USER MOD reduce.3.24.130724 H: found=0, std=0, add=788, rem=0, adj=35 USER MOD reduce.3.24.130724 removed 784 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 82 TYR OH : rot 30:sc= 1.07 USER MOD Set 1.2: A 97 LYS NZ :NH3+ 142:sc= 1.1 (180deg=-0.472) USER MOD Set 2.1: A 9 TYR OH : rot 180:sc= 0 USER MOD Set 2.2: A 10 GLN : amide:sc= -1.66 K(o=-1.7,f=-5.3!) USER MOD Single : A 1 THR N :NH3+ -177:sc= 0 (180deg=-0.00708) USER MOD Single : A 1 THR OG1 : rot 180:sc= 0 USER MOD Single : A 2 SER OG : rot 180:sc= 0 USER MOD Single : A 3 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 5 THR OG1 : rot 180:sc= 0 USER MOD Single : A 7 THR OG1 : rot 180:sc= -0.414 USER MOD Single : A 8 HIS : no HD1:sc= -0.0521 X(o=-0.052,f=-0.003) USER MOD Single : A 12 GLN : amide:sc= -1.14 X(o=-1.1,f=-1.2) USER MOD Single : A 14 ASN : amide:sc= -0.356 K(o=-0.36,f=-5.9!) USER MOD Single : A 15 SER OG : rot -59:sc= 0.249 USER MOD Single : A 19 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 20 THR OG1 : rot 180:sc= 0 USER MOD Single : A 22 THR OG1 : rot 43:sc= 0.725 USER MOD Single : A 28 SER OG : rot -46:sc= 0.304 USER MOD Single : A 30 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 34 MET CE :methyl -135:sc= -0.498 (180deg=-3.88!) USER MOD Single : A 35 THR OG1 : rot 180:sc= 0 USER MOD Single : A 38 MET CE :methyl -125:sc= -0.237 (180deg=-1.33) USER MOD Single : A 41 THR OG1 : rot 180:sc= 0 USER MOD Single : A 42 SER OG : rot 180:sc= 0 USER MOD Single : A 43 SER OG : rot 180:sc= 0 USER MOD Single : A 45 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 52 THR OG1 : rot 180:sc= 0 USER MOD Single : A 53 THR OG1 : rot 138:sc= 0.788 USER MOD Single : A 67 GLN :FLIP amide:sc= -1.67 F(o=-2.9!,f=-1.7) USER MOD Single : A 68 THR OG1 : rot -29:sc= 0.391 USER MOD Single : A 69 SER OG : rot -109:sc= -1.55! USER MOD Single : A 70 THR OG1 : rot -36:sc= 0.399 USER MOD Single : A 71 THR OG1 : rot -6:sc= 0.968 USER MOD Single : A 73 THR OG1 : rot 180:sc= 0 USER MOD Single : A 75 TYR OH : rot 180:sc= 0 USER MOD Single : A 76 LYS NZ :NH3+ -155:sc= 1.26 (180deg=0.697) USER MOD Single : A 77 SER OG : rot -16:sc= 0.00221 USER MOD Single : A 79 THR OG1 : rot 180:sc= 0 USER MOD Single : A 92 SER OG : rot 180:sc= 0 USER MOD Single : A 95 THR OG1 : rot 180:sc= 0 USER MOD Single : A 96 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 99 THR OG1 : rot 76:sc= 0.399 USER MOD Single : A 104 THR OG1 : rot -57:sc= 0.618 USER MOD Single : A 107 SER OG : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N THR A 1 3.946 -59.247 -6.548 1.00 0.00 N ATOM 2 CA THR A 1 2.740 -58.743 -5.904 1.00 0.00 C ATOM 3 C THR A 1 2.180 -57.538 -6.650 1.00 0.00 C ATOM 4 O THR A 1 0.980 -57.460 -6.912 1.00 0.00 O ATOM 5 CB THR A 1 3.009 -58.346 -4.440 1.00 0.00 C ATOM 6 OG1 THR A 1 3.529 -59.467 -3.716 1.00 0.00 O ATOM 7 CG2 THR A 1 1.737 -57.850 -3.771 1.00 0.00 C ATOM 0 H1 THR A 1 4.277 -60.097 -6.049 1.00 0.00 H new ATOM 0 H2 THR A 1 3.737 -59.486 -7.538 1.00 0.00 H new ATOM 0 H3 THR A 1 4.687 -58.518 -6.517 1.00 0.00 H new ATOM 0 HA THR A 1 2.009 -59.552 -5.926 1.00 0.00 H new ATOM 0 HB THR A 1 3.742 -57.539 -4.435 1.00 0.00 H new ATOM 0 HG1 THR A 1 3.699 -59.206 -2.787 1.00 0.00 H new ATOM 0 HG21 THR A 1 1.952 -57.576 -2.738 1.00 0.00 H new ATOM 0 HG22 THR A 1 1.360 -56.979 -4.307 1.00 0.00 H new ATOM 0 HG23 THR A 1 0.986 -58.639 -3.788 1.00 0.00 H new ATOM 15 N SER A 2 3.057 -56.600 -6.992 1.00 0.00 N ATOM 16 CA SER A 2 2.649 -55.396 -7.707 1.00 0.00 C ATOM 17 C SER A 2 3.865 -54.572 -8.121 1.00 0.00 C ATOM 18 O SER A 2 4.883 -54.554 -7.429 1.00 0.00 O ATOM 19 CB SER A 2 1.719 -54.551 -6.836 1.00 0.00 C ATOM 20 OG SER A 2 1.511 -53.270 -7.404 1.00 0.00 O ATOM 0 H SER A 2 4.055 -56.650 -6.786 1.00 0.00 H new ATOM 0 HA SER A 2 2.115 -55.701 -8.607 1.00 0.00 H new ATOM 0 HB2 SER A 2 0.762 -55.060 -6.720 1.00 0.00 H new ATOM 0 HB3 SER A 2 2.147 -54.445 -5.839 1.00 0.00 H new ATOM 0 HG SER A 2 0.912 -52.750 -6.829 1.00 0.00 H new ATOM 26 N LYS A 3 3.751 -53.889 -9.255 1.00 0.00 N ATOM 27 CA LYS A 3 4.838 -53.061 -9.763 1.00 