 -8.784 0.913 -7.144 1.00 0.00 H new ATOM 0 HB1 ALA A 59 -6.761 2.079 -7.960 1.00 0.00 H new ATOM 0 HB2 ALA A 59 -6.524 0.316 -7.887 1.00 0.00 H new ATOM 0 HB3 ALA A 59 -6.815 1.110 -9.452 1.00 0.00 H new ATOM 835 N GLU A 60 -9.682 1.928 -10.109 1.00 0.00 N ATOM 836 CA GLU A 60 -10.418 2.961 -10.829 1.00 0.00 C ATOM 837 C GLU A 60 -11.839 3.095 -10.288 1.00 0.00 C ATOM 838 O GLU A 60 -12.407 4.187 -10.271 1.00 0.00 O ATOM 839 CB GLU A 60 -10.458 2.641 -12.324 1.00 0.00 C ATOM 840 CG GLU A 60 -11.153 3.707 -13.156 1.00 0.00 C ATOM 841 CD GLU A 60 -10.184 4.725 -13.726 1.00 0.00 C ATOM 842 OE1 GLU A 60 -9.406 4.361 -14.632 1.00 0.00 O ATOM 843 OE2 GLU A 60 -10.205 5.886 -13.266 1.00 0.00 O ATOM 0 H GLU A 60 -9.477 1.094 -10.660 1.00 0.00 H new ATOM 0 HA GLU A 60 -9.901 3.909 -10.681 1.00 0.00 H new ATOM 0 HB2 GLU A 60 -9.438 2.516 -12.688 1.00 0.00 H new ATOM 0 HB3 GLU A 60 -10.968 1.689 -12.470 1.00 0.00 H new ATOM 0 HG2 GLU A 60 -11.695 3.230 -13.972 1.00 0.00 H new ATOM 0 HG3 GLU A 60 -11.892 4.219 -12.540 1.00 0.00 H new ATOM 850 N GLY A 61 -12.406 1.977 -9.848 1.00 0.00 N ATOM 851 CA GLY A 61 -13.755 1.990 -9.313 1.00 0.00 C ATOM 852 C GLY A 61 -13.830 2.637 -7.944 1.00 0.00 C ATOM 853 O GLY A 61 -14.726 3.436 -7.675 1.00 0.00 O ATOM 0 H GLY A 61 -11.956 1.062 -9.852 1.00 0.00 H new ATOM 0 HA2 GLY A 61 -14.410 2.525 -10.001 1.00 0.00 H new ATOM 0 HA3 GLY A 61 -14.127 0.967 -9.249 1.00 0.00 H new ATOM 857 N SER A 62 -12.886 2.290 -7.075 1.00 0.00 N ATOM 858 CA SER A 62 -12.848 2.841 -5.726 1.00 0.00 C ATOM 859 C SER A 62 -12.693 4.358 -5.762 1.00 0.00 C ATOM 860 O SER A 62 -13.309 5.075 -4.972 1.00 0.00 O ATOM 861 CB SER A 62 -11.701 2.218 -4.929 1.00 0.00 C ATOM 862 OG SER A 62 -11.862 2.445 -3.539 1.00 0.00 O ATOM 0 H SER A 62 -12.137 1.629 -7.282 1.00 0.00 H new ATOM 0 HA SER A 62 -13.792 2.602 -5.237 1.00 0.00 H new ATOM 0 HB2 SER A 62 -11.660 1.146 -5.123 1.00 0.00 H new ATOM 0 HB3 SER A 62 -10.752 2.639 -5.262 1.00 0.00 H new ATOM 0 HG SER A 62 -11.923 1.586 -3.072 1.00 0.00 H new ATOM 868 N GLY A 63 -11.864 4.841 -6.683 1.00 0.00 N ATOM 869 CA GLY A 63 -11.643 6.269 -6.805 1.00 0.00 C ATOM 870 C GLY A 63 -10.177 6.641 -6.683 1.00 0.00 C ATOM 871 O GLY A 63 -9.834 7.641 -6.053 1.00 0.00 O ATOM 0 H GLY A 63 -11.342 4.268 -7.346 1.00 0.00 H new ATOM 0 HA2 GLY A 63 -12.023 6.612 -7.768 1.00 0.00 H new ATOM 0 HA3 GLY A 63 -12.212 6.789 -6.034 1.00 0.00 H new ATOM 875 N LEU A 64 -9.312 5.834 -7.287 1.00 0.00 N ATOM 876 CA LEU A 64 -7.876 6.082 -7.244 1.00 0.00 C ATOM 877 C LEU A 64 -7.381 6.643 -8.572 1.00 0.00 C ATOM 878 O LEU A 64 -7.327 5.933 -9.576 1.00 0.00 O ATOM 879 CB LEU A 64 -7.124 4.792 -6.908 1.00 0.00 C ATOM 880 CG LEU A 64 -7.008 4.480 -5.416 1.00 0.00 C ATOM 881 CD1 LEU A 64 -6.733 2.999 -5.202 1.00 0.00 C ATOM 882 CD2 LEU A 64 -5.915 5.324 -4.779 1.00 0.00 C ATOM 0 H LEU A 64 -9.580 5.002 -7.812 1.00 0.00 H new ATOM 0 HA LEU A 64 -7.683 6.820 -6.465 1.00 0.00 H new ATOM 0 HB2 LEU A 64 -7.626 3.959 -7.400 1.00 0.00 H new ATOM 0 HB3 LEU A 64 -6.121 4.854 -7.330 1.00 0.00 H new ATOM 0 HG LEU A 64 -7.955 4.727 -4.937 1.00 0.00 H new ATOM 0 HD11 LEU A 64 -6.653 2.794 -4.134 1.00 0.00 H new ATOM 0 HD12 LEU A 64 -7.549 2.413 -5.624 1.00 0.00 H new ATOM 0 HD13 LEU A 64 -5.799 2.728 -5.694 1.00 0.00 H new ATOM 0 HD21 LEU A 64 -5.846 5.089 -3.717 1.00 0.00 H new ATOM 0 HD22 LEU A 64 -4.961 5.108 -5.261 1.00 0.00 H new ATOM 0 HD23 LEU A 64 -6.153 6.381 -4.902 1.00 0.00 H new ATOM 894 N LYS A 65 -7.020 7.923 -8.571 1.00 0.00 N ATOM 895 CA LYS A 65 -6.529 8.580 -9.776 1.00 0.00 C ATOM 896 C LYS A 65 -5.056 8.949 -9.633 1.00 0.00 C ATOM 897 O LYS A 65 -4.456 8.755 -8.576 1.00 0.00 O ATOM 898 CB LYS A 65 -7.357 9.834 -10.072 1.00 0.00 C ATOM 899 CG LYS A 65 -8.301 9.673 -11.253 1.00 0.00 C ATOM 900 CD LYS A 65 -9.719 9.370 -10.797 1.00 0.00 C ATOM 901 CE LYS A 65 -10.746 9.898 -11.786 1.00 0.00 C ATOM 902 NZ LYS A 65 -12.137 9.758 -11.270 1.00 0.00 N ATOM 0 H LYS A 65 -7.059 8.525 -7.749 1.00 0.00 H new ATOM 0 HA LYS A 65 -6.630 7.883 -10.608 1.00 0.00 H new ATOM 0 HB2 LYS A 65 -7.937 10.094 -9.186 1.00 0.00 H new ATOM 0 HB3 LYS A 65 -6.682 10.667 -10.267 1.00 0.00 H new ATOM 0 HG2 LYS A 65 -8.297 10.585 -11.850 1.00 0.00 H new ATOM 0 HG3 LYS A 65 -7.945 8.869 -11.897 1.00 0.00 H new ATOM 0 HD2 LYS A 65 -9.843 8.293 -10.682 1.00 0.00 H new ATOM 0 HD3 LYS A 65 -9.891 9.817 -9.818 1.00 0.00 H new ATOM 0 HE2 LYS A 65 -10.541 10.948 -11.997 1.00 0.00 H new ATOM 0 HE3 LYS A 65 -10.653 9.359 -12.729 1.00 0.00 H new ATOM 0 HZ1 LYS A 65 -12.807 10.129 -11.973 1.00 0.00 H new ATOM 0 HZ2 LYS A 65 -12.342 8.754 -11.093 1.00 0.00 H new ATOM 0 HZ3 LYS A 65 -12.234 10.293 -10.383 1.00 0.00 H new ATOM 916 N VAL A 66 -4.478 9.484 -10.704 1.00 0.00 N ATOM 917 CA VAL A 66 -3.076 9.881 -10.699 1.00 0.00 C ATOM 918 C VAL A 66 -2.852 11.097 -9.806 1.00 0.00 C ATOM 919 O VAL A 66 -3.754 11.913 -9.615 1.00 0.00 O ATOM 920 CB VAL A 66 -2.576 10.202 -12.119 1.00 0.00 C ATOM 921 CG1 VAL A 66 -2.602 8.955 -12.990 1.00 0.00 C ATOM 922 CG2 VAL A 66 -3.410 11.313 -12.741 1.00 0.00 C ATOM 0 H VAL A 66 -4.960 9.652 -11.587 1.00 0.00 H new ATOM 0 HA VAL A 66 -2.511 9.036 -10.307 1.00 0.00 H new ATOM 0 HB VAL A 66 -1.545 10.548 -12.051 1.00 0.00 H new ATOM 0 HG11 VAL A 66 -2.245 9.202 -13.990 1.00 0.00 H new ATOM 0 HG12 VAL A 66 -1.958 8.192 -12.553 1.00 0.00 H new ATOM 0 HG13 VAL A 66 -3.622 8.576 -13.052 1.00 0.00 H new ATOM 0 HG21 VAL A 66 -3.042 11.526 -13.745 1.00 0.00 H new ATOM 0 HG22 VAL A 66 -4.452 10.998 -12.796 1.00 0.00 H new ATOM 0 HG23 VAL A 66 -3.334 12.211 -12.128 1.00 0.00 H new ATOM 932 N GLY A 67 -1.645 11.212 -9.263 1.00 0.00 N ATOM 933 CA GLY A 67 -1.325 12.331 -8.397 1.00 0.00 C ATOM 934 C GLY A 67 -1.604 12.036 -6.937 1.00 0.00 C ATOM 935 O GLY A 67 -1.866 12.946 -6.152 1.00 0.00 O ATOM 0 H GLY A 67 -0.882 10.550 -9.407 1.00 0.00 H new ATOM 0 HA2 GLY A 67 -0.273 12.589 -8.517 1.00 0.00 H new ATOM 0 HA3 GLY A 67 -1.904 13.201 -8.705 1.00 0.00 H new ATOM 939 N ASP A 68 -1.549 10.758 -6.572 1.00 0.00 N ATOM 940 CA ASP A 68 -1.798 10.346 -5.195 1.00 0.00 C ATOM 941 C ASP A 68 -0.520 9.830 -4.543 1.00 0.00 C ATOM 942 O ASP A 68 0.385 9.345 -5.223 1.00 0.00 O ATOM 943 CB ASP A 68 -2.880 9.264 -5.153 1.00 0.00 C ATOM 944 CG ASP A 68 -4.267 9.842 -4.961 1.00 0.00 C ATOM 945 OD1 ASP A 68 -4.899 10.219 -5.970 1.00 0.00 O ATOM 946 OD2 ASP A 68 -4.723 9.917 -3.800 1.00 0.00 O ATOM 0 H ASP A 68 -1.335 9.991 -7.210 1.00 0.00 H new ATOM 0 HA ASP A 68 -2.143 11.217 -4.637 1.00 0.00 H new ATOM 0 HB2 ASP A 68 -2.853 8.691 -6.080 1.00 0.00 H new ATOM 0 HB3 ASP A 68 -2.664 8.569 -4.342 1.00 0.00 H new ATOM 951 N GLN A 69 -0.451 9.940 -3.220 1.00 0.00 N ATOM 952 CA GLN A 69 0.718 9.485 -2.476 1.00 0.00 C ATOM 953 C GLN A 69 0.335 8.412 -1.463 1.00 0.00 C ATOM 954 O GLN A 69 -0.357 8.687 -0.483 1.00 0.00 O ATOM 955 CB GLN A 69 1.381 10.664 -1.760 1.00 0.00 C ATOM 956 CG GLN A 69 2.896 10.555 -1.683 1.00 0.00 C ATOM 957 CD GLN A 69 3.378 10.105 -0.318 1.00 0.00 C ATOM 958 OE1 GLN A 69 2.725 10.351 0.696 1.00 0.00 O ATOM 959 NE2 GLN A 69 4.528 9.442 -0.285 1.00 0.00 N ATOM 0 H GLN A 69 -1.190 10.340 -2.642 1.00 0.00 H new ATOM 0 HA GLN A 69 1.424 9.053 -3.185 1.00 0.00 H new ATOM 0 HB2 GLN A 69 1.117 11.587 -2.276 1.00 0.00 H new ATOM 0 HB3 GLN A 69 0.978 10.738 -0.750 1.00 0.00 H new ATOM 0 HG2 GLN A 69 3.245 9.851 -2.438 1.00 0.00 H new ATOM 0 HG3 GLN A 69 3.339 11.522 -1.920 1.00 0.00 H new ATOM 0 HE21 GLN A 69 5.037 