0.00 C ATOM 28 C LYS A 3 4.542 -51.581 -9.545 1.00 0.00 C ATOM 29 O LYS A 3 4.580 -50.786 -10.484 1.00 0.00 O ATOM 30 CB LYS A 3 5.061 -53.333 -11.252 1.00 0.00 C ATOM 31 CG LYS A 3 5.831 -54.613 -11.528 1.00 0.00 C ATOM 32 CD LYS A 3 4.971 -55.843 -11.292 1.00 0.00 C ATOM 33 CE LYS A 3 5.581 -57.080 -11.933 1.00 0.00 C ATOM 34 NZ LYS A 3 6.569 -57.741 -11.036 1.00 0.00 N ATOM 0 H LYS A 3 2.916 -53.893 -9.840 1.00 0.00 H new ATOM 0 HA LYS A 3 5.744 -53.317 -9.213 1.00 0.00 H new ATOM 0 HB2 LYS A 3 4.094 -53.386 -11.752 1.00 0.00 H new ATOM 0 HB3 LYS A 3 5.600 -52.493 -11.689 1.00 0.00 H new ATOM 0 HG2 LYS A 3 6.187 -54.609 -12.558 1.00 0.00 H new ATOM 0 HG3 LYS A 3 6.711 -54.655 -10.886 1.00 0.00 H new ATOM 0 HD2 LYS A 3 4.854 -56.007 -10.221 1.00 0.00 H new ATOM 0 HD3 LYS A 3 3.974 -55.675 -11.699 1.00 0.00 H new ATOM 0 HE2 LYS A 3 4.790 -57.786 -12.184 1.00 0.00 H new ATOM 0 HE3 LYS A 3 6.068 -56.802 -12.867 1.00 0.00 H new ATOM 0 HZ1 LYS A 3 6.961 -58.579 -11.510 1.00 0.00 H new ATOM 0 HZ2 LYS A 3 7.338 -57.076 -10.816 1.00 0.00 H new ATOM 0 HZ3 LYS A 3 6.099 -58.030 -10.155 1.00 0.00 H new ATOM 48 N GLU A 4 4.249 -51.218 -8.300 1.00 0.00 N ATOM 49 CA GLU A 4 3.947 -49.832 -7.960 1.00 0.00 C ATOM 50 C GLU A 4 4.536 -49.465 -6.601 1.00 0.00 C ATOM 51 O GLU A 4 5.004 -50.330 -5.859 1.00 0.00 O ATOM 52 CB GLU A 4 2.434 -49.604 -7.951 1.00 0.00 C ATOM 53 CG GLU A 4 2.036 -48.152 -8.161 1.00 0.00 C ATOM 54 CD GLU A 4 0.646 -48.008 -8.749 1.00 0.00 C ATOM 55 OE1 GLU A 4 -0.261 -48.751 -8.320 1.00 0.00 O ATOM 56 OE2 GLU A 4 0.466 -47.151 -9.640 1.00 0.00 O ATOM 0 H GLU A 4 4.214 -51.863 -7.511 1.00 0.00 H new ATOM 0 HA GLU A 4 4.399 -49.192 -8.718 1.00 0.00 H new ATOM 0 HB2 GLU A 4 1.979 -50.213 -8.732 1.00 0.00 H new ATOM 0 HB3 GLU A 4 2.029 -49.949 -7.000 1.00 0.00 H new ATOM 0 HG2 GLU A 4 2.080 -47.626 -7.208 1.00 0.00 H new ATOM 0 HG3 GLU A 4 2.758 -47.673 -8.823 1.00 0.00 H new ATOM 63 N THR A 5 4.509 -48.175 -6.280 1.00 0.00 N ATOM 64 CA THR A 5 5.041 -47.692 -5.012 1.00 0.00 C ATOM 65 C THR A 5 4.195 -46.550 -4.460 1.00 0.00 C ATOM 66 O THR A 5 3.759 -45.671 -5.204 1.00 0.00 O ATOM 67 CB THR A 5 6.497 -47.212 -5.160 1.00 0.00 C ATOM 68 OG1 THR A 5 7.146 -47.932 -6.214 1.00 0.00 O ATOM 69 CG2 THR A 5 7.265 -47.404 -3.860 1.00 0.00 C ATOM 0 H THR A 5 4.124 -47.446 -6.881 1.00 0.00 H new ATOM 0 HA THR A 5 5.012 -48.531 -4.317 1.00 0.00 H new ATOM 0 HB THR A 5 6.483 -46.149 -5.402 1.00 0.00 H new ATOM 0 HG1 THR A 5 8.071 -47.620 -6.302 1.00 0.00 H new ATOM 0 HG21 THR A 5 8.291 -47.058 -3.989 1.00 0.00 H new ATOM 0 HG22 THR A 5 6.786 -46.831 -3.066 1.00 0.00 H new ATOM 0 HG23 THR A 5 7.269 -48.461 -3.593 1.00 0.00 H new ATOM 77 N PHE A 6 3.966 -46.568 -3.151 1.00 0.00 N ATOM 78 CA PHE A 6 3.171 -45.534 -2.500 1.00 0.00 C ATOM 79 C PHE A 6 3.291 -45.631 -0.982 1.00 0.00 C ATOM 80 O PHE A 6 3.194 -46.716 -0.407 1.00 0.00 O ATOM 81 CB PHE A 6 1.703 -45.651 -2.915 1.00 0.00 C ATOM 82 CG PHE A 6 0.745 -45.121 -1.887 1.00 0.00 C ATOM 83 CD1 PHE A 6 0.507 -43.760 -1.780 1.00 0.00 C ATOM 84 CD2 PHE A 6 0.082 -45.983 -1.029 1.00 0.00 C ATOM 85 CE1 PHE A 6 -0.374 -43.269 -0.835 1.00 0.00 C ATOM 86 CE2 PHE A 6 -0.800 -45.498 -0.082 1.00 0.00 C ATOM 87 CZ PHE A 6 -1.029 -44.139 0.015 1.00 0.00 C ATOM 0 H PHE A 6 4.320 -47.287 -2.520 1.00 0.00 H new ATOM 0 HA PHE A 6 3.554 -44.564 -2.816 1.00 0.00 H new ATOM 0 HB2 PHE A 6 1.554 -45.112 -3.851 1.00 0.00 H new ATOM 0 HB3 PHE A 6 1.471 -46.698 -3.110 1.00 0.00 H new ATOM 0 HD1 PHE A 6 1.016 -43.075 -2.442 1.00 0.00 H new ATOM 0 HD2 PHE A 6 0.256 -47.046 -1.101 1.00 0.00 H new ATOM 0 HE1 PHE A 6 -0.550 -42.206 -0.761 1.00 0.00 H new ATOM 0 HE2 PHE A 6 -1.310 -46.181 0.582 1.00 0.00 H new ATOM 0 HZ PHE A 6 -1.718 -43.758 0.754 1.00 0.00 H new ATOM 97 N THR A 7 3.503 -44.489 -0.336 1.00 0.00 N ATOM 98 CA THR A 7 3.638 -44.444 1.115 1.00 0.00 C ATOM 99 C THR A 7 3.307 -43.057 1.655 1.00 0.00 C ATOM 100 O THR A 7 3.179 -42.097 0.894 1.00 0.00 O ATOM 101 CB THR A 7 5.062 -44.829 1.558 1.00 0.00 C ATOM 102 OG1 THR A 7 5.177 -44.720 2.981 1.00 0.00 O ATOM 103 CG2 THR A 7 6.097 -43.937 0.890 1.00 0.00 C ATOM 0 H THR A 7 3.585 -43.582 -0.795 1.00 0.00 H new ATOM 0 HA THR A 7 2.931 -45.167 1.521 1.00 0.00 H new ATOM 0 HB THR A 7 5.247 -45.860 1.256 1.00 0.00 H new ATOM 0 HG1 THR A 7 6.084 -44.968 3.256 1.00 0.00 H new ATOM 0 HG21 THR A 7 7.095 -44.228 1.219 1.00 0.00 H new ATOM 0 HG22 THR A 7 6.026 -44.044 -0.192 1.00 0.00 H new ATOM 0 HG23 THR A 7 5.913 -42.898 1.164 1.00 0.00 H new ATOM 111 N HIS A 8 3.170 -42.958 2.973 1.00 0.00 N ATOM 112 CA HIS A 8 2.856 -41.687 3.616 1.00 0.00 C ATOM 113 C HIS A 8 3.905 -40.633 3.277 1.00 0.00 C ATOM 114 O HIS A 8 5.022 -40.961 2.875 1.00 0.00 O ATOM 115 CB HIS A 8 2.767 -41.866 5.132 1.00 0.00 C ATOM 116 CG HIS A 8 1.520 -42.565 5.580 1.00 0.00 C ATOM 117 ND1 HIS A 8 1.429 -43.249 6.774 1.00 0.00 N ATOM 118 CD2 HIS A 8 0.309 -42.683 4.988 1.00 0.00 C ATOM 119 CE1 HIS A 8 0.216 -43.758 6.896 1.00 0.00 C ATOM 120 NE2 HIS A 8 -0.483 -43.429 5.825 1.00 0.00 N ATOM 0 H HIS A 8 3.271 -43.743 3.617 1.00 0.00 H new ATOM 0 HA HIS A 8 1.891 -41.347 3.241 1.00 0.00 H new ATOM 0 HB2 HIS A 8 3.634 -42.431 5.474 1.00 0.00 H new ATOM 0 HB3 HIS A 8 2.816 -40.887 5.609 1.00 0.00 H new ATOM 0 HD2 HIS A 8 0.019 -42.267 4.034 1.00 0.00 H new ATOM 0 HE1 HIS A 8 -0.143 -44.343 7.730 1.00 0.00 H new ATOM 0 HE2 HIS A 8 -1.454 -43.687 5.648 1.00 0.00 H new ATOM 128 N TYR A 9 3.539 -39.366 3.442 1.00 0.00 N ATOM 129 CA TYR A 9 4.447 -38.264 3.150 1.00 0.00 C ATOM 130 C TYR A 9 4.598 -37.347 4.360 1.00 0.00 C ATOM 131 O TYR A 9 3.930 -37.531 5.377 1.00 0.00 O ATOM 132 CB TYR A 9 3.942 -37.463 1.949 1.00 0.00 C ATOM 133 CG TYR A 9 5.046 -36.820 1.141 1.00 0.00 C ATOM 134 CD1 TYR A 9 5.743 -37.544 0.181 1.00 0.00 C ATOM 135 CD2 TYR A 9 5.393 -35.489 1.338 1.00 0.00 C ATOM 136 CE1 TYR A 9 6.753 -36.961 -0.559 1.00 0.00 C ATOM 137 CE2 TYR A 9 6.401 -34.897 0.601 1.00 0.00 C ATOM 138 CZ TYR A 9 7.079 -35.637 -0.345 1.00 0.00 C ATOM 139 OH TYR A 9 8.084 -35.053 -1.081 1.00 0.00 O ATOM 0 H TYR A 9 2.620 -39.077 3.776 1.00 0.00 H new ATOM 0 HA TYR A 9 5.424 -38.685 2.912 1.00 0.00 H new ATOM 0 HB2 TYR A 9 3.365 -38.122 1.300 1.00 0.00 H new ATOM 0 HB3 TYR A 9 3.262 -36.687 2.301 1.00 0.00 H new ATOM 0 HD1 TYR A 9 5.491 -38.580 0.011 1.00 0.00 H new ATOM 0 HD2 TYR A 9 4.866 -34.907 2.080 1.00 0.00 H new ATOM 0 HE1 TYR A 9 7.285 -37.538 -1.301 1.00 0.00 H new ATOM 0 HE2 TYR A 9 6.656 -33.861 0.765 1.00 0.00 H new ATOM 0 HH TYR A 9 8.187 -34.117 -0.809 1.00 0.00 H new ATOM 149 N GLN A 10 5.481 -36.361 4.241 1.00 0.00 N ATOM 150 CA GLN A 10 5.720 -35.415 5.325 1.00 0.00 C ATOM 151 C GLN A 10 5.010 -34.091 5.058 1.00 0.00 C ATOM 152 O GLN A 10 4.895 -33.639 3.919 1.00 0.00 O ATOM 153 CB GLN A 10 7.220 -35.177 5.500 1.00 0.00 C ATOM 154 CG GLN A 10 7.836 -34.335 4.394 1.00 0.00 C ATOM 155 CD GLN A 10 8.274 -35.166 3.204 1.00 0.00 C ATOM 156 OE1 GLN A 10 8.053 -36.376 3.162 1.00 0.00 O ATOM 157 NE2 GLN A 10 8.898 -34.518 2.227 1.00 0.00 N ATOM 0 H GLN A 10 6.043 -36.196 3.406 1.00 0.00 H new ATOM 0 HA GLN A 10 5.318 -35.843 6.243 1.00 0.00 H new ATOM 0 HB2 GLN A 10 7.392 -34.686 6.458 1.00 0.00 H new ATOM 0 HB3 GLN A 10 7.730 -36.140 5.539 1.00 0.00 H new ATOM 0 HG2 GLN A 10 7.113 -33.589 4.065 1.00 0.00 H new ATOM 0 HG3 GLN A 10 8.695 -33.793 4.790 1.00 0.00 H new ATOM 0 HE21 GLN A 10 9.060 -33.514 2.303 1.00 0.00 H new ATOM 0 HE22 GLN A 10 9.215 -35.024 1.400 1.00 0.00 H new ATOM 166 N PRO A 11 4.522 -33.454 6.133 1.00 0.00 N ATOM 167 CA PRO A 11 3.816 -32.173 6.041 1.00 0.00 C ATOM 168 C PRO A 11 4.744 -31.025 5.660 1.00 0.00 C ATOM 169 O PRO A 11 5.954 -31.210 5.534 1.00 0.00 O ATOM 170 CB PRO A 11 3.265 -31.969 7.455 1.00 0.00 C ATOM 171 CG PRO A 11 4.180 -32.750 8.334 1.00 0.00 C ATOM 172 CD PRO A 11 4.624 -33.935 7.521 1.00 0.00 C ATOM 0 HA PRO A 11 3.048 -32.186 5.267 1.00 0.00 H new ATOM 0 HB2 PRO A 11 3.258 -30.914 7.729 1.00 0.00 H new ATOM 0 HB3 PRO A 11 2.238 -32.326 7.535 1.00 0.00 H new ATOM 0 HG2 PRO A 11 5.034 -32.147 8.643 1.00 0.00 H new ATOM 0 HG3 PRO A 11 3.670 -33.069 9.243 1.00 0.00 H new ATOM 0 HD2 PRO A 11 5.643 -34.234 7.769 1.00 0.00 H new ATOM 0 HD3 PRO A 11 3.987 -34.802 7.694 1.00 0.00 H new ATOM 180 N GLN A 12 4.169 -29.841 5.479 1.00 0.00 N ATOM 181 CA GLN A 12 4.946 -28.663 5.112 1.00 0.00 C ATOM 182 C GLN A 12 5.279 -27.825 6.342 1.00 0.00 C ATOM 183 O GLN A 12 5.156 -26.602 6.324 1.00 0.00 O ATOM 184 CB GLN A 12 4.179 -27.816 4.096 1.00 0.00 C ATOM 185 CG GLN A 12 5.079 -27.044 3.144 1.00 0.00 C ATOM 186 CD GLN A 12 5.539 -25.720 3.721 1.00 0.00 C ATOM 187 OE1 GLN A 12 6.696 -25.570 4.116 1.00 0.00 O ATOM 188 NE2 GLN A 12 4.634 -24.749 3.774 1.00 0.00 N ATOM 0 H GLN A 12 3.168 -29.672 5.580 1.00 0.00 H new ATOM 0 HA GLN A 12 5.879 -29.001 4.662 1.00 0.00 H new ATOM 0 HB2 GLN A 12 3.523 -28.465 3.516 1.00 0.00 H new ATOM 0 HB3 GLN A 12 3.541 -27.112 4.630 1.00 0.00 H new ATOM 0 HG2 GLN A 12 5.950 -27.652 2.900 1.00 0.00 H new ATOM 0 HG3 GLN A 12 4.545 -26.864 2.211 1.00 0.00 H new ATOM 0 HE21 GLN A 12 3.686 -24.916 3.436 1.00 0.00 H new ATOM 0 HE22 GLN A 12 4.887 -23.836 4.153 1.00 0.00 H new ATOM 197 N GLY A 13 5.702 -28.494 7.411 1.00 0.00 N ATOM 198 CA GLY A 13 6.046 -27.795 8.635 1.00 0.00 C ATOM 199 C GLY A 13 4.850 -27.599 9.546 1.00 0.00 C ATOM 200 O GLY A 13 3.820 -27.076 9.124 1.00 0.00 O ATOM 0 H GLY A 13 5.812 -29.507 7.451 1.00 0.00 H new ATOM 0 HA2 GLY A 13 6.815 -28.356 9.166 1.00 0.00 H new ATOM 0 HA3 GLY A 13 6.473 -26.823 8.387 1.00 0.00 H new ATOM 204 N ASN A 14 4.987 -28.021 10.799 1.00 0.00 N ATOM 205 CA ASN A 14 3.908 -27.891 11.771 1.00 0.00 C ATOM 206 C ASN A 14 4.253 -26.848 12.830 1.00 0.00 C ATOM 207 O ASN A 14 5.399 -26.413 12.937 1.00 0.00 O ATOM 208 CB ASN A 14 3.630 -29.239 12.439 1.00 0.00 C ATOM 209 CG ASN A 14 3.542 -30.374 11.436 1.00 0.00 C ATOM 210 OD1 ASN A 14 3.427 -30.145 10.232 1.00 0.00 O ATOM 211 ND2 ASN A 14 3.596 -31.605 11.930 1.00 0.00 N ATOM 0 H ASN A 14 5.834 -28.456 11.165 1.00 0.00 H new ATOM 0 HA ASN A 14 3.013 -27.564 11.242 1.00 0.00 H new ATOM 0 HB2 ASN A 14 4.420 -29.454 13.159 1.00 0.00 H new ATOM 0 HB3 ASN A 14 2.696 -29.179 12.998 1.00 0.00 H new ATOM 0 HD21 ASN A 14 3.542 -32.409 11.304 1.00 0.00 H new ATOM 0 HD22 ASN A 14 3.692 -31.747 12.935 1.00 0.00 H new ATOM 218 N SER A 15 3.253 -26.453 13.611 1.00 0.00 N ATOM 219 CA SER A 15 3.449 -25.458 14.659 1.00 0.00 C ATOM 220 C SER A 15 4.149 -24.219 14.109 1.00 0.00 C ATOM 221 O SER A 15 5.161 -23.773 14.650 1.00 0.00 O ATOM 222 CB SER A 15 4.266 -26.052 15.808 1.00 0.00 C ATOM 223 OG SER A 15 4.334 -25.155 16.903 1.00 0.00 O ATOM 0 H SER A 15 2.299 -26.807 13.538 1.00 0.00 H new ATOM 0 HA SER A 15 2.469 -25.163 15.034 1.00 0.00 H new ATOM 0 HB2 SER A 15 3.816 -26.991 16.131 1.00 0.00 H new ATOM 0 HB3 SER A 15 5.273 -26.284 15.461 1.00 0.00 H new ATOM 0 HG SER A 15 4.743 -24.314 16.612 1.00 0.00 H new ATOM 229 N ASP A 16 3.602 -23.669 13.031 1.00 0.00 N ATOM 230 CA ASP A 16 4.172 -22.480 12.407 1.00 0.00 C ATOM 231 C ASP A 16 3.452 -21.221 12.878 1.00 0.00 C ATOM 232 O ASP A 16 2.245 -21.221 13.122 1.00 0.00 O ATOM 233 CB ASP A 16 4.091 -22.590 10.884 1.00 0.00 C ATOM 234 CG ASP A 16 2.865 -23.352 10.422 1.00 0.00 C ATOM 235 OD1 ASP A 16 1.752 -22.792 10.506 1.00 0.00 O ATOM 236 OD2 ASP A 16 3.017 -24.510 9.978 1.00 0.00 O ATOM 0 H ASP A 16 2.765 -24.027 12.571 1.00 0.00 H new ATOM 0 HA ASP A 16 5.219 -22.410 12.703 1.00 0.00 H new ATOM 0 HB2 ASP A 16 4.078 -21.590 10.451 1.00 0.00 H new ATOM 0 HB3 ASP A 16 4.986 -23.087 10.511 1.00 0.00 H new ATOM 241 N PRO A 17 4.208 -20.121 13.010 1.00 0.00 N ATOM 242 CA PRO A 17 3.663 -18.834 13.454 1.00 0.00 C ATOM 243 C PRO A 17 2.751 -18.200 12.409 1.00 0.00 C ATOM 244 O PRO A 17 2.055 -17.225 12.690 1.00 0.00 O ATOM 245 CB PRO A 17 4.912 -17.974 13.665 1.00 0.00 C ATOM 246 CG PRO A 17 5.940 -18.573 12.769 1.00 0.00 C ATOM 247 CD PRO A 17 5.653 -20.048 12.737 1.00 0.00 C ATOM 0 HA PRO A 17 3.045 -18.939 14.346 1.00 0.00 H new ATOM 0 HB2 PRO A 17 4.723 -16.932 13.409 1.00 0.00 H new ATOM 0 HB3 PRO A 17 5.235 -17.993 14.706 1.00 0.00 H new ATOM 0 HG2 PRO A 17 5.884 -18.143 11.769 1.00 0.00 H new ATOM 0 HG3 PRO A 17 6.945 -18.379 