9.260 -1.150 1.00 0.00 H new ATOM 0 HE22 GLN A 69 4.903 9.115 0.605 1.00 0.00 H new ATOM 968 N ILE A 70 0.790 7.187 -1.706 1.00 0.00 N ATOM 969 CA ILE A 70 0.496 6.071 -0.815 1.00 0.00 C ATOM 970 C ILE A 70 1.328 6.156 0.461 1.00 0.00 C ATOM 971 O ILE A 70 2.529 6.419 0.415 1.00 0.00 O ATOM 972 CB ILE A 70 0.765 4.717 -1.501 1.00 0.00 C ATOM 973 CG1 ILE A 70 0.074 4.663 -2.864 1.00 0.00 C ATOM 974 CG2 ILE A 70 0.293 3.572 -0.616 1.00 0.00 C ATOM 975 CD1 ILE A 70 0.729 3.706 -3.836 1.00 0.00 C ATOM 0 H ILE A 70 1.364 6.942 -2.513 1.00 0.00 H new ATOM 0 HA ILE A 70 -0.562 6.137 -0.563 1.00 0.00 H new ATOM 0 HB ILE A 70 1.839 4.613 -1.656 1.00 0.00 H new ATOM 0 HG12 ILE A 70 -0.966 4.370 -2.724 1.00 0.00 H new ATOM 0 HG13 ILE A 70 0.068 5.662 -3.299 1.00 0.00 H new ATOM 0 HG21 ILE A 70 0.490 2.622 -1.114 1.00 0.00 H new ATOM 0 HG22 ILE A 70 0.828 3.602 0.333 1.00 0.00 H new ATOM 0 HG23 ILE A 70 -0.777 3.671 -0.433 1.00 0.00 H new ATOM 0 HD11 ILE A 70 0.186 3.719 -4.781 1.00 0.00 H new ATOM 0 HD12 ILE A 70 1.762 4.010 -4.006 1.00 0.00 H new ATOM 0 HD13 ILE A 70 0.711 2.698 -3.422 1.00 0.00 H new ATOM 987 N LEU A 71 0.680 5.931 1.599 1.00 0.00 N ATOM 988 CA LEU A 71 1.359 5.982 2.889 1.00 0.00 C ATOM 989 C LEU A 71 1.655 4.577 3.404 1.00 0.00 C ATOM 990 O LEU A 71 2.787 4.267 3.776 1.00 0.00 O ATOM 991 CB LEU A 71 0.509 6.743 3.906 1.00 0.00 C ATOM 992 CG LEU A 71 0.092 8.151 3.478 1.00 0.00 C ATOM 993 CD1 LEU A 71 -1.107 8.621 4.288 1.00 0.00 C ATOM 994 CD2 LEU A 71 1.255 9.120 3.631 1.00 0.00 C ATOM 0 H LEU A 71 -0.315 5.712 1.654 1.00 0.00 H new ATOM 0 HA LEU A 71 2.305 6.506 2.753 1.00 0.00 H new ATOM 0 HB2 LEU A 71 -0.390 6.162 4.113 1.00 0.00 H new ATOM 0 HB3 LEU A 71 1.065 6.814 4.841 1.00 0.00 H new ATOM 0 HG LEU A 71 -0.195 8.122 2.427 1.00 0.00 H new ATOM 0 HD11 LEU A 71 -1.390 9.625 3.970 1.00 0.00 H new ATOM 0 HD12 LEU A 71 -1.943 7.940 4.128 1.00 0.00 H new ATOM 0 HD13 LEU A 71 -0.848 8.635 5.347 1.00 0.00 H new ATOM 0 HD21 LEU A 71 0.941 10.117 3.322 1.00 0.00 H new ATOM 0 HD22 LEU A 71 1.572 9.146 4.674 1.00 0.00 H new ATOM 0 HD23 LEU A 71 2.086 8.792 3.007 1.00 0.00 H new ATOM 1006 N GLU A 72 0.630 3.732 3.425 1.00 0.00 N ATOM 1007 CA GLU A 72 0.781 2.360 3.897 1.00 0.00 C ATOM 1008 C GLU A 72 -0.242 1.442 3.236 1.00 0.00 C ATOM 1009 O GLU A 72 -1.290 1.894 2.773 1.00 0.00 O ATOM 1010 CB GLU A 72 0.628 2.301 5.417 1.00 0.00 C ATOM 1011 CG GLU A 72 -0.748 2.721 5.907 1.00 0.00 C ATOM 1012 CD GLU A 72 -0.764 4.131 6.465 1.00 0.00 C ATOM 1013 OE1 GLU A 72 0.157 4.909 6.136 1.00 0.00 O ATOM 1014 OE2 GLU A 72 -1.696 4.457 7.228 1.00 0.00 O ATOM 0 H GLU A 72 -0.314 3.972 3.121 1.00 0.00 H new ATOM 0 HA GLU A 72 1.780 2.017 3.626 1.00 0.00 H new ATOM 0 HB2 GLU A 72 0.830 1.285 5.755 1.00 0.00 H new ATOM 0 HB3 GLU A 72 1.379 2.944 5.875 1.00 0.00 H new ATOM 0 HG2 GLU A 72 -1.459 2.652 5.084 1.00 0.00 H new ATOM 0 HG3 GLU A 72 -1.083 2.026 6.677 1.00 0.00 H new ATOM 1021 N VAL A 73 0.069 0.150 3.196 1.00 0.00 N ATOM 1022 CA VAL A 73 -0.823 -0.833 2.592 1.00 0.00 C ATOM 1023 C VAL A 73 -0.882 -2.107 3.427 1.00 0.00 C ATOM 1024 O VAL A 73 0.144 -2.732 3.698 1.00 0.00 O ATOM 1025 CB VAL A 73 -0.380 -1.191 1.162 1.00 0.00 C ATOM 1026 CG1 VAL A 73 -1.428 -2.055 0.477 1.00 0.00 C ATOM 1027 CG2 VAL A 73 -0.107 0.070 0.355 1.00 0.00 C ATOM 0 H VAL A 73 0.932 -0.240 3.575 1.00 0.00 H new ATOM 0 HA VAL A 73 -1.813 -0.379 2.554 1.00 0.00 H new ATOM 0 HB VAL A 73 0.546 -1.764 1.222 1.00 0.00 H new ATOM 0 HG11 VAL A 73 -1.096 -2.297 -0.533 1.00 0.00 H new ATOM 0 HG12 VAL A 73 -1.568 -2.975 1.044 1.00 0.00 H new ATOM 0 HG13 VAL A 73 -2.372 -1.512 0.428 1.00 0.00 H new ATOM 0 HG21 VAL A 73 0.205 -0.204 -0.653 1.00 0.00 H new ATOM 0 HG22 VAL A 73 -1.014 0.672 0.303 1.00 0.00 H new ATOM 0 HG23 VAL A 73 0.684 0.646 0.836 1.00 0.00 H new ATOM 1037 N ASN A 74 -2.089 -2.487 3.833 1.00 0.00 N ATOM 1038 CA ASN A 74 -2.281 -3.687 4.639 1.00 0.00 C ATOM 1039 C ASN A 74 -1.532 -3.580 5.963 1.00 0.00 C ATOM 1040 O ASN A 74 -1.088 -4.583 6.521 1.00 0.00 O ATOM 1041 CB ASN A 74 -1.811 -4.924 3.869 1.00 0.00 C ATOM 1042 CG ASN A 74 -2.949 -5.626 3.155 1.00 0.00 C ATOM 1043 OD1 ASN A 74 -3.849 -6.176 3.789 1.00 0.00 O ATOM 1044 ND2 ASN A 74 -2.914 -5.611 1.827 1.00 0.00 N ATOM 0 H ASN A 74 -2.948 -1.982 3.617 1.00 0.00 H new ATOM 0 HA ASN A 74 -3.345 -3.784 4.854 1.00 0.00 H new ATOM 0 HB2 ASN A 74 -1.055 -4.630 3.141 1.00 0.00 H new ATOM 0 HB3 ASN A 74 -1.335 -5.620 4.560 1.00 0.00 H new ATOM 0 HD21 ASN A 74 -3.653 -6.068 1.292 1.00 0.00 H new ATOM 0 HD22 ASN A 74 -2.148 -5.143 1.342 1.00 0.00 H new ATOM 1051 N GLY A 75 -1.396 -2.355 6.463 1.00 0.00 N ATOM 1052 CA GLY A 75 -0.700 -2.139 7.717 1.00 0.00 C ATOM 1053 C GLY A 75 0.808 -2.179 7.561 1.00 0.00 C ATOM 1054 O GLY A 75 1.526 -2.531 8.496 1.00 0.00 O ATOM 0 H GLY A 75 -1.756 -1.509 6.021 1.00 0.00 H new ATOM 0 HA2 GLY A 75 -0.993 -1.174 8.130 1.00 0.00 H new ATOM 0 HA3 GLY A 75 -1.008 -2.899 8.435 1.00 0.00 H new ATOM 1058 N ARG A 76 1.287 -1.817 6.375 1.00 0.00 N ATOM 1059 CA ARG A 76 2.719 -1.812 6.099 1.00 0.00 C ATOM 1060 C ARG A 76 3.182 -0.433 5.640 1.00 0.00 C ATOM 1061 O ARG A 76 2.535 0.205 4.809 1.00 0.00 O ATOM 1062 CB ARG A 76 3.058 -2.857 5.033 1.00 0.00 C ATOM 1063 CG ARG A 76 4.549 -3.114 4.886 1.00 0.00 C ATOM 1064 CD ARG A 76 4.850 -4.599 4.760 1.00 0.00 C ATOM 1065 NE ARG A 76 6.213 -4.919 5.179 1.00 0.00 N ATOM 1066 CZ ARG A 76 6.619 -6.143 5.508 1.00 0.00 C ATOM 1067 NH1 ARG A 76 5.773 -7.164 5.467 1.00 0.00 N ATOM 1068 NH2 ARG A 76 7.876 -6.347 5.878 1.00 0.00 N ATOM 0 H ARG A 76 0.705 -1.524 5.590 1.00 0.00 H new ATOM 0 HA ARG A 76 3.241 -2.061 7.023 1.00 0.00 H new ATOM 0 HB2 ARG A 76 2.559 -3.793 5.282 1.00 0.00 H new ATOM 0 HB3 ARG A 76 2.658 -2.528 4.074 1.00 0.00 H new ATOM 0 HG2 ARG A 76 4.924 -2.590 4.007 1.00 0.00 H new ATOM 0 HG3 ARG A 76 5.076 -2.707 5.749 1.00 0.00 H new ATOM 0 HD2 ARG A 76 4.142 -5.165 5.366 1.00 0.00 H new ATOM 0 HD3 ARG A 76 4.706 -4.912 3.726 1.00 0.00 H new ATOM 0 HE ARG A 76 6.893 -4.160 5.222 1.00 0.00 H new ATOM 0 HH11 ARG A 76 4.805 -7.013 5.182 1.00 0.00 H new ATOM 0 HH12 ARG A 76 6.090 -8.100 5.720 1.00 0.00 H new ATOM 0 HH21 ARG A 76 8.531 -5.566 5.910 1.00 0.00 H new ATOM 0 HH22 ARG A 76 8.188 -7.285 6.130 1.00 0.00 H new ATOM 1082 N SER A 77 4.304 0.021 6.187 1.00 0.00 N ATOM 1083 CA SER A 77 4.853 1.325 5.834 1.00 0.00 C ATOM 1084 C SER A 77 5.340 1.337 4.389 1.00 0.00 C ATOM 1085 O SER A 77 6.280 0.626 4.033 1.00 0.00 O ATOM 1086 CB SER A 77 6.003 1.689 6.774 1.00 0.00 C ATOM 1087 OG SER A 77 6.076 3.091 6.972 1.00 0.00 O ATOM 0 H SER A 77 4.851 -0.494 6.876 1.00 0.00 H new ATOM 0 HA SER A 77 4.060 2.065 5.938 1.00 0.00 H new ATOM 0 HB2 SER A 77 5.865 1.190 7.733 1.00 0.00 H new ATOM 0 HB3 SER A 77 6.944 1.328 6.359 1.00 0.00 H new ATOM 0 HG SER A 77 6.818 3.298 7.578 1.00 0.00 H new ATOM 1093 N PHE A 78 4.693 2.149 3.559 1.00 0.00 N ATOM 1094 CA PHE A 78 5.060 2.255 2.151 1.00 0.00 C ATOM 1095 C PHE A 78 5.829 3.545 1.884 1.00 0.00 C ATOM 1096 O PHE A 78 5.749 4.114 0.795 1.00 0.00 O ATOM 1097 CB PHE A 78 3.808 2.199 1.271 1.00 0.00 C ATOM 1098 CG PHE A 78 3.514 0.827 0.733 1.00 0.00 C ATOM 1099 CD1 PHE A 78 3.326 -0.243 1.593 1.00 0.00 C ATOM 1100 CD2 PHE A 78 3.423 0.611 -0.632 1.00 0.00 C ATOM 1101 CE1 PHE A 78 3.054 -1.505 1.099 1.00 0.00 C ATOM 1102 CE2 PHE A 78 3.152 -0.649 -1.131 1.00 0.00 C ATOM 1103 CZ PHE A 78 2.967 -1.709 -0.264 1.00 0.00 C ATOM 0 H PHE A 78 3.912 2.743 3.837 1.00 0.00 H