13.144 1.00 0.00 H new ATOM 0 HD2 PRO A 17 5.902 -20.485 11.770 1.00 0.00 H new ATOM 0 HD3 PRO A 17 6.231 -20.586 13.488 1.00 0.00 H new ATOM 255 N ALA A 18 2.758 -18.761 11.205 1.00 0.00 N ATOM 256 CA ALA A 18 1.929 -18.252 10.119 1.00 0.00 C ATOM 257 C ALA A 18 0.576 -17.778 10.638 1.00 0.00 C ATOM 258 O ALA A 18 0.110 -18.227 11.686 1.00 0.00 O ATOM 259 CB ALA A 18 1.742 -19.320 9.052 1.00 0.00 C ATOM 0 H ALA A 18 3.329 -19.569 10.956 1.00 0.00 H new ATOM 0 HA ALA A 18 2.439 -17.397 9.676 1.00 0.00 H new ATOM 0 HB1 ALA A 18 1.121 -18.926 8.248 1.00 0.00 H new ATOM 0 HB2 ALA A 18 2.714 -19.609 8.652 1.00 0.00 H new ATOM 0 HB3 ALA A 18 1.257 -20.192 9.491 1.00 0.00 H new ATOM 265 N HIS A 19 -0.050 -16.867 9.900 1.00 0.00 N ATOM 266 CA HIS A 19 -1.350 -16.332 10.286 1.00 0.00 C ATOM 267 C HIS A 19 -2.472 -17.015 9.510 1.00 0.00 C ATOM 268 O HIS A 19 -3.410 -17.553 10.098 1.00 0.00 O ATOM 269 CB HIS A 19 -1.395 -14.822 10.048 1.00 0.00 C ATOM 270 CG HIS A 19 -0.294 -14.074 10.734 1.00 0.00 C ATOM 271 ND1 HIS A 19 -0.413 -13.562 12.009 1.00 0.00 N ATOM 272 CD2 HIS A 19 0.953 -13.754 10.316 1.00 0.00 C ATOM 273 CE1 HIS A 19 0.712 -12.958 12.345 1.00 0.00 C ATOM 274 NE2 HIS A 19 1.558 -13.060 11.336 1.00 0.00 N ATOM 0 H HIS A 19 0.322 -16.484 9.031 1.00 0.00 H new ATOM 0 HA HIS A 19 -1.495 -16.529 11.348 1.00 0.00 H new ATOM 0 HB2 HIS A 19 -1.341 -14.630 8.976 1.00 0.00 H new ATOM 0 HB3 HIS A 19 -2.355 -14.437 10.393 1.00 0.00 H new ATOM 0 HD2 HIS A 19 1.391 -13.998 9.359 1.00 0.00 H new ATOM 0 HE1 HIS A 19 0.907 -12.464 13.285 1.00 0.00 H new ATOM 0 HE2 HIS A 19 2.506 -12.685 11.317 1.00 0.00 H new ATOM 282 N THR A 20 -2.368 -16.989 8.184 1.00 0.00 N ATOM 283 CA THR A 20 -3.374 -17.604 7.327 1.00 0.00 C ATOM 284 C THR A 20 -2.725 -18.381 6.188 1.00 0.00 C ATOM 285 O THR A 20 -1.542 -18.204 5.898 1.00 0.00 O ATOM 286 CB THR A 20 -4.329 -16.550 6.736 1.00 0.00 C ATOM 287 OG1 THR A 20 -3.579 -15.444 6.221 1.00 0.00 O ATOM 288 CG2 THR A 20 -5.310 -16.057 7.789 1.00 0.00 C ATOM 0 H THR A 20 -1.597 -16.549 7.681 1.00 0.00 H new ATOM 0 HA THR A 20 -3.945 -18.290 7.952 1.00 0.00 H new ATOM 0 HB THR A 20 -4.892 -17.015 5.927 1.00 0.00 H new ATOM 0 HG1 THR A 20 -4.193 -14.779 5.845 1.00 0.00 H new ATOM 0 HG21 THR A 20 -5.974 -15.313 7.348 1.00 0.00 H new ATOM 0 HG22 THR A 20 -5.899 -16.896 8.158 1.00 0.00 H new ATOM 0 HG23 THR A 20 -4.761 -15.608 8.616 1.00 0.00 H new ATOM 296 N ALA A 21 -3.506 -19.241 5.543 1.00 0.00 N ATOM 297 CA ALA A 21 -3.007 -20.043 4.433 1.00 0.00 C ATOM 298 C ALA A 21 -3.651 -19.619 3.117 1.00 0.00 C ATOM 299 O ALA A 21 -4.792 -19.157 3.092 1.00 0.00 O ATOM 300 CB ALA A 21 -3.260 -21.521 4.694 1.00 0.00 C ATOM 0 H ALA A 21 -4.488 -19.400 5.770 1.00 0.00 H new ATOM 0 HA ALA A 21 -1.933 -19.878 4.352 1.00 0.00 H new ATOM 0 HB1 ALA A 21 -2.882 -22.108 3.857 1.00 0.00 H new ATOM 0 HB2 ALA A 21 -2.748 -21.822 5.608 1.00 0.00 H new ATOM 0 HB3 ALA A 21 -4.331 -21.693 4.804 1.00 0.00 H new ATOM 306 N THR A 22 -2.911 -19.778 2.024 1.00 0.00 N ATOM 307 CA THR A 22 -3.408 -19.409 0.704 1.00 0.00 C ATOM 308 C THR A 22 -3.416 -20.610 -0.235 1.00 0.00 C ATOM 309 O THR A 22 -2.382 -20.985 -0.787 1.00 0.00 O ATOM 310 CB THR A 22 -2.560 -18.287 0.078 1.00 0.00 C ATOM 311 OG1 THR A 22 -1.185 -18.683 0.024 1.00 0.00 O ATOM 312 CG2 THR A 22 -2.690 -16.999 0.877 1.00 0.00 C ATOM 0 H THR A 22 -1.965 -20.160 2.027 1.00 0.00 H new ATOM 0 HA THR A 22 -4.428 -19.050 0.839 1.00 0.00 H new ATOM 0 HB THR A 22 -2.926 -18.108 -0.933 1.00 0.00 H new ATOM 0 HG1 THR A 22 -1.124 -19.615 -0.273 1.00 0.00 H new ATOM 0 HG21 THR A 22 -2.082 -16.221 0.415 1.00 0.00 H new ATOM 0 HG22 THR A 22 -3.733 -16.683 0.891 1.00 0.00 H new ATOM 0 HG23 THR A 22 -2.348 -17.168 1.898 1.00 0.00 H new ATOM 320 N ALA A 23 -4.589 -21.208 -0.413 1.00 0.00 N ATOM 321 CA ALA A 23 -4.731 -22.365 -1.288 1.00 0.00 C ATOM 322 C ALA A 23 -5.027 -21.936 -2.721 1.00 0.00 C ATOM 323 O ALA A 23 -5.578 -20.864 -2.973 1.00 0.00 O ATOM 324 CB ALA A 23 -5.829 -23.284 -0.774 1.00 0.00 C ATOM 0 H ALA A 23 -5.455 -20.910 0.037 1.00 0.00 H new ATOM 