new ATOM 0 HA PHE A 78 5.706 1.413 1.905 1.00 0.00 H new ATOM 0 HB2 PHE A 78 2.951 2.545 1.849 1.00 0.00 H new ATOM 0 HB3 PHE A 78 3.929 2.890 0.436 1.00 0.00 H new ATOM 0 HD1 PHE A 78 3.393 -0.089 2.660 1.00 0.00 H new ATOM 0 HD2 PHE A 78 3.565 1.436 -1.314 1.00 0.00 H new ATOM 0 HE1 PHE A 78 2.910 -2.331 1.779 1.00 0.00 H new ATOM 0 HE2 PHE A 78 3.085 -0.805 -2.198 1.00 0.00 H new ATOM 0 HZ PHE A 78 2.755 -2.695 -0.651 1.00 0.00 H new ATOM 1113 N LEU A 79 6.573 4.003 2.886 1.00 0.00 N ATOM 1114 CA LEU A 79 7.356 5.226 2.758 1.00 0.00 C ATOM 1115 C LEU A 79 8.773 4.920 2.286 1.00 0.00 C ATOM 1116 O LEU A 79 9.313 5.609 1.421 1.00 0.00 O ATOM 1117 CB LEU A 79 7.402 5.968 4.095 1.00 0.00 C ATOM 1118 CG LEU A 79 6.038 6.356 4.669 1.00 0.00 C ATOM 1119 CD1 LEU A 79 6.109 6.468 6.184 1.00 0.00 C ATOM 1120 CD2 LEU A 79 5.555 7.662 4.058 1.00 0.00 C ATOM 0 H LEU A 79 6.650 3.546 3.795 1.00 0.00 H new ATOM 0 HA LEU A 79 6.874 5.859 2.013 1.00 0.00 H new ATOM 0 HB2 LEU A 79 7.920 5.343 4.822 1.00 0.00 H new ATOM 0 HB3 LEU A 79 7.997 6.873 3.971 1.00 0.00 H new ATOM 0 HG LEU A 79 5.323 5.573 4.416 1.00 0.00 H new ATOM 0 HD11 LEU A 79 5.130 6.745 6.575 1.00 0.00 H new ATOM 0 HD12 LEU A 79 6.410 5.509 6.606 1.00 0.00 H new ATOM 0 HD13 LEU A 79 6.838 7.230 6.459 1.00 0.00 H new ATOM 0 HD21 LEU A 79 4.583 7.923 4.478 1.00 0.00 H new ATOM 0 HD22 LEU A 79 6.270 8.454 4.280 1.00 0.00 H new ATOM 0 HD23 LEU A 79 5.464 7.547 2.978 1.00 0.00 H new ATOM 1132 N ASN A 80 9.371 3.880 2.859 1.00 0.00 N ATOM 1133 CA ASN A 80 10.726 3.481 2.496 1.00 0.00 C ATOM 1134 C ASN A 80 10.737 2.086 1.879 1.00 0.00 C ATOM 1135 O ASN A 80 11.668 1.309 2.094 1.00 0.00 O ATOM 1136 CB ASN A 80 11.636 3.516 3.725 1.00 0.00 C ATOM 1137 CG ASN A 80 11.071 2.721 4.885 1.00 0.00 C ATOM 1138 OD1 ASN A 80 10.061 2.031 4.746 1.00 0.00 O ATOM 1139 ND2 ASN A 80 11.722 2.813 6.039 1.00 0.00 N ATOM 0 H ASN A 80 8.938 3.298 3.577 1.00 0.00 H new ATOM 0 HA ASN A 80 11.100 4.188 1.755 1.00 0.00 H new ATOM 0 HB2 ASN A 80 12.616 3.120 3.459 1.00 0.00 H new ATOM 0 HB3 ASN A 80 11.784 4.551 4.035 1.00 0.00 H new ATOM 0 HD21 ASN A 80 11.389 2.300 6.855 1.00 0.00 H new ATOM 0 HD22 ASN A 80 12.555 3.397 6.109 1.00 0.00 H new ATOM 1146 N ILE A 81 9.697 1.774 1.113 1.00 0.00 N ATOM 1147 CA ILE A 81 9.586 0.473 0.467 1.00 0.00 C ATOM 1148 C ILE A 81 10.191 0.504 -0.934 1.00 0.00 C ATOM 1149 O ILE A 81 10.167 1.533 -1.609 1.00 0.00 O ATOM 1150 CB ILE A 81 8.117 0.013 0.377 1.00 0.00 C ATOM 1151 CG1 ILE A 81 8.036 -1.406 -0.193 1.00 0.00 C ATOM 1152 CG2 ILE A 81 7.304 0.979 -0.473 1.00 0.00 C ATOM 1153 CD1 ILE A 81 6.875 -2.210 0.350 1.00 0.00 C ATOM 0 H ILE A 81 8.919 2.406 0.925 1.00 0.00 H new ATOM 0 HA ILE A 81 10.140 -0.237 1.082 1.00 0.00 H new ATOM 0 HB ILE A 81 7.696 0.006 1.382 1.00 0.00 H new ATOM 0 HG12 ILE A 81 7.952 -1.349 -1.278 1.00 0.00 H new ATOM 0 HG13 ILE A 81 8.966 -1.931 0.027 1.00 0.00 H new ATOM 0 HG21 ILE A 81 6.270 0.637 -0.524 1.00 0.00 H new ATOM 0 HG22 ILE A 81 7.336 1.973 -0.026 1.00 0.00 H new ATOM 0 HG23 ILE A 81 7.723 1.020 -1.478 1.00 0.00 H new ATOM 0 HD11 ILE A 81 6.880 -3.204 -0.097 1.00 0.00 H new ATOM 0 HD12 ILE A 81 6.968 -2.299 1.432 1.00 0.00 H new ATOM 0 HD13 ILE A 81 5.939 -1.707 0.107 1.00 0.00 H new ATOM 1165 N LEU A 82 10.730 -0.631 -1.366 1.00 0.00 N ATOM 1166 CA LEU A 82 11.339 -0.734 -2.686 1.00 0.00 C ATOM 1167 C LEU A 82 10.308 -0.489 -3.782 1.00 0.00 C ATOM 1168 O LEU A 82 9.119 -0.751 -3.598 1.00 0.00 O ATOM 1169 CB LEU A 82 11.980 -2.111 -2.870 1.00 0.00 C ATOM 1170 CG LEU A 82 13.061 -2.465 -1.847 1.00 0.00 C ATOM 1171 CD1 LEU A 82 13.258 -3.970 -1.778 1.00 0.00 C ATOM 1172 CD2 LEU A 82 14.368 -1.768 -2.193 1.00 0.00 C ATOM 0 H LEU A 82 10.757 -1.493 -0.821 1.00 0.00 H new ATOM 0 HA LEU A 82 12.112 0.031 -2.762 1.00 0.00 H new ATOM 0 HB2 LEU A 82 11.197 -2.868 -2.825 1.00 0.00 H new ATOM 0 HB3 LEU A 82 12.415 -2.162 -3.868 1.00 0.00 H new ATOM 0 HG LEU A 82 12.736 -2.118 -0.866 1.00 0.00 H new ATOM 0 HD11 LEU A 82 14.031 -4.203 -1.045 1.00 0.00 H new ATOM 0 HD12 LEU A 82 12.323 -4.446 -1.483 1.00 0.00 H new ATOM 0 HD13 LEU A 82 13.562 -4.342 -2.756 1.00 0.00 H new ATOM 0 HD21 LEU A 82 15.127 -2.030 -1.456 1.00 0.00 H new ATOM 0 HD22 LEU A 82 14.699 -2.085 -3.182 1.00 0.00 H new ATOM 0 HD23 LEU A 82 14.217 -0.689 -2.190 1.00 0.00 H new ATOM 1184 N HIS A 83 10.770 0.013 -4.922 1.00 0.00 N ATOM 1185 CA HIS A 83 9.886 0.292 -6.048 1.00 0.00 C ATOM 1186 C HIS A 83 9.302 -0.997 -6.614 1.00 0.00 C ATOM 1187 O HIS A 83 8.121 -1.058 -6.957 1.00 0.00 O ATOM 1188 CB HIS A 83 10.642 1.047 -7.143 1.00 0.00 C ATOM 1189 CG HIS A 83 9.747 1.674 -8.165 1.00 0.00 C ATOM 1190 ND1 HIS A 83 8.505 2.193 -7.862 1.00 0.00 N ATOM 1191 CD2 HIS A 83 9.917 1.867 -9.495 1.00 0.00 C ATOM 1192 CE1 HIS A 83 7.951 2.675 -8.960 1.00 0.00 C ATOM 1193 NE2 HIS A 83 8.788 2.490 -9.964 1.00 0.00 N ATOM 0 H HIS A 83 11.751 0.235 -5.091 1.00 0.00 H new ATOM 0 HA HIS A 83 9.066 0.913 -5.688 1.00 0.00 H new ATOM 0 HB2 HIS A 83 11.253 1.823 -6.682 1.00 0.00 H new ATOM 0 HB3 HIS A 83 11.324 0.359 -7.643 1.00 0.00 H new ATOM 0 HD2 HIS A 83 10.781 1.583 -10.078 1.00 0.00 H new ATOM 0 HE1 HIS A 83 6.979 3.141 -9.025 1.00 0.00 H new ATOM 0 HE2 HIS A 83 8.622 2.766 -10.932 1.00 0.00 H new ATOM 1202 N ASP A 84 10.136 -2.027 -6.709 1.00 0.00 N ATOM 1203 CA ASP A 84 9.702 -3.317 -7.233 1.00 0.00 C ATOM 1204 C ASP A 84 8.838 -4.055 -6.217 1.00 0.00 C ATOM 1205 O ASP A 84 7.869 -4.723 -6.578 1.00 0.00 O ATOM 1206 CB ASP A 84 10.914 -4.173 -7.605 1.00 0.00 C ATOM 1207 CG ASP A 84 11.504 -3.788 -8.949 1.00 0.00 C ATOM 1208 OD1 ASP A 84 12.348 -2.868 -8.984 1.00 0.00 O ATOM 1209 OD2 ASP A 84 11.121 -4.407 -9.964 1.00 0.00 O ATOM 0 H ASP A 84 11.117 -1.994 -6.430 1.00 0.00 H new ATOM 0 HA ASP A 84 9.105 -3.135 -8.127 1.00 0.00 H new ATOM 0 HB2 ASP A 84 11.677 -4.071 -6.834 1.00 0.00 H new ATOM 0 HB3 ASP A 84 10.621 -5.223 -7.627 1.00 0.00 H new ATOM 1214 N GLU A 85 9.195 -3.930 -4.942 1.00 0.00 N ATOM 1215 CA GLU A 85 8.452 -4.585 -3.872 1.00 0.00 C ATOM 1216 C GLU A 85 7.037 -4.027 -3.771 1.00 0.00 C ATOM 1217 O GLU A 85 6.087 -4.763 -3.505 1.00 0.00 O ATOM 1218 CB GLU A 85 9.179 -4.409 -2.537 1.00 0.00 C ATOM 1219 CG GLU A 85 8.638 -5.296 -1.429 1.00 0.00 C ATOM 1220 CD GLU A 85 9.478 -5.231 -0.167 1.00 0.00 C ATOM 1221 OE1 GLU A 85 9.255 -4.311 0.647 1.00 0.00 O ATOM 1222 OE2 GLU A 85 10.358 -6.101 0.006 1.00 0.00 O ATOM 0 H GLU A 85 9.994 -3.381 -4.625 1.00 0.00 H new ATOM 0 HA GLU A 85 8.388 -5.648 -4.106 1.00 0.00 H new ATOM 0 HB2 GLU A 85 10.238 -4.624 -2.678 1.00 0.00 H new ATOM 0 HB3 GLU A 85 9.104 -3.367 -2.226 1.00 0.00 H new ATOM 0 HG2 GLU A 85 7.616 -4.998 -1.196 1.00 0.00 H new ATOM 0 HG3 GLU A 85 8.597 -6.327 -1.781 1.00 0.00 H new ATOM 1229 N ALA A 86 6.903 -2.722 -3.986 1.00 0.00 N ATOM 1230 CA ALA A 86 5.603 -2.066 -3.917 1.00 0.00 C ATOM 1231 C ALA A 86 4.712 -2.492 -5.080 1.00 0.00 C ATOM 1232 O ALA A 86 3.489 -2.551 -4.949 1.00 0.00 O ATOM 1233 CB ALA A 86 5.774 -0.555 -3.907 1.00 0.00 C ATOM 0 H ALA A 86 7.679 -2.099 -4.209 1.00 0.00 H new ATOM 0 HA ALA A 86 5.118 -2.371 -2.990 1.00 0.00 H new ATOM 0 HB1 ALA A 86 4.795 -0.078 -3.855 1.00 0.00 H new ATOM 0 HB2 ALA A 86 6.367 -0.262 -3.041 1.00 0.00 H new ATOM 0 HB3 ALA A 86 6.283 -0.240 -4.818 1.00 0.00 H new ATOM 1239 N VAL A 87 5.332 -2.788 -6.217 1.00 0.00 N ATOM 1240 CA VAL A 87 4.594 -3.208 -7.402 1.00 0.00 C ATOM 1241 C VAL A 87 4.286 -4.702 -7.355 1.00 0.00 C ATOM 1242 O VAL A 87 3.209 -5.136 -7.763 1.00 0.00 O ATOM 1243 CB VAL A 87 5.376 -2.897 -8.693 1.00 0.00 C ATOM 1244 CG1 VAL A 87 4.530 -3.202 -9.920 1.00 0.00 C ATOM 1245 CG2 VAL A 87 5.836 -1.446 -8.702 1.00 0.00 C ATOM 0 H VAL A 87 6.343 -2.745 -6.343 1.00 0.00 H new ATOM 0 HA VAL A 87 3.660 -2.646 -7.409 1.00 0.00 H new ATOM 0 HB VAL A 87 6.259 -3.536 -8.722 1.00 0.00 H new ATOM 0 HG11 VAL A 87 5.101 -2.976 -10.821 1.00 0.00 H new ATOM 0 HG12 VAL A 87 4.256 -4.257 -9.920 1.00 0.00 H new ATOM 0 HG13 VAL A 87 3.627 -2.592 -9.900 1.00 0.00 H new ATOM 0 HG21 VAL A 87 6.386 -1.245 -9.621 1.00 0.00 H new ATOM 0 HG22 VAL A 87 4.968 -0.789 -8.647 1.00 0.00 H new ATOM 0 HG23 VAL A 87 6.483 -1.264 -7.844 1.00 0.00 H new ATOM 1255 N ARG A 88 5.237 -5.482 -6.854 1.00 0.00 N ATOM 1256 CA ARG A 88 5.066 -6.926 -6.752 1.00 0.00 C ATOM 1257 C ARG A 88 4.100 -7.280 -5.625 1.00 0.00 C ATOM 1258 O ARG A 88 3.265 -8.173 -5.766 1.00 0.00 O ATOM 1259 CB ARG A 88 6.417 -7.606 -6.516 1.00 0.00 C ATOM 1260 CG ARG A 88 6.601 -8.886 -7.317 1.00 0.00 C ATOM 1261 CD ARG A 88 8.059 -9.102 -7.691 1.00 0.00 C ATOM 1262 NE ARG A 88 8.720 -10.048 -6.794 1.00 0.00 N ATOM 1263 CZ ARG A 88 9.872 -10.653 -7.074 1.00 0.00 C ATOM 1264 NH1 ARG A 88 10.493 -10.415 -8.223 1.00 0.00 N ATOM 1265 NH2 ARG A 88 10.405 -11.498 -6.202 1.00 0.00 N ATOM 0 H ARG A 88 6.134 -5.138 -6.512 1.00 0.00 H new ATOM 0 HA ARG A 88 4.647 -7.285 -7.692 1.00 0.00 H new ATOM 0 HB2 ARG A 88 7.215 -6.909 -6.772 1.00 0.00 H new ATOM 0 HB3 ARG A 88 6.520 -7.833 -5.455 1.00 0.00 H new ATOM 0 HG2 ARG A 88 6.243 -9.736 -6.735 1.00 0.00 H new ATOM 0 HG3 ARG A 88 5.995 -8.841 -8.222 1.00 0.00 H new ATOM 0 HD2 ARG A 88 8.120 -9.470 -8.715 1.00 0.00 H new ATOM 0 HD3 ARG A 88 8.585 -8.148 -7.664 1.00 0.00 H new ATOM 0 HE ARG A 88 8.272 -10.257 -5.902 1.00 0.00 H new ATOM 0 HH11 ARG A 88 10.088 -9.765 -8.897 1.00 0.00 H new ATOM 0 HH12 ARG A 88 11.376 -10.882 -8.432 1.00 0.00 H new ATOM 0 HH21 ARG A 88 9.932 -11.684 -5.318 1.00 0.00 H new ATOM 0 HH22 ARG A 88 11.288 -11.962 -6.416 1.00 0.00 H new ATOM 1279 N LEU A 89 4.220 -6.572 -4.507 1.00 0.00 N ATOM 1280 CA LEU A 89 3.358 -6.810 -3.354 1.00 0.00 C ATOM 1281 C LEU A 89 1.927 -6.372 -3.647 1.00 0.00 C ATOM 1282 O LEU A 89 0.971 -7.023 -3.227 1.00 0.00 O ATOM 1283 CB LEU A 89 3.892 -6.065 -2.129 1.00 0.00 C ATOM 1284 CG LEU A 89 3.042 -6.206 -0.865 1.00 0.00 C ATOM 1285 CD1 LEU A 89 2.966 -7.663 -0.434 1.00 0.00 C ATOM 1286 CD2 LEU A 89 3.608 -5.346 0.255 1.00 0.00 C ATOM 0 H LEU A 89 4.906 -5.829 -4.374 1.00 0.00 H new ATOM 0 HA LEU A 89 3.356 -7.880 -3.147 1.00 0.00 H new ATOM 0 HB2 LEU A 89 4.898 -6.425 -1.914 1.00 0.00 H new ATOM 0 HB3 LEU A 89 3.978 -5.007 -2.375 1.00 0.00 H new ATOM 0 HG LEU A 89 2.032 -5.861 -1.087 1.00 0.00 H new ATOM 0 HD11 LEU A 89 2.358 -7.745 0.467 1.00 0.00 H new ATOM 0 HD12 LEU A 89 2.516 -8.255 -1.231 1.00 0.00 H new ATOM 0 HD13 LEU A 89 3.970 -8.034 -0.229 1.00 0.00 H new ATOM 0 HD21 LEU A 89 2.991 -5.458 1.147 1.00 0.00 H new ATOM 0 HD22 LEU A 89 4.627 -5.662 0.477 1.00 0.00 H new ATOM 0 HD23 LEU A 89 3.611 -4.301 -0.055 1.00 0.00 H new ATOM 1298 N LEU A 90 1.786 -5.263 -4.367 1.00 0.00 N ATOM 1299 CA LEU A 90 0.471 -4.739 -4.713 1.00 0.00 C ATOM 1300 C LEU A 90 -0.202 -5.614 -5.767 1.00 0.00 C ATOM 1301 O LEU A 90 -1.425 -5.757 -5.780 1.00 0.00 O ATOM 1302 CB LEU A 90 0.589 -3.302 -5.226 1.00 0.00 C ATOM 1303 CG LEU A 90 0.800 -2.244 -4.143 1.00 0.00 C ATOM 1304 CD1 LEU A 90 1.046 -0.881 -4.770 1.00 0.00 C ATOM 1305 CD2 LEU A 90 -0.397 -2.194 -3.206 1.00 0.00 C ATOM 0 H LEU A 90 2.567 -4.711 -4.722 1.00 0.00 H new ATOM 0 HA LEU A 90 -0.144 -4.746 -3.813 1.00 0.00 H new ATOM 0 HB2 LEU A 90 1.420 -3.251 -5.930 1.00 0.00 H new ATOM 0 HB3 LEU A 90 -0.315 -3.055 -5.782 1.00 0.00 H new ATOM 0 HG LEU A 90 1.680 -2.518 -3.561 1.00 0.00 H new ATOM 0 HD11 LEU A 90 1.194 -0.140 -3.984 1.00 0.00 H new ATOM 0 HD12 LEU A 90 1.935 -0.925 -5.399 1.00 0.00 H new ATOM 0 HD13 LEU A 90 0.186 -0.599 -5.377 1.00 0.00 H new ATOM 0 HD21 LEU A 90 -0.229 -1.435 -2.442 1.00 0.00 H new ATOM 0 HD22 LEU A 90 -1.293 -1.945 -3.774 1.00 0.00 H new ATOM 0 HD23 LEU A 90 -0.527 -3.166 -2.730 1.00 0.00 H new ATOM 1317 N LYS A 91 0.605 -6.198 -6.647 1.00 0.00 N ATOM 1318 CA LYS A 91 0.087 -7.060 -7.703 1.00 0.00 C ATOM 1319 C LYS A 91 0.396 -8.525 -7.408 1.00 0.00 C ATOM 1320 O LYS A 91 1.234 -9.139 -8.069 1.00 0.00 O ATOM 1321 CB LYS A 91 0.684 -6.660 -9.054 1.00 0.00 C ATOM 1322 CG LYS A 91 0.690 -5.161 -9.298 1.00 0.00 C ATOM 1323 CD LYS A 91 -0.717 -4.627 -9.518 1.00 0.00 C ATOM 1324 CE LYS A 91 -0.744 -3.561 -10.602 1.00 0.00 C ATOM 1325 NZ LYS A 91 -0.551 -2.195 -10.043 1.00 0.00 N ATOM 0 H LYS A 91 1.619 -6.090 -6.650 1.00 0.00 H new ATOM 0 HA LYS A 91 -0.995 -6.937 -7.743 1.00 0.00 H new ATOM 0 HB2 LYS A 91 1.706 -7.033 -9.115 1.00 0.00 H new ATOM 0 HB3 LYS A 91 0.119 -7.147 -9.849 1.00 0.00 H new ATOM 0 HG2 LYS A 91 1.144 -4.654 -8.446 1.00 0.00 H new ATOM 0 HG3 LYS A 91 1.306 -4.935 -10.168 1.00 0.00 H new ATOM 0 HD2 LYS A 91 -1.379 -5.447 -9.796 1.00 0.00 H new ATOM 0 HD3 LYS A 91 -1.099 -4.210 -8.586 1.00 0.00 H new ATOM 0 HE2 LYS A 91 0.037 -3.767 -11.334 1.00 0.00 H new ATOM 0 HE3 LYS A 91 -1.696 -3.605 -11.131 1.00 0.00 H new ATOM 0 HZ1 LYS A 91 -0.289 -1.541 -10.808 1.00 0.00 H new ATOM 0 HZ2 LYS A 91 -1.435 -1.873 -9.599 1.00 0.00 H new ATOM 0 HZ3 LYS A 91 0.206 -2.215 -9.331 1.00 0.00 H new ATOM 1339 N SER A 92 -0.286 -9.079 -6.411 1.00 0.00 N ATOM 1340 CA SER A 92 -0.085 -10.471 -6.028 1.00 0.00 C ATOM 1341 C SER A 92 -1.057 -10.879 -4.927 1.00 0.00 C ATOM 1342 O SER A 92 -1.661 -11.951 -4.983 1.00 0.00 O ATOM 1343 CB SER A 92 1.355 -10.689 -5.559 1.00 0.00 C ATOM 1344 OG SER A 92 1.740 -12.045 -5.708 1.00 0.00 O ATOM 0 H SER A 92 -0.983 -8.585 -5.854 1.00 0.00 H new ATOM 0 HA SER A 92 -0.274 -11.093 -6.903 1.00 0.00 H new ATOM 0 HB2 SER A 92 2.028 -10.051 -6.132 1.00 0.00 H new ATOM 0 HB3 SER A 92 1.449 -10.394 -4.514 1.00 0.00 H new ATOM 0 HG SER A 92 2.664 -12.158 -5.403 1.00 0.00 H new ATOM 1350 N SER A 93 -1.204 -10.019 -3.925 1.00 0.00 N ATOM 1351 CA SER A 93 -2.103 -10.290 -2.810 1.00 0.00 C ATOM 1352 C SER A 93 -3.551 -10.006 -3.196 1.00 0.00 C ATOM 1353 O SER A 93 -3.818 -9.253 -4.133 1.00 0.00 O ATOM 1354 CB SER A 93 -1.712 -9.446 -1.596 1.00 0.00 C ATOM 1355 OG SER A 93 -1.888 -10.173 -0.391 1.00 0.00 O ATOM 0 H SER A 93 -0.712 -9.128 -3.862 1.00 0.00 H new ATOM 0 HA SER A 93 -2.015 -11.346 -2.554 1.00 0.00 H new ATOM 0 HB2 SER A 93 -0.672 -9.133 -1.687 1.00 0.00 H new ATOM 0 HB3 SER A 93 -2.317 -8.540 -1.569 1.00 0.00 H new ATOM 0 HG SER A 93 -1.630 -9.612 0.370 1.00 0.00 H new ATOM 1361 N ARG A 94 -4.482 -10.614 -2.468 1.00 0.00 N ATOM 1362 CA ARG A 94 -5.904 -10.425 -2.734 1.00 0.00 C ATOM 1363 C ARG A 94 -6.413 -9.142 -2.088 1.00 0.00 C ATOM 1364 O ARG A 94 -6.860 -8.223 -2.775 1.00 0.00 O ATOM 1365 CB ARG A 94 -6.703 -11.623 -2.217 1.00 0.00 C ATOM 1366 CG ARG A 94 -6.843 -12.745 -3.233 1.00 0.00 C ATOM 1367 CD ARG A 94 -5.488 -13.285 -3.657 1.00 0.00 C ATOM 1368 NE ARG A 94 -4.745 -13.844 -2.530 1.00 0.00 N ATOM 1369 CZ ARG A 94 -3.587 -14.490 -2.653 1.00 0.00 C ATOM 1370 NH1 ARG A 94 -3.038 -14.660 -3.850 1.00 0.00 N ATOM 1371 NH2 ARG A 94 -2.976 -14.966 -1.577 1.00 0.00 N ATOM 0 H ARG A 94 -4.278 -11.241 -1.690 1.00 0.00 H new ATOM 0 HA ARG A 94 -6.039 -10.344 -3.813 1.00 0.00 H new ATOM 0 HB2 ARG A 94 -6.219 -12.013 -1.322 1.00 0.00 H new ATOM 0 HB3 ARG A 94 -7.696 -11.286 -1.921 1.00 0.00 H new ATOM 0 