0 HA ALA A 23 -3.786 -22.909 -1.286 1.00 0.00 H new ATOM 0 HB1 ALA A 23 -5.924 -24.144 -1.437 1.00 0.00 H new ATOM 0 HB2 ALA A 23 -5.577 -23.626 0.230 1.00 0.00 H new ATOM 0 HB3 ALA A 23 -6.774 -22.741 -0.746 1.00 0.00 H new ATOM 330 N PRO A 24 -4.651 -22.790 -3.685 1.00 0.00 N ATOM 331 CA PRO A 24 -4.865 -22.520 -5.110 1.00 0.00 C ATOM 332 C PRO A 24 -6.339 -22.580 -5.496 1.00 0.00 C ATOM 333 O PRO A 24 -6.693 -22.405 -6.661 1.00 0.00 O ATOM 334 CB PRO A 24 -4.084 -23.638 -5.804 1.00 0.00 C ATOM 335 CG PRO A 24 -4.041 -24.745 -4.808 1.00 0.00 C ATOM 336 CD PRO A 24 -3.988 -24.085 -3.458 1.00 0.00 C ATOM 0 HA PRO A 24 -4.539 -21.518 -5.389 1.00 0.00 H new ATOM 0 HB2 PRO A 24 -4.576 -23.952 -6.724 1.00 0.00 H new ATOM 0 HB3 PRO A 24 -3.080 -23.310 -6.075 1.00 0.00 H new ATOM 0 HG2 PRO A 24 -4.920 -25.384 -4.896 1.00 0.00 H new ATOM 0 HG3 PRO A 24 -3.169 -25.379 -4.967 1.00 0.00 H new ATOM 0 HD2 PRO A 24 -4.506 -24.675 -2.702 1.00 0.00 H new ATOM 0 HD3 PRO A 24 -2.962 -23.956 -3.114 1.00 0.00 H new ATOM 344 N GLY A 25 -7.195 -22.827 -4.509 1.00 0.00 N ATOM 345 CA GLY A 25 -8.621 -22.905 -4.766 1.00 0.00 C ATOM 346 C GLY A 25 -8.992 -24.104 -5.617 1.00 0.00 C ATOM 347 O GLY A 25 -8.312 -24.414 -6.594 1.00 0.00 O ATOM 0 H GLY A 25 -6.926 -22.974 -3.536 1.00 0.00 H new ATOM 0 HA2 GLY A 25 -9.156 -22.957 -3.818 1.00 0.00 H new ATOM 0 HA3 GLY A 25 -8.947 -21.993 -5.266 1.00 0.00 H new ATOM 351 N GLY A 26 -10.074 -24.780 -5.244 1.00 0.00 N ATOM 352 CA GLY A 26 -10.514 -25.945 -5.990 1.00 0.00 C ATOM 353 C GLY A 26 -11.960 -26.301 -5.709 1.00 0.00 C ATOM 354 O GLY A 26 -12.381 -27.438 -5.926 1.00 0.00 O ATOM 0 H GLY A 26 -10.654 -24.542 -4.439 1.00 0.00 H new ATOM 0 HA2 GLY A 26 -10.390 -25.758 -7.057 1.00 0.00 H new ATOM 0 HA3 GLY A 26 -9.879 -26.794 -5.739 1.00 0.00 H new ATOM 358 N LEU A 27 -12.723 -25.329 -5.222 1.00 0.00 N ATOM 359 CA LEU A 27 -14.131 -25.546 -4.907 1.00 0.00 C ATOM 360 C LEU A 27 -14.901 -26.003 -6.143 1.00 0.00 C ATOM 361 O LEU A 27 -14.478 -25.763 -7.274 1.00 0.00 O ATOM 362 CB LEU A 27 -14.754 -24.265 -4.350 1.00 0.00 C ATOM 363 CG LEU A 27 -14.698 -24.097 -2.832 1.00 0.00 C ATOM 364 CD1 LEU A 27 -13.365 -23.500 -2.409 1.00 0.00 C ATOM 365 CD2 LEU A 27 -15.850 -23.228 -2.349 1.00 0.00 C ATOM 0 H LEU A 27 -12.391 -24.383 -5.037 1.00 0.00 H new ATOM 0 HA LEU A 27 -14.192 -26.330 -4.152 1.00 0.00 H new ATOM 0 HB2 LEU A 27 -14.253 -23.412 -4.809 1.00 0.00 H new ATOM 0 HB3 LEU A 27 -15.798 -24.227 -4.661 1.00 0.00 H new ATOM 0 HG LEU A 27 -14.794 -25.081 -2.374 1.00 0.00 H new ATOM 0 HD11 LEU A 27 -13.344 -23.388 -1.325 1.00 0.00 H new ATOM 0 HD12 LEU A 27 -12.555 -24.160 -2.721 1.00 0.00 H new ATOM 0 HD13 LEU A 27 -13.239 -22.524 -2.877 1.00 0.00 H new ATOM 0 HD21 LEU A 27 -15.794 -23.119 -1.266 1.00 0.00 H new ATOM 0 HD22 LEU A 27 -15.785 -22.245 -2.816 1.00 0.00 H new ATOM 0 HD23 LEU A 27 -16.797 -23.696 -2.618 1.00 0.00 H new ATOM 377 N SER A 28 -16.033 -26.662 -5.918 1.00 0.00 N ATOM 378 CA SER A 28 -16.861 -27.154 -7.013 1.00 0.00 C ATOM 379 C SER A 28 -18.204 -26.429 -7.047 1.00 0.00 C ATOM 380 O SER A 28 -19.110 -26.814 -7.785 1.00 0.00 O ATOM 381 CB SER A 28 -17.086 -28.661 -6.873 1.00 0.00 C ATOM 382 OG SER A 28 -17.592 -29.215 -8.075 1.00 0.00 O ATOM 0 H SER A 28 -16.398 -26.868 -4.988 1.00 0.00 H new ATOM 0 HA SER A 28 -16.337 -26.957 -7.949 1.00 0.00 H new ATOM 0 HB2 SER A 28 -16.147 -29.149 -6.611 1.00 0.00 H new ATOM 0 HB3 SER A 28 -17.784 -28.854 -6.058 1.00 0.00 H new ATOM 0 HG SER A 28 -18.323 -28.655 -8.411 1.00 0.00 H new ATOM 388 N ALA A 29 -18.322 -25.378 -6.243 1.00 0.00 N ATOM 389 CA ALA A 29 -19.551 -24.597 -6.182 1.00 0.00 C ATOM 390 C ALA A 29 -19.370 -23.354 -5.317 1.00 0.00 C ATOM 391 O ALA A 29 -18.433 -23.269 -4.522 1.00 0.00 O ATOM 392 CB ALA A 29 -20.693 -25.451 -5.651 1.00 0.00 C ATOM 0 H ALA A 29 -17.581 -25.048 -5.625 1.00 0.00 H new ATOM 0 HA ALA A 29 -19.795 -24.271 -7.193 1.00 0.00 H new ATOM 0 HB1 ALA A 29 -21.605 -24.855 -5.611 1.00 0.00 H new ATOM 0 HB2 ALA A 29 -20.846 -26.305 -6.311 1.00 0.00 H new ATOM 0 HB3 ALA A 29 -20.447 -25.806 -4.650 1.00 0.00 H new ATOM 398 N LYS A 30 -20.272 -22.392 -5.476 1.00 0.00 N ATOM 399 CA LYS A 30 -20.213 -21.153 -4.710 1.00 0.00 C ATOM 400 C LYS A 30 -20.524 -21.408 -3.238 1.00 0.00 C ATOM 401 O LYS A 30 -21.433 -22.170 -2.910 1.00 0.00 O ATOM 402 CB LYS A 30 -21.197 -20.129 -5.280 1.00 0.00 C ATOM 403 CG LYS A 30 -22.633 -20.622 -5.321 1.00 0.00 C ATOM 404 CD LYS A 30 -23.512 -19.711 -6.160 1.00 0.00 C ATOM 405 CE LYS A 30 -24.879 -20.329 -6.410 1.00 0.00 C ATOM 406 NZ LYS A 30 -25.852 -19.973 -5.341 1.00 0.00 N ATOM 0 H LYS A 30 -21.054 -22.447 -6.129 1.00 0.00 H new ATOM 0 HA LYS A 30 -19.201 -20.756 -4.786 1.00 0.00 H new ATOM 0 HB2 LYS A 30 -21.151 -19.220 -4.680 1.00 0.00 H new ATOM 0 HB3 LYS A 30 -20.885 -19.861 -6.289 1.00 0.00 H new ATOM 0 HG2 LYS A 30 -22.660 -21.632 -5.729 1.00 0.00 H new ATOM 0 HG3 LYS A 30 -23.029 -20.678 -4.307 1.00 0.00 H new ATOM 0 HD2 LYS A 30 -23.632 -18.753 -5.654 1.00 0.00 H new ATOM 0 HD3 LYS A 30 -23.023 -19.509 -7.113 1.00 0.00 H new ATOM 0 HE2 LYS A 30 -25.259 -19.992 -7.374 1.00 0.00 H new ATOM 0 HE3 LYS A 30 -24.783 -21.413 -6.467 1.00 0.00 H new ATOM 0 HZ1 LYS A 30 -26.771 -20.413 -5.548 1.00 0.00 H new ATOM 0 HZ2 LYS A 30 -25.502 -20.317 -4.424 1.00 0.00 H new ATOM 0 HZ3 LYS A 30 -25.964 -18.940 -5.303 1.00 0.00 H new ATOM 420 N ALA A 31 -19.765 -20.765 -2.357 1.00 0.00 N ATOM 421 CA ALA A 31 -19.962 -20.920 -0.922 1.00 0.00 C ATOM 422 C ALA A 31 -19.532 -19.665 -0.170 1.00 0.00 C ATOM 423 O ALA A 31 -18.499 -19.061 -0.460 1.00 0.00 O ATOM 424 CB ALA A 31 -19.197 -22.132 -0.411 1.00 0.00 C ATOM 0 H ALA A 31 -19.008 -20.131 -2.613 1.00 0.00 H new ATOM 0 HA ALA A 31 -21.026 -21.074 -0.741 1.00 0.00 H new ATOM 0 HB1 ALA A 31 -19.354 -22.235 0.663 1.00 0.00 H new ATOM 0 HB2 ALA A 31 -19.555 -23.028 -0.918 1.00 0.00 H new ATOM 0 HB3 ALA A 31 -18.134 -22.002 -0.612 1.00 0.00 H new ATOM 430 N PRO A 32 -20.342 -19.261 0.821 1.00 0.00 N ATOM 431 CA PRO A 32 -20.065 -18.074 1.635 1.00 0.00 C ATOM 432 C PRO A 32 -18.869 -18.272 2.560 1.00 0.00 C ATOM 433 O PRO A 32 -18.425 -19.397 2.784 1.00 0.00 O ATOM 434 CB PRO A 32 -21.348 -17.895 2.450 1.00 0.00 C ATOM 435 CG PRO A 32 -21.946 -19.258 2.518 1.00 0.00 C ATOM 436 CD PRO A 32 -21.589 -19.932 1.222 1.00 0.00 C ATOM 0 HA PRO A 32 -19.810 -17.210 1.022 1.00 0.00 H new ATOM 0 HB2 PRO A 32 -21.134 -17.506 3.446 1.00 0.00 H new ATOM 0 HB3 PRO A 32 -22.026 -17.188 1.971 1.00 0.00 H new ATOM 0 HG2 PRO A 32 -21.553 -19.815 3.369 1.00 0.00 H new ATOM 0 HG3 PRO A 32 -23.027 -19.204 2.645 1.00 0.00 H new ATOM 0 HD2 PRO A 32 -21.444 -21.004 1.353 1.00 0.00 H new ATOM 0 HD3 PRO A 32 -22.372 -19.805 0.474 1.00 0.00 H new ATOM 444 N ALA A 33 -18.353 -17.170 3.096 1.00 0.00 N ATOM 445 CA ALA A 33 -17.210 -17.224 4.000 1.00 0.00 C ATOM 446 C ALA A 33 -17.643 -17.608 5.410 1.00 0.00 C ATOM 447 O ALA A 33 -18.810 -17.921 5.648 1.00 0.00 O ATOM 448 CB ALA A 33 -16.485 -15.886 4.014 1.00 0.00 C ATOM 0 H ALA A 33 -18.708 -16.230 2.920 1.00 0.00 H new ATOM 0 HA ALA A 33 -16.527 -17.992 3.637 1.00 0.00 H new ATOM 0 HB1 ALA A 33 -15.634 -15.940 4.693 1.00 0.00 H new ATOM 0 HB2 ALA A 33 -16.133 -15.652 3.009 1.00 0.00 H new ATOM 0 HB3 ALA A 33 -17.168 -15.106 4.350 1.00 0.00 H new ATOM 454 N MET A 34 -16.697 -17.581 6.343 1.00 0.00 N ATOM 455 CA MET A 34 -16.982 -17.927 7.731 1.00 0.00 C ATOM 456 C MET A 34 -17.495 -19.359 7.840 1.00 0.00 C ATOM 457 O MET A 34 -18.539 -19.612 8.444 1.00 0.00 O ATOM 458 CB MET A 34 -18.010 -16.958 8.319 1.00 0.00 C ATOM 459 CG MET A 34 -17.415 -15.627 8.748 1.00 0.00 C ATOM 460 SD MET A 34 -16.060 -15.819 9.923 1.00 0.00 S ATOM 461 CE MET A 34 -16.878 -16.714 11.240 1.00 0.00 C ATOM 0 H MET A 34 -15.727 -17.323 6.163 1.00 0.00 H new ATOM 0 HA MET A 34 -16.054 -17.849 8.297 1.00 0.00 H new ATOM 0 HB2 MET A 34 -18.790 -16.776 7.580 1.00 0.00 H new ATOM 0 HB3 MET A 34 -18.489 -17.427 9.179 1.00 0.00 H new ATOM 0 HG2 MET A 34 -17.055 -15.094 7.868 1.00 0.00 H new ATOM 0 HG3 MET A 34 -18.195 -15.012 9.196 1.00 0.00 H new ATOM 0 HE1 MET A 34 -16.608 -16.275 12.201 1.00 0.00 H new