HG2 ARG A 94 -7.440 -13.551 -2.806 1.00 0.00 H new ATOM 0 HG3 ARG A 94 -7.380 -12.380 -4.108 1.00 0.00 H new ATOM 0 HD2 ARG A 94 -5.626 -14.054 -4.417 1.00 0.00 H new ATOM 0 HD3 ARG A 94 -4.906 -12.485 -4.114 1.00 0.00 H new ATOM 0 HE ARG A 94 -5.136 -13.733 -1.594 1.00 0.00 H new ATOM 0 HH11 ARG A 94 -3.503 -14.295 -4.681 1.00 0.00 H new ATOM 0 HH12 ARG A 94 -2.151 -15.156 -3.938 1.00 0.00 H new ATOM 0 HH21 ARG A 94 -3.393 -14.837 -0.655 1.00 0.00 H new ATOM 0 HH22 ARG A 94 -2.089 -15.461 -1.671 1.00 0.00 H new ATOM 1385 N HIS A 95 -6.344 -9.085 -0.761 1.00 0.00 N ATOM 1386 CA HIS A 95 -6.798 -7.914 -0.021 1.00 0.00 C ATOM 1387 C HIS A 95 -5.741 -6.813 -0.041 1.00 0.00 C ATOM 1388 O HIS A 95 -4.592 -7.036 0.340 1.00 0.00 O ATOM 1389 CB HIS A 95 -7.125 -8.295 1.424 1.00 0.00 C ATOM 1390 CG HIS A 95 -8.291 -7.546 1.991 1.00 0.00 C ATOM 1391 ND1 HIS A 95 -9.334 -8.163 2.650 1.00 0.00 N ATOM 1392 CD2 HIS A 95 -8.576 -6.222 1.997 1.00 0.00 C ATOM 1393 CE1 HIS A 95 -10.210 -7.251 3.035 1.00 0.00 C ATOM 1394 NE2 HIS A 95 -9.772 -6.066 2.651 1.00 0.00 N ATOM 0 H HIS A 95 -5.978 -9.837 -0.177 1.00 0.00 H new ATOM 0 HA HIS A 95 -7.699 -7.536 -0.504 1.00 0.00 H new ATOM 0 HB2 HIS A 95 -7.333 -9.364 1.471 1.00 0.00 H new ATOM 0 HB3 HIS A 95 -6.249 -8.113 2.046 1.00 0.00 H new ATOM 0 HD2 HIS A 95 -7.974 -5.435 1.567 1.00 0.00 H new ATOM 0 HE1 HIS A 95 -11.127 -7.442 3.572 1.00 0.00 H new ATOM 0 HE2 HIS A 95 -10.246 -5.178 2.814 1.00 0.00 H new ATOM 1403 N LEU A 96 -6.138 -5.627 -0.489 1.00 0.00 N ATOM 1404 CA LEU A 96 -5.225 -4.492 -0.560 1.00 0.00 C ATOM 1405 C LEU A 96 -5.868 -3.240 0.025 1.00 0.00 C ATOM 1406 O LEU A 96 -6.819 -2.697 -0.537 1.00 0.00 O ATOM 1407 CB LEU A 96 -4.806 -4.236 -2.009 1.00 0.00 C ATOM 1408 CG LEU A 96 -4.232 -5.450 -2.740 1.00 0.00 C ATOM 1409 CD1 LEU A 96 -4.354 -5.273 -4.246 1.00 0.00 C ATOM 1410 CD2 LEU A 96 -2.781 -5.673 -2.344 1.00 0.00 C ATOM 0 H LEU A 96 -7.086 -5.427 -0.808 1.00 0.00 H new ATOM 0 HA LEU A 96 -4.340 -4.733 0.029 1.00 0.00 H new ATOM 0 HB2 LEU A 96 -5.672 -3.873 -2.563 1.00 0.00 H new ATOM 0 HB3 LEU A 96 -4.063 -3.439 -2.021 1.00 0.00 H new ATOM 0 HG LEU A 96 -4.807 -6.330 -2.450 1.00 0.00 H new ATOM 0 HD11 LEU A 96 -3.940 -6.147 -4.750 1.00 0.00 H new ATOM 0 HD12 LEU A 96 -5.404 -5.162 -4.515 1.00 0.00 H new ATOM 0 HD13 LEU A 96 -3.805 -4.383 -4.553 1.00 0.00 H new ATOM 0 HD21 LEU A 96 -2.389 -6.541 -2.874 1.00 0.00 H new ATOM 0 HD22 LEU A 96 -2.193 -4.793 -2.604 1.00 0.00 H new ATOM 0 HD23 LEU A 96 -2.719 -5.845 -1.269 1.00 0.00 H new ATOM 1422 N ILE A 97 -5.341 -2.784 1.158 1.00 0.00 N ATOM 1423 CA ILE A 97 -5.863 -1.594 1.819 1.00 0.00 C ATOM 1424 C ILE A 97 -4.848 -0.457 1.783 1.00 0.00 C ATOM 1425 O ILE A 97 -4.064 -0.280 2.716 1.00 0.00 O ATOM 1426 CB ILE A 97 -6.240 -1.885 3.286 1.00 0.00 C ATOM 1427 CG1 ILE A 97 -7.127 -3.128 3.372 1.00 0.00 C ATOM 1428 CG2 ILE A 97 -6.941 -0.683 3.902 1.00 0.00 C ATOM 1429 CD1 ILE A 97 -7.066 -3.822 4.716 1.00 0.00 C ATOM 0 H ILE A 97 -4.553 -3.221 1.636 1.00 0.00 H new ATOM 0 HA ILE A 97 -6.759 -1.296 1.274 1.00 0.00 H new ATOM 0 HB ILE A 97 -5.326 -2.075 3.849 1.00 0.00 H new ATOM 0 HG12 ILE A 97 -8.159 -2.843 3.166 1.00 0.00 H new ATOM 0 HG13 ILE A 97 -6.829 -3.832 2.595 1.00 0.00 H new ATOM 0 HG21 ILE A 97 -7.201 -0.904 4.937 1.00 0.00 H new ATOM 0 HG22 ILE A 97 -6.277 0.181 3.871 1.00 0.00 H new ATOM 0 HG23 ILE A 97 -7.848 -0.463 3.339 1.00 0.00 H new ATOM 0 HD11 ILE A 97 -7.719 -4.694 4.705 1.00 0.00 H new ATOM 0 HD12 ILE A 97 -6.042 -4.138 4.916 1.00 0.00 H new ATOM 0 HD13 ILE A 97 -7.393 -3.134 5.496 1.00 0.00 H new ATOM 1441 N LEU A 98 -4.866 0.313 0.699 1.00 0.00 N ATOM 1442 CA LEU A 98 -3.947 1.433 0.541 1.00 0.00 C ATOM 1443 C LEU A 98 -4.436 2.652 1.315 1.00 0.00 C ATOM 1444 O LEU A 98 -5.615 3.001 1.264 1.00 0.00 O ATOM 1445 CB LEU A 98 -3.787 1.785 -0.939 1.00 0.00 C ATOM 1446 CG LEU A 98 -2.937 0.804 -1.751 1.00 0.00 C ATOM 1447 CD1 LEU A 98 -3.825 -0.171 -2.509 1.00 0.00 C ATOM 1448 CD2 LEU A 98 -2.025 1.554 -2.710 1.00 0.00 C ATOM 0 H LEU A 98 -5.508 0.181 -0.083 1.00 0.00 H new ATOM 0 HA LEU A 98 -2.979 1.134 0.943 1.00 0.00 H new ATOM 0 HB2 LEU A 98 -4.777 1.845 -1.391 1.00 0.00 H new ATOM 0 HB3 LEU A 98 -3.341 2.777 -1.015 1.00 0.00 H new ATOM 0 HG LEU A 98 -2.314 0.235 -1.060 1.00 0.00 H new ATOM 0 HD11 LEU A 98 -3.203 -0.860 -3.080 1.00 0.00 H new ATOM 0 HD12 LEU A 98 -4.435 -0.733 -1.802 1.00 0.00 H new ATOM 0 HD13 LEU A 98 -4.474 0.381 -3.189 1.00 0.00 H new ATOM 0 HD21 LEU A 98 -1.429 0.840 -3.278 1.00 0.00 H new ATOM 0 HD22 LEU A 98 -2.628 2.150 -3.395 1.00 0.00 H new ATOM 0 HD23 LEU A 98 -1.363 2.210 -2.145 1.00 0.00 H new ATOM 1460 N THR A 99 -3.521 3.296 2.034 1.00 0.00 N ATOM 1461 CA THR A 99 -3.859 4.477 2.820 1.00 0.00 C ATOM 1462 C THR A 99 -3.205 5.724 2.234 1.00 0.00 C ATOM 1463 O THR A 99 -2.074 6.066 2.579 1.00 0.00 O ATOM 1464 CB THR A 99 -3.418 4.292 4.272 1.00 0.00 C ATOM 1465 OG1 THR A 99 -3.868 3.047 4.778 1.00 0.00 O ATOM 1466 CG2 THR A 99 -3.931 5.376 5.196 1.00 0.00 C ATOM 0 H THR A 99 -2.541 3.020 2.088 1.00 0.00 H new ATOM 0 HA THR A 99 -4.941 4.606 2.790 1.00 0.00 H new ATOM 0 HB THR A 99 -2.329 4.340 4.252 1.00 0.00 H new ATOM 0 HG1 THR A 99 -3.575 2.946 5.708 1.00 0.00 H new ATOM 0 HG21 THR A 99 -3.582 5.185 6.211 1.00 0.00 H new ATOM 0 HG22 THR A 99 -3.560 6.345 4.861 1.00 0.00 H new ATOM 0 HG23 THR A 99 -5.021 5.380 5.182 1.00 0.00 H new ATOM 1474 N VAL A 100 -3.924 6.400 1.343 1.00 0.00 N ATOM 1475 CA VAL A 100 -3.413 7.608 0.708 1.00 0.00 C ATOM 1476 C VAL A 100 -4.003 8.859 1.351 1.00 0.00 C ATOM 1477 O VAL A 100 -4.941 8.778 2.145 1.00 0.00 O ATOM 1478 CB VAL A 100 -3.726 7.626 -0.800 1.00 0.00 C ATOM 1479 CG1 VAL A 100 -2.958 6.527 -1.518 1.00 0.00 C ATOM 1480 CG2 VAL A 100 -5.222 7.485 -1.037 1.00 0.00 C ATOM 0 H VAL A 100 -4.862 6.131 1.045 1.00 0.00 H new ATOM 0 HA VAL A 100 -2.332 7.605 0.848 1.00 0.00 H new ATOM 0 HB VAL A 100 -3.407 8.585 -1.207 1.00 0.00 H new ATOM 0 HG11 VAL A 100 -3.192 6.555 -2.582 1.00 0.00 H new ATOM 0 HG12 VAL A 100 -1.888 6.679 -1.377 1.00 0.00 H new ATOM 0 HG13 VAL A 100 -3.243 5.557 -1.110 1.00 0.00 H new ATOM 0 HG21 VAL A 100 -5.424 7.500 -2.108 1.00 0.00 H new ATOM 0 HG22 VAL A 100 -5.570 6.542 -0.615 1.00 0.00 H new ATOM 0 HG23 VAL A 100 -5.746 8.312 -0.558 1.00 0.00 H new ATOM 1490 N LYS A 101 -3.448 10.015 1.005 1.00 0.00 N ATOM 1491 CA LYS A 101 -3.918 11.284 1.547 1.00 0.00 C ATOM 1492 C LYS A 101 -4.425 12.197 0.435 1.00 0.00 C ATOM 1493 O LYS A 101 -4.048 12.044 -0.726 1.00 0.00 O ATOM 1494 CB LYS A 101 -2.798 11.979 2.323 1.00 0.00 C ATOM 1495 CG LYS A 101 -1.583 12.309 1.471 1.00 0.00 C ATOM 1496 CD LYS A 101 -0.307 12.312 2.297 1.00 0.00 C ATOM 1497 CE LYS A 101 0.099 13.722 2.692 1.00 0.00 C ATOM 1498 NZ LYS A 101 1.040 13.728 3.846 1.00 0.00 N ATOM 0 H LYS A 101 -2.670 10.099 0.350 1.00 0.00 H new ATOM 0 HA LYS A 101 -4.745 11.075 2.226 1.00 0.00 H new ATOM 0 HB2 LYS A 101 -3.186 12.899 2.759 1.00 0.00 H new ATOM 0 HB3 LYS A 101 -2.489 11.340 3.150 1.00 0.00 H new ATOM 0 HG2 LYS A 101 -1.494 11.581 0.665 1.00 0.00 H new ATOM 0 HG3 LYS A 101 -1.718 13.285 1.005 1.00 0.00 H new ATOM 0 HD2 LYS A 101 -0.452 11.710 3.194 1.00 0.00 H new ATOM 0 HD3 LYS A 101 0.497 11.847 1.727 1.00 0.00 H new ATOM 0 HE2 LYS A 101 0.566 14.217 1.841 1.00 0.00 H new ATOM 0 HE3 LYS A 101 -0.791 14.298 2.947 1.00 0.00 H new ATOM 0 HZ1 LYS A 101 1.292 14.709 4.083 1.00 0.00 H new ATOM 0 HZ2 LYS A 101 0.586 13.279 4.667 1.00 0.00 H new ATOM 0 HZ3 LYS A 101 1.900 13.201 3.595 1.00 0.00 H new ATOM 1512 N ASP A 102 -5.281 13.147 0.799 1.00 0.00 N ATOM 1513 CA ASP A 102 -5.838 14.085 -0.169 1.00 0.00 C ATOM 1514 C ASP A 102 -4.734 14.899 -0.835 1.00 0.00 C ATOM 1515 O ASP A 102 -4.403 15.998 -0.390 1.00 0.00 O ATOM 1516 CB ASP A 102 -6.837 15.021 0.514 1.00 0.00 C ATOM 1517 CG ASP A 102 -7.930 14.266 1.245 1.00 0.00 C ATOM 1518 OD1 ASP A 102 -8.292 13.159 0.791 1.00 0.00 O ATOM 1519 OD2 ASP A 102 -8.424 14.780 2.269 1.00 0.00 O ATOM 0 H ASP A 102 -5.604 13.287 1.756 1.00 0.00 H new ATOM 0 HA ASP A 102 -6.355 13.511 -0.938 1.00 0.00 H new ATOM 0 HB2 ASP A 102 -6.307 15.661 1.219 1.00 0.00 H new ATOM 0 HB3 ASP A 102 -7.288 15.674 -0.233 1.00 0.00 H new ATOM 1524 N VAL A 103 -4.167 14.352 -1.906 1.00 0.00 N ATOM 1525 CA VAL A 103 -3.100 15.027 -2.634 1.00 0.00 C ATOM 1526 C VAL A 103 -3.663 15.901 -3.750 1.00 0.00 C ATOM 1527 O VAL A 103 -4.358 15.414 -4.642 1.00 0.00 O ATOM 1528 CB VAL A 103 -2.107 14.018 -3.240 1.00 0.00 C ATOM 1529 CG1 VAL A 103 -0.900 14.738 -3.822 1.00 0.00 C ATOM 1530 CG2 VAL A 103 -1.678 12.999 -2.195 1.00 0.00 C ATOM 0 H VAL A 103 -4.429 13.443 -2.288 1.00 0.00 H new ATOM 0 HA VAL A 103 -2.575 15.655 -1.914 1.00 0.00 H new ATOM 0 HB VAL A 103 -2.607 13.486 -4.050 1.00 0.00 H new ATOM 0 HG11 VAL A 103 -0.210 14.008 -4.245 1.00 0.00 H new ATOM 0 HG12 VAL A 103 -1.227 15.424 -4.604 1.00 0.00 H new ATOM 0 HG13 VAL A 103 -0.396 15.299 -3.035 1.00 0.00 H new ATOM 0 HG21 VAL A 103 -0.976 12.294 -2.641 1.00 0.00 H new ATOM 0 HG22 VAL A 103 -1.197 13.512 -1.362 1.00 0.00 H new ATOM 0 HG23 VAL A 103 -2.553 12.460 -1.832 1.00 0.00 H new ATOM 1540 N GLY A 104 -3.359 17.193 -3.693 1.00 0.00 N ATOM 1541 CA GLY A 104 -3.842 18.114 -4.706 1.00 0.00 C ATOM 1542 C GLY A 104 -5.200 18.695 -4.361 1.00 0.00 C ATOM 1543 O GLY A 104 -5.381 19.912 -4.369 1.00 0.00 O ATOM 0 H GLY A 104 -2.787 17.619 -2.964 1.00 0.00 H new ATOM 0 HA2 GLY A 104 -3.124 18.925 -4.828 1.00 0.00 H new ATOM 0 HA3 GLY A 104 -3.904 17.597 -5.663 1.00 0.00 H new ATOM 1547 N ARG A 105 -6.154 17.822 -4.056 1.00 0.00 N ATOM 1548 CA ARG A 105 -7.502 18.255 -3.707 1.00 0.00 C ATOM 1549 C ARG A 105 -8.142 19.026 -4.857 1.00 0.00 C ATOM 1550 O ARG A 105 -7.724 20.138 -5.181 1.00 0.00 O ATOM 1551 CB ARG A 105 -7.472 19.125 -2.449 1.00 0.00 C ATOM 1552 CG ARG A 105 -7.169 18.346 -1.179 1.00 0.00 C ATOM 1553 CD ARG A 105 -8.105 18.738 -0.046 1.00 0.00 C ATOM 1554 NE ARG A 105 -9.460 18.235 -0.257 1.00 0.00 N ATOM 1555 CZ ARG A 105 -10.534 18.710 0.371 1.00 0.00 C ATOM 1556 NH1 ARG A 105 -10.414 19.699 1.249 1.00 0.00 N ATOM 1557 NH2 ARG A 105 -11.730 18.196 0.120 1.00 0.00 N ATOM 0 H ARG A 105 -6.019 16.811 -4.043 1.00 0.00 H new ATOM 0 HA ARG A 105 -8.102 17.366 -3.511 1.00 0.00 H new ATOM 0 HB2 ARG A 105 -6.722 19.905 -2.575 1.00 0.00 H new ATOM 0 HB3 ARG A 105 -8.435 19.624 -2.339 1.00 0.00 H new ATOM 0 HG2 ARG A 105 -7.262 17.278 -1.376 1.00 0.00 H new ATOM 0 HG3 ARG A 105 -6.137 18.526 -0.878 1.00 0.00 H new ATOM 0 HD2 ARG A 105 -7.717 18.350 0.896 1.00 0.00 H new ATOM 0 HD3 ARG A 105 -8.131 19.824 0.043 1.00 0.00 H new ATOM 0 HE ARG A 105 -9.591 17.475 -0.925 1.00 0.00 H new ATOM 0 HH11 ARG A 105 -9.496 20.098 1.445 1.00 0.00 H new ATOM 0 HH12 ARG A 105 -11.240 20.059 1.727 1.00 0.00 H new ATOM 0 HH21 ARG A 105 -11.828 17.437 -0.554 1.00 0.00 H new ATOM 0 HH22 ARG A 105 -12.553 18.560 0.601 1.00 0.00 H new ATOM 1571 N LEU A 106 -9.159 18.430 -5.471 1.00 0.00 N ATOM 1572 CA LEU A 106 -9.857 19.061 -6.585 1.00 0.00 C ATOM 1573 C LEU A 106 -10.964 19.985 -6.079 1.00 0.00 C ATOM 1574 O LEU A 106 -11.668 19.656 -5.125 1.00 0.00 O ATOM 1575 CB LEU A 106 -10.447 17.994 -7.512 1.00 0.00 C ATOM 1576 CG LEU A 106 -10.300 18.281 -9.007 1.00 0.00 C ATOM 1577 CD1 LEU A 106 -9.990 17.003 -9.770 1.00 0.00 C ATOM 1578 CD2 LEU A 106 -11.562 18.935 -9.551 1.00 0.00 C ATOM 0 H LEU A 106 -9.518 17.510 -5.216 1.00 0.00 H new ATOM 0 HA LEU A 106 -9.137 19.659 -7.144 1.00 0.00 H new ATOM 0 HB2 LEU A 106 -9.969 17.039 -7.292 1.00 0.00 H new ATOM 0 HB3 LEU A 106 -11.506 17.880 -7.282 1.00 0.00 H new ATOM 0 HG LEU A 106 -9.468 18.971 -9.143 1.00 0.00 H new ATOM 0 HD11 LEU A 106 -9.889 17.228 -10.832 1.00 0.00 H new ATOM 0 HD12 LEU A 106 -9.058 16.575 -9.400 1.00 0.00 H new ATOM 0 HD13 LEU A 106 -10.800 16.288 -9.626 1.00 0.00 H new ATOM 0 HD21 LEU A 106 -11.440 19.132 -10.616 1.00 0.00 H new ATOM 0 HD22 LEU A 106 -12.411 18.268 -9.401 1.00 0.00 H new ATOM 0 HD23 LEU A 106 -11.740 19.874 -9.026 1.00 0.00 H new ATOM 1590 N PRO A 107 -11.133 21.159 -6.713 1.00 0.00 N ATOM 1591 CA PRO A 107 -12.161 22.127 -6.317 1.00 0.00 C ATOM 1592 C PRO A 107 -13.567 21.656 -6.674 1.00 0.00 C ATOM 1593 O PRO A 107 -13.765 20.959 -7.668 1.00 0.00 O ATOM 1594 CB PRO A 107 -11.797 23.379 -7.117 1.00 0.00 C ATOM 1595 CG PRO A 107 -11.080 22.863 -8.317 1.00 0.00 C ATOM 1596 CD PRO A 107 -10.337 21.637 -7.862 1.00 0.00 C ATOM 0 HA PRO A 107 -12.179 22.285 -5.239 1.00 0.00 H new ATOM 0 HB2 PRO A 107 -12.687 23.942 -7.399 1.00 0.00 H new ATOM 0 HB3 PRO A 107 -11.165 24.051 -6.536 1.00 0.00 H new ATOM 0 HG2 PRO A 107 -11.781 22.620 -9.116 1.00 0.00 H new ATOM 0 HG3 PRO A 107 -10.393 23.611 -8.712 1.00 0.00 H new ATOM 0 HD2 PRO A 107 -10.279 20.887 -8.651 1.00 0.00 H new ATOM 0 HD3 PRO A 107 -9.313 21.873 -7.571 1.00 0.00 H new ATOM 1604 N HIS A 108 -14.540 22.042 -5.854 1.00 0.00 N ATOM 1605 CA HIS A 108 -15.928 21.658 -6.084 1.00 0.00 C ATOM 1606 C HIS A 108 -16.466 22.302 -7.358 1.00 0.00 C ATOM 1607 O HIS A 108 -16.845 21.610 -8.303 1.00 0.00 O ATOM 1608 CB HIS A 108 -16.797 22.063 -4.891 1.00 0.00 C ATOM 1609 CG HIS A 108 -16.181 21.744 -3.563 1.00 0.00 C ATOM 1610 ND1 HIS A 108 -16.383 20.548 -2.907 1.00 0.00 N ATOM 1611 CD2 HIS A 108 -15.363 22.475 -2.769 1.00 0.00 C ATOM 1612 CE1 HIS A 108 -15.717 20.558 -1.765 1.00 0.00 C ATOM 1613 NE2 HIS A 108 -15.089 21.713 -1.659 1.00 0.00 N ATOM 0 H HIS A 108 -14.393 22.619 -5.026 1.00 0.00 H new ATOM 0 HA HIS A 108 -15.964 20.575 -6.200 1.00 0.00 H new ATOM 0 HB2 HIS A 108 -16.994 23.134 -4.943 1.00 0.00 H new ATOM 0 HB3 HIS A 108 -17.760 21.558 -4.966 1.00 0.00 H new ATOM 0 HD2 HIS A 108 -14.995 23.470 -2.970 1.00 0.00 H new ATOM 0 HE1 HIS A 108 -15.691 19.756 -1.042 1.00 0.00 H new ATOM 0 HE2 HIS A 108 -14.496 21.995 -0.879 1.00 0.00 H new ATOM 1622 N ALA A 109 -16.498 23.631 -7.375 1.00 0.00 N ATOM 1623 CA ALA A 109 -16.990 24.371 -8.531 1.00 0.00 C ATOM 1624 C ALA A 109 -18.472 24.093 -8.771 1.00 0.00 C ATOM 1625 O ALA A 109 -19.331 24.891 -8.395 1.00 0.00 O ATOM 1626 CB ALA A 109 -16.173 24.024 -9.769 1.00 0.00 C ATOM 0 H ALA A 109 -16.189 24.218 -6.600 1.00 0.00 H new ATOM 0 HA ALA A 109 -16.878 25.436 -8.326 1.00 0.00 H new ATOM 0 HB1 ALA A 109 -16.552 24.584 -10.624 1.00 0.00 H new ATOM 0 HB2 ALA A 109 -15.128 24.283 -9.600 1.00 0.00 H new ATOM 0 HB3 ALA A 109 -16.254 22.956 -9.971 1.00 0.00 H new ATOM 1632 N ARG A 110 -18.764 22.957 -9.397 1.00 0.00 N ATOM 1633 CA ARG A 110 -20.142 22.575 -9.682 1.00 0.00 C ATOM 1634 C ARG A 110 -20.721 21.743 -8.544 1.00 0.00 C ATOM 1635 O ARG A 110 -19.987 21.251 -7.687 1.00 0.00 O ATOM 1636 CB ARG A 110 -20.215 21.790 -10.994 1.00 0.00 C ATOM 1637 CG ARG A 110 -19.745 22.579 -12.204 1.00 0.00 C ATOM 1638 CD ARG A 110 -19.744 21.724 -13.461 1.00 0.00 C ATOM 1639 NE ARG A 110 -18.618 22.040 -14.336 1.00 0.00 N ATOM 1640 CZ ARG A 110 -18.479 23.198 -14.978 1.00 0.00 C ATOM 1641 NH1 ARG A 110 -19.393 24.151 -14.845 1.00 0.00 N ATOM 1642 NH2 ARG A 110 -17.425 23.403 -15.754 1.00 0.00 N ATOM 0 H ARG A 110 -18.065 22.286 -9.716 1.00 0.00 H new ATOM 0 HA ARG A 110 -20.733 23.486 -9.779 1.00 0.00 H new ATOM 0 HB2 ARG A 110 -19.610 20.888 -10.902 1.00 0.00 H new ATOM 0 HB3 ARG A 110 -21.243 21.468 -11.158 1.00 0.00 H new ATOM 0 HG2 ARG A 110 -20.394 23.443 -12.351 1.00 0.00 H new ATOM 0 HG3 ARG A 110 -18.741 22.962 -12.022 1.00 0.00 H new ATOM 0 HD2 ARG A 110 -19.703 20.671 -13.183 1.00 0.00 H new ATOM 0 HD3 ARG A 110 -20.678 21.875 -14.003 1.00 0.00 H new ATOM 0 HE ARG A 110 -17.895 21.331 -14.463 1.00 0.00 H new ATOM 0 HH11 ARG A 110 -20.206 23.998 -14.249 1.00 0.00 H new ATOM 0 HH12 ARG A 110 -19.282 25.037 -15.339 1.00 0.00 H new ATOM 0 HH21 ARG A 110 -16.720 22.674 -15.860 1.00 0.00 H new ATOM 0 HH22 ARG A 110 -17.319 24.290 -16.246 1.00 0.00 H new ATOM 1656 N THR A 111 -22.043 21.588 -8.541 1.00 0.00 N ATOM 1657 CA THR A 111 -22.724 20.814 -7.507 1.00 0.00 C ATOM 1658 C THR A 111 -22.679 21.536 -6.164 1.00 0.00 C ATOM 1659 O THR A 111 -23.713 21.935 -5.629 1.00 0.00 O ATOM 1660 CB THR A 111 -22.095 19.425 -7.374 1.00 0.00 C ATOM 1661 OG1 THR A 111 -21.820 18.875 -8.649 1.00 0.00 O ATOM 1662 CG2 THR A 111 -22.970 18.440 -6.628 1.00 0.00 C ATOM 0 H THR A 111 -22.664 21.989 -9.244 1.00 0.00 H new ATOM 0 HA THR A 111 -23.767 20.704 -7.805 1.00 0.00 H new ATOM 0 HB THR A 111 -21.179 19.577 -6.803 1.00 0.00 H new ATOM 0 HG1 THR A 111 -21.417 17.988 -8.543 1.00 0.00 H new ATOM 0 HG21 THR A 111 -22.465 17.476 -6.570 1.00 0.00 H new ATOM 0 HG22 THR A 111 -23.160 18.812 -5.621 1.00 0.00 H new ATOM 0 HG23 THR A 111 -23.917 18.322 -7.155 1.00 0.00 H new ATOM 1670 N THR A 112 -21.475 21.702 -5.624 1.00 0.00 N ATOM 1671 CA THR A 112 -21.295 22.377 -4.342 1.00 0.00 C ATOM 1672 C THR A 112 -21.872 21.543 -3.203 1.00 0.00 C ATOM 1673 O THR A 112 -23.086 21.489 -3.013 1.00 0.00 O ATOM 1674 CB THR A 112 -21.955 23.757 -4.366 1.00 0.00 C ATOM 1675 OG1 THR A 112 -21.631 24.448 -5.559 1.00 0.00 O ATOM 1676 CG2 THR A 112 -21.549 24.636 -3.202 1.00 0.00 C ATOM 0 H THR A 112 -20.609 21.378 -6.054 1.00 0.00 H new ATOM 0 HA THR A 112 -20.225 22.500 -4.174 1.00 0.00 H new ATOM 0 HB THR A 112 -23.026 23.565 -4.299 1.00 0.00 H new ATOM 0 HG1 THR A 112 -22.064 25.327 -5.556 1.00 0.00 H new ATOM 0 HG21 THR A 112 -22.053 25.599 -3.280 1.00 0.00 H new ATOM 0 HG22 THR A 112 -21.831 24.154 -2.266 1.00 0.00 H new ATOM 0 HG23 THR A 112 -20.470 24.788 -3.220 1.00 0.00 H new ATOM 1684 N VAL A 113 -20.991 20.893 -2.447 1.00 0.00 N ATOM 1685 CA VAL A 113 -21.412 20.062 -1.327 1.00 0.00 C ATOM 1686 C VAL A 113 -21.747 20.911 -0.106 1.00 0.00 C ATOM 1687 O VAL A 113 -21.187 21.990 0.084 1.00 0.00 O ATOM 1688 CB VAL A 113 -20.324 19.042 -0.945 1.00 0.00 C ATOM 1689 CG1 VAL A 113 -20.109 18.042 -2.070 1.00 0.00 C ATOM 1690 CG2 VAL A 113 -19.024 19.752 -0.598 1.00 0.00 C ATOM 0 H VAL A 113 -19.982 20.927 -2.591 1.00 0.00 H new ATOM 0 HA VAL A 113 -22.305 19.527 -1.650 1.00 0.00 H new ATOM 0 HB VAL A 113 -20.659 18.495 -0.064 1.00 0.00 H new ATOM 0 HG11 VAL A 113 -19.336 17.330 -1.781 1.00 0.00 H new ATOM 0 HG12 VAL A 113 -21.039 17.509 -2.266 1.00 0.00 H new ATOM 0 HG13 VAL A 113 -19.797 18.570 -2.971 1.00 0.00 H new ATOM 0 HG21 VAL A 113 -18.267 19.015 -0.331 1.00 0.00 H new ATOM 0 HG22 VAL A 113 -18.683 20.327 -1.459 1.00 0.00 H new ATOM 0 HG23 VAL A 113 -19.190 20.424 0.244 1.00 0.00 H new ATOM 1700 N ASP A 114 -22.664 20.416 0.720 1.00 0.00 N ATOM 1701 CA ASP A 114 -23.074 21.130 1.924 1.00 0.00 C ATOM 1702 C ASP A 114 -23.775 20.190 2.899 1.00 0.00 C ATOM 1703 O ASP A 114 -24.872 19.702 2.628 1.00 0.00 O ATOM 1704 CB ASP A 114 -24.001 22.291 1.563 1.00 0.00 C ATOM 1705 CG ASP A 114 -25.195 21.846 0.741 1.00 0.00 C ATOM 1706 OD1 ASP A 114 -25.026 21.616 -0.476 1.00 0.00 O ATOM 1707 OD2 ASP A 114 -26.298 21.726 1.314 1.00 0.00 O ATOM 0 H ASP A 114 -23.137 19.524 0.577 1.00 0.00 H new ATOM 0 HA ASP A 114 -22.179 21.525 2.405 1.00 0.00 H new ATOM 0 HB2 ASP A 114 -24.351 22.770 2.477 1.00 0.00 H new ATOM 0 HB3 ASP A 114 -23.439 23.041 1.006 1.00 0.00 H new ATOM 1712 N GLU A 115 -23.133 19.940 4.037 1.00 0.00 N ATOM 1713 CA GLU A 115 -23.695 19.059 5.054 1.00 0.00 C ATOM 1714 C GLU A 115 -25.043 19.580 5.542 1.00 0.00 C ATOM 1715 O GLU A 115 -25.115 20.319 6.524 1.00 0.00 O ATOM 1716 CB GLU A 115 -22.729 18.926 6.232 1.00 0.00 C ATOM 1717 CG GLU A 115 -22.672 17.524 6.817 1.00 0.00 C ATOM 1718 CD GLU A 115 -21.554 17.359 7.828 1.00 0.00 C ATOM 1719 OE1 GLU A 115 -20.476 17.957 7.625 1.00 0.00 O ATOM 1720 OE2 GLU A 115 -21.755 16.632 8.824 1.00 0.00 O ATOM 0 H GLU A 115 -22.224 20.335 4.277 1.00 0.00 H new ATOM 0 HA GLU A 115 -23.847 18.078 4.605 1.00 0.00 H new ATOM 0 HB2 GLU A 115 -21.730 19.216 5.906 1.00 0.00 H new ATOM 0 HB3 GLU A 115 -23.025 19.625 7.014 1.00 0.00 H new ATOM 0 HG2 GLU A 115 -23.625 17.294 7.294 1.00 0.00 H new ATOM 0 HG3 GLU A 115 -22.537 16.803 6.011 1.00 0.00 H new ATOM 1727 N THR A 116 -26.109 19.190 4.851 1.00 0.00 N ATOM 1728 CA THR A 116 -27.455 19.617 5.214 1.00 0.00 C ATOM 1729 C THR A 116 -28.170 18.535 6.016 1.00 0.00 C ATOM 1730 O THR A 116 -29.391 18.396 5.937 1.00 0.00 O ATOM 1731 CB THR A 116 -28.260 19.956 3.959 1.00 0.00 C ATOM 1732 OG1 THR A 116 -29.550 20.429 4.304 1.00 0.00 O ATOM 1733 CG2 THR A 116 -28.438 18.778 3.026 1.00 0.00 C ATOM 0 H THR A 116 -26.067 18.578 4.036 1.00 0.00 H new ATOM 0 HA THR A 116 -27.373 20.509 5.835 1.00 0.00 H new ATOM 0 HB THR A 116 -27.682 20.723 3.443 1.00 0.00 H new ATOM 0 HG1 THR A 116 -29.917 19.879 5.027 1.00 0.00 H new ATOM 0 HG21 THR A 116 -29.018 19.087 2.156 1.00 0.00 H new ATOM 0 HG22 THR A 116 -27.461 18.419 2.702 1.00 0.00 H new ATOM 0 HG23 THR A 116 -28.964 17.978 3.547 1.00 0.00 H new ATOM 1741 N LYS A 117 -27.403 17.772 6.787 1.00 0.00 N ATOM 1742 CA LYS A 117 -27.964 16.703 7.604 1.00 0.00 C ATOM 1743 C LYS A 117 -27.348 16.704 8.999 1.00 0.00 C ATOM 1744 O LYS A 117 -26.233 16.220 9.196 1.00 0.00 O ATOM 1745 CB LYS A 117 -27.735 15.347 6.934 1.00 0.00 C ATOM 1746 CG LYS A 117 -28.887 14.372 7.121 1.00 0.00 C ATOM 1747 CD LYS A 117 -30.142 14.846 6.405 1.00 0.00 C ATOM 1748 CE LYS A 117 -31.185 15.357 7.387 1.00 0.00 C ATOM 1749 NZ LYS A 117 -31.918 16.539 6.855 1.00 0.00 N ATOM 0 H LYS A 117 -26.391 17.874 6.863 1.00 0.00 H new ATOM 0 HA LYS A 117 -29.036 16.877 7.700 1.00 0.00 H new ATOM 0 HB2 LYS A 117 -27.570 15.501 5.868 1.00 0.00 H new ATOM 0 HB3 LYS A 117 -26.825 14.902 7.336 1.00 0.00 H new ATOM 0 HG2 LYS A 117 -28.600 13.391 6.742 1.00 0.00 H new ATOM 0 HG3 LYS A 117 -29.096 14.254 8.184 1.00 0.00 H new ATOM 0 HD2 LYS A 117 -29.884 15.638 5.702 1.00 0.00 H new ATOM 0 HD3 LYS A 117 -30.561 14.026 5.822 1.00 0.00 H new ATOM 0 HE2 LYS A 117 -31.895 14.560 7.610 1.00 0.00 H new ATOM 0 HE3 LYS A 117 -30.700 15.623 8.326 1.00 0.00 H new ATOM 0 HZ1 LYS A 117 -32.495 16.959 7.611 1.00 0.00 H new ATOM 0 HZ2 LYS A 117 -31.236 17.243 6.508 1.00 0.00 H new ATOM 0 HZ3 LYS A 117 -32.536 16.241 6.073 1.00 0.00 H new ATOM 1763 N TRP A 118 -28.080 17.250 9.964 1.00 0.00 N ATOM 1764 CA TRP A 118 -27.605 17.313 11.342 1.00 0.00 C ATOM 1765 C TRP A 118 -28.762 17.166 12.325 1.00 0.00 C ATOM 1766 O TRP A 118 -29.901 16.922 11.926 1.00 0.00 O ATOM 1767 CB TRP A 118 -26.871 18.633 11.589 1.00 0.00 C ATOM 1768 CG TRP A 118 -25.381 18.485 11.635 1.00 0.00 C ATOM 1769 CD1 TRP A 118 -24.670 17.568 12.353 1.00 0.00 C ATOM 1770 CD2 TRP A 118 -24.419 19.280 10.931 1.00 0.00 C ATOM 1771 NE1 TRP A 118 -23.323 17.742 12.140 1.00 0.00 N ATOM 1772 CE2 TRP A 118 -23.144 18.787 11.271 1.00 0.00 C ATOM 1773 CE3 TRP A 118 -24.510 20.358 10.047 1.00 0.00 C ATOM 1774 CZ2 TRP A 118 -21.972 19.337 10.758 1.00 0.00 C ATOM 1775 CZ3 TRP A 118 -23.346 20.903 9.538 1.00 0.00 C ATOM 1776 CH2 TRP A 118 -22.092 20.391 9.894 1.00 0.00 C ATOM 0 H TRP A 118 -29.004 17.655 9.818 1.00 0.00 H new ATOM 0 HA TRP A 118 -26.913 16.486 11.501 1.00 0.00 H new ATOM 0 HB2 TRP A 118 -27.134 19.340 10.802 1.00 0.00 H new ATOM 0 HB3 TRP A 118 -27.216 19.061 12.530 1.00 0.00 H new ATOM 0 HD1 TRP A 118 -25.103 16.815 12.995 1.00 0.00 H new ATOM 0 HE1 TRP A 118 -22.579 17.185 12.560 1.00 0.00 H new ATOM 0 HE3 TRP A 118 -25.473 20.759 9.766 1.00 0.00 H new ATOM 0 HZ2 TRP A 118 -21.003 18.946 11.032 1.00 0.00 H new ATOM 0 HZ3 TRP A 118 -23.405 21.737 8.855 1.00 0.00 H new ATOM 0 HH2 TRP A 118 -21.201 20.838 9.478 1.00 0.00 H new ATOM 1787 N ILE A 119 -28.462 17.316 13.610 1.00 0.00 N ATOM 1788 CA ILE A 119 -29.476 17.199 14.651 1.00 0.00 C ATOM 1789 C ILE A 119 -29.449 18.406 15.582 1.00 0.00 C ATOM 1790 O ILE A 119 -28.597 18.503 16.465 1.00 0.00 O ATOM 1791 CB ILE A 119 -29.284 15.918 15.485 1.00 0.00 C ATOM 1792 CG1 ILE A 119 -27.825 15.783 15.926 1.00 0.00 C ATOM 1793 CG2 ILE A 119 -29.717 14.698 14.687 1.00 0.00 C ATOM 1794 CD1 ILE A 119 -27.668 15.290 17.347 1.00 0.00 C ATOM 0 H ILE A 119 -27.524 17.519 13.956 1.00 0.00 H new ATOM 0 HA ILE A 119 -30.441 17.152 14.146 1.00 0.00 H new ATOM 0 HB ILE A 119 -29.908 15.986 16.376 1.00 0.00 H new ATOM 0 HG12 ILE A 119 -27.312 15.096 15.253 1.00 0.00 H new ATOM 0 HG13 ILE A 119 -27.333 16.751 15.829 1.00 0.00 H new ATOM 0 HG21 ILE A 119 -29.576 13.800 15.289 1.00 0.00 H new ATOM 0 HG22 ILE A 119 -30.769 14.793 14.419 1.00 0.00 H new ATOM 0 HG23 ILE A 119 -29.117 14.625 13.780 1.00 0.00 H new ATOM 0 HD11 ILE A 119 -26.608 15.218 17.592 1.00 0.00 H new ATOM 0 HD12 ILE A 119 -28.152 15.988 18.030 1.00 0.00 H new ATOM 0 HD13 ILE A 119 -28.130 14.308 17.445 1.00 0.00 H new ATOM 1806 N ALA A 120 -30.387 19.326 15.379 1.00 0.00 N ATOM 1807 CA ALA A 120 -30.470 20.528 16.200 1.00 0.00 C ATOM 1808 C ALA A 120 -31.896 21.066 16.242 1.00 0.00 C ATOM 1809 O ALA A 120 -32.615 21.028 15.244 1.00 0.00 O ATOM 1810 CB ALA A 120 -29.517 21.591 15.676 1.00 0.00 C ATOM 0 H ALA A 120 -31.100 19.262 14.653 1.00 0.00 H new ATOM 0 HA ALA A 120 -30.179 20.265 17.217 1.00 0.00 H new ATOM 0 HB1 ALA A 120 -29.589 22.483 16.298 1.00 0.00 H new ATOM 0 HB2 ALA A 120 -28.496 21.210 15.705 1.00 0.00 H new ATOM 0 HB3 ALA A 120 -29.782 21.843 14.649 1.00 0.00 H new ATOM 1816 N SER A 121 -32.298 21.568 17.404 1.00 0.00 N ATOM 1817 CA SER A 121 -33.639 22.116 17.578 1.00 0.00 C ATOM 1818 C SER A 121 -34.700 21.050 17.326 1.00 0.00 C ATOM 1819 O SER A 121 -34.446 20.052 16.651 1.00 0.00 O ATOM 1820 CB SER A 121 -33.855 23.299 16.633 1.00 0.00 C ATOM 1821 OG SER A 121 -32.664 24.052 16.478 1.00 0.00 O ATOM 0 H SER A 121 -31.715 21.607 18.240 1.00 0.00 H new ATOM 0 HA SER A 121 -33.733 22.460 18.608 1.00 0.00 H new ATOM 0 HB2 SER A 121 -34.188 22.936 15.661 1.00 0.00 H new ATOM 0 HB3 SER A 121 -34.646 23.940 17.022 1.00 0.00 H new ATOM 0 HG SER A 121 -32.828 24.801 15.868 1.00 0.00 H new ATOM 1827 N SER A 122 -35.891 21.268 17.875 1.00 0.00 N ATOM 1828 CA SER A 122 -36.994 20.328 17.711 1.00 0.00 C ATOM 1829 C SER A 122 -38.313 20.961 18.141 1.00 0.00 C ATOM 1830 O SER A 122 -38.473 21.366 19.293 1.00 0.00 O ATOM 1831 CB SER A 122 -36.733 19.057 18.523 1.00 0.00 C ATOM 1832 OG SER A 122 -36.383 17.974 17.677 1.00 0.00 O ATOM 0 H SER A 122 -36.117 22.088 18.438 1.00 0.00 H new ATOM 0 HA SER A 122 -37.065 20.066 16.655 1.00 0.00 H new ATOM 0 HB2 SER A 122 -35.931 19.237 19.239 1.00 0.00 H new ATOM 0 HB3 SER A 122 -37.622 18.800 19.099 1.00 0.00 H new ATOM 0 HG SER A 122 -35.665 18.251 17.071 1.00 0.00 H new ATOM 1838 N SER A 123 -39.256 21.044 17.209 1.00 0.00 N ATOM 1839 CA SER A 123 -40.561 21.629 17.491 1.00 0.00 C ATOM 1840 C SER A 123 -41.632 20.549 17.593 1.00 0.00 C ATOM 1841 O SER A 123 -41.384 19.383 17.289 1.00 0.00 O ATOM 1842 CB SER A 123 -40.938 22.636 16.403 1.00 0.00 C ATOM 1843 OG SER A 123 -39.942 23.633 16.263 1.00 0.00 O ATOM 0 H SER A 123 -39.141 20.713 16.251 1.00 0.00 H new ATOM 0 HA SER A 123 -40.500 22.145 18.449 1.00 0.00 H new ATOM 0 HB2 SER A 123 -41.073 22.117 15.454 1.00 0.00 H new ATOM 0 HB3 SER A 123 -41.892 23.103 16.650 1.00 0.00 H new ATOM 0 HG SER A 123 -40.206 24.263 15.560 1.00 0.00 H new ATOM 1849 N GLY A 124 -42.826 20.946 18.024 1.00 0.00 N ATOM 1850 CA GLY A 124 -43.918 20.002 18.158 1.00 0.00 C ATOM 1851 C GLY A 124 -45.051 20.543 19.012 1.00 0.00 C ATOM 1852 O GLY A 124 -45.902 21.282 18.517 1.00 0.00 O ATOM 0 H GLY A 124 -43.055 21.906 18.283 1.00 0.00 H new ATOM 0 HA2 GLY A 124 -44.301 19.751 17.169 1.00 0.00 H new ATOM 0 HA3 GLY A 124 -43.544 19.078 18.599 1.00 0.00 H new ATOM 1856 N PRO A 125 -45.091 20.193 20.310 1.00 0.00 N ATOM 1857 CA PRO A 125 -46.140 20.662 21.222 1.00 0.00 C ATOM 1858 C PRO A 125 -46.259 22.182 21.232 1.00 0.00 C ATOM 1859 O PRO A 125 -47.339 22.729 21.458 1.00 0.00 O ATOM 1860 CB PRO A 125 -45.682 20.154 22.591 1.00 0.00 C ATOM 1861 CG PRO A 125 -44.799 18.993 22.291 1.00 0.00 C ATOM 1862 CD PRO A 125 -44.120 19.316 20.991 1.00 0.00 C ATOM 0 HA PRO A 125 -47.125 20.299 20.928 1.00 0.00 H new ATOM 0 HB2 PRO A 125 -45.145 20.927 23.140 1.00 0.00 H new ATOM 0 HB3 PRO A 125 -46.531 19.857 23.207 1.00 0.00 H new ATOM 0 HG2 PRO A 125 -44.069 18.842 23.086 1.00 0.00 H new ATOM 0 HG3 PRO A 125 -45.378 18.073 22.211 1.00 0.00 H new ATOM 0 HD2 PRO A 125 -43.166 19.819 21.149 1.00 0.00 H new ATOM 0 HD3 PRO A 125 -43.914 18.417 20.410 1.00 0.00 H new ATOM 1870 N SER A 126 -45.141 22.859 20.985 1.00 0.00 N ATOM 1871 CA SER A 126 -45.119 24.318 20.968 1.00 0.00 C ATOM 1872 C SER A 126 -45.617 24.854 19.629 1.00 0.00 C ATOM 1873 O SER A 126 -46.445 25.763 19.583 1.00 0.00 O ATOM 1874 CB SER A 126 -43.705 24.830 21.241 1.00 0.00 C ATOM 1875 OG SER A 126 -42.960 23.893 22.001 1.00 0.00 O ATOM 0 H SER A 126 -44.240 22.421 20.794 1.00 0.00 H new ATOM 0 HA SER A 126 -45.785 24.676 21.753 1.00 0.00 H new ATOM 0 HB2 SER A 126 -43.196 25.023 20.297 1.00 0.00 H new ATOM 0 HB3 SER A 126 -43.755 25.778 21.776 1.00 0.00 H new ATOM 0 HG SER A 126 -42.059 24.244 22.160 1.00 0.00 H new ATOM 1881 N SER A 127 -45.106 24.284 18.542 1.00 0.00 N ATOM 1882 CA SER A 127 -45.500 24.706 17.202 1.00 0.00 C ATOM 1883 C SER A 127 -47.001 24.528 16.993 1.00 0.00 C ATOM 1884 O SER A 127 -47.597 23.573 17.489 1.00 0.00 O ATOM 1885 CB SER A 127 -44.729 23.910 16.147 1.00 0.00 C ATOM 1886 OG SER A 127 -43.463 24.493 15.893 1.00 0.00 O ATOM 0 H SER A 127 -44.419 23.530 18.563 1.00 0.00 H new ATOM 0 HA SER A 127 -45.260 25.764 17.097 1.00 0.00 H new ATOM 0 HB2 SER A 127 -44.598 22.882 16.486 1.00 0.00 H new ATOM 0 HB3 SER A 127 -45.306 23.870 15.223 1.00 0.00 H new ATOM 0 HG SER A 127 -43.050 24.054 15.120 1.00 0.00 H new ATOM 1892 N GLY A 128 -47.603 25.455 16.256 1.00 0.00 N ATOM 1893 CA GLY A 128 -49.029 25.384 15.996 1.00 0.00 C ATOM 1894 C GLY A 128 -49.589 26.690 15.468 1.00 0.00 C ATOM 1895 O GLY A 128 -49.645 27.668 16.243 1.00 0.00 O ATOM 1896 OXT GLY A 128 -49.970 26.736 14.279 1.00 0.00 O ATOM 0 H GLY A 128 -47.129 26.254 15.834 1.00 0.00 H new ATOM 0 HA2 GLY A 128 -49.224 24.591 15.275 1.00 0.00 H new ATOM 0 HA3 GLY A 128 -49.550 25.114 16.915 1.00 0.00 H new TER 1900 GLY A 128