ATOM 0 HE2 MET A 34 -17.958 -16.654 11.105 1.00 0.00 H new ATOM 0 HE3 MET A 34 -16.567 -17.759 11.218 1.00 0.00 H new ATOM 471 N THR A 35 -16.756 -20.295 7.252 1.00 0.00 N ATOM 472 CA THR A 35 -17.137 -21.701 7.282 1.00 0.00 C ATOM 473 C THR A 35 -15.927 -22.603 7.072 1.00 0.00 C ATOM 474 O THR A 35 -14.961 -22.240 6.400 1.00 0.00 O ATOM 475 CB THR A 35 -18.194 -22.020 6.208 1.00 0.00 C ATOM 476 OG1 THR A 35 -17.633 -21.846 4.902 1.00 0.00 O ATOM 477 CG2 THR A 35 -19.413 -21.124 6.365 1.00 0.00 C ATOM 0 H THR A 35 -15.890 -20.104 6.749 1.00 0.00 H new ATOM 0 HA THR A 35 -17.562 -21.892 8.267 1.00 0.00 H new ATOM 0 HB THR A 35 -18.506 -23.057 6.334 1.00 0.00 H new ATOM 0 HG1 THR A 35 -18.311 -22.052 4.225 1.00 0.00 H new ATOM 0 HG21 THR A 35 -20.145 -21.368 5.595 1.00 0.00 H new ATOM 0 HG22 THR A 35 -19.855 -21.280 7.349 1.00 0.00 H new ATOM 0 HG23 THR A 35 -19.113 -20.081 6.263 1.00 0.00 H new ATOM 485 N PRO A 36 -15.977 -23.808 7.659 1.00 0.00 N ATOM 486 CA PRO A 36 -14.892 -24.788 7.548 1.00 0.00 C ATOM 487 C PRO A 36 -14.776 -25.369 6.143 1.00 0.00 C ATOM 488 O PRO A 36 -15.767 -25.469 5.418 1.00 0.00 O ATOM 489 CB PRO A 36 -15.295 -25.878 8.545 1.00 0.00 C ATOM 490 CG PRO A 36 -16.777 -25.767 8.648 1.00 0.00 C ATOM 491 CD PRO A 36 -17.096 -24.307 8.474 1.00 0.00 C ATOM 0 HA PRO A 36 -13.919 -24.342 7.752 1.00 0.00 H new ATOM 0 HB2 PRO A 36 -14.995 -26.866 8.195 1.00 0.00 H new ATOM 0 HB3 PRO A 36 -14.818 -25.725 9.513 1.00 0.00 H new ATOM 0 HG2 PRO A 36 -17.268 -26.368 7.882 1.00 0.00 H new ATOM 0 HG3 PRO A 36 -17.130 -26.131 9.613 1.00 0.00 H new ATOM 0 HD2 PRO A 36 -18.053 -24.162 7.974 1.00 0.00 H new ATOM 0 HD3 PRO A 36 -17.156 -23.792 9.433 1.00 0.00 H new ATOM 499 N LEU A 37 -13.561 -25.750 5.764 1.00 0.00 N ATOM 500 CA LEU A 37 -13.316 -26.321 4.444 1.00 0.00 C ATOM 501 C LEU A 37 -12.537 -27.628 4.553 1.00 0.00 C ATOM 502 O LEU A 37 -12.051 -27.984 5.626 1.00 0.00 O ATOM 503 CB LEU A 37 -12.547 -25.327 3.571 1.00 0.00 C ATOM 504 CG LEU A 37 -13.050 -23.883 3.597 1.00 0.00 C ATOM 505 CD1 LEU A 37 -12.118 -22.980 2.804 1.00 0.00 C ATOM 506 CD2 LEU A 37 -14.467 -23.802 3.049 1.00 0.00 C ATOM 0 H LEU A 37 -12.731 -25.674 6.352 1.00 0.00 H new ATOM 0 HA LEU A 37 -14.280 -26.531 3.981 1.00 0.00 H new ATOM 0 HB2 LEU A 37 -11.502 -25.333 3.883 1.00 0.00 H new ATOM 0 HB3 LEU A 37 -12.574 -25.682 2.541 1.00 0.00 H new ATOM 0 HG LEU A 37 -13.062 -23.541 4.632 1.00 0.00 H new ATOM 0 HD11 LEU A 37 -12.491 -21.956 2.833 1.00 0.00 H new ATOM 0 HD12 LEU A 37 -11.120 -23.015 3.240 1.00 0.00 H new ATOM 0 HD13 LEU A 37 -12.074 -23.321 1.770 1.00 0.00 H new ATOM 0 HD21 LEU A 37 -14.809 -22.767 3.075 1.00 0.00 H new ATOM 0 HD22 LEU A 37 -14.481 -24.163 2.021 1.00 0.00 H new ATOM 0 HD23 LEU A 37 -15.128 -24.418 3.658 1.00 0.00 H new ATOM 518 N MET A 38 -12.421 -28.337 3.435 1.00 0.00 N ATOM 519 CA MET A 38 -11.697 -29.602 3.404 1.00 0.00 C ATOM 520 C MET A 38 -10.765 -29.667 2.198 1.00 0.00 C ATOM 521 O MET A 38 -11.055 -29.098 1.145 1.00 0.00 O ATOM 522 CB MET A 38 -12.679 -30.775 3.368 1.00 0.00 C ATOM 523 CG MET A 38 -13.357 -30.959 2.019 1.00 0.00 C ATOM 524 SD MET A 38 -14.627 -32.238 2.049 1.00 0.00 S ATOM 525 CE MET A 38 -13.620 -33.717 1.965 1.00 0.00 C ATOM 0 H MET A 38 -12.819 -28.057 2.539 1.00 0.00 H new ATOM 0 HA MET A 38 -11.094 -29.669 4.310 1.00 0.00 H new ATOM 0 HB2 MET A 38 -12.148 -31.691 3.626 1.00 0.00 H new ATOM 0 HB3 MET A 38 -13.442 -30.623 4.131 1.00 0.00 H new ATOM 0 HG2 MET A 38 -13.805 -30.015 1.710 1.00 0.00 H new ATOM 0 HG3 MET A 38 -12.606 -31.215 1.271 1.00 0.00 H new ATOM 0 HE1 MET A 38 -13.942 -34.329 1.123 1.00 0.00 H new ATOM 0 HE2 MET A 38 -12.575 -33.438 1.832 1.00 0.00 H new ATOM 0 HE3 MET A 38 -13.729 -34.285 2.889 1.00 0.00 H new ATOM 535 N LEU A 39 -9.645 -30.363 2.359 1.00 0.00 N ATOM 536 CA LEU A 39 -8.670 -30.502 1.282 1.00 0.00 C ATOM 537 C LEU A 39 -9.216 -31.382 0.163 1.00 0.00 C ATOM 538 O LEU A 39 -10.229 -32.061 0.331 1.00 0.00 O ATOM 539 CB LEU A 39 -7.366 -31.093 1.822 1.00 0.00 C ATOM 540 CG LEU A 39 -6.324 -30.086 2.311 1.00 0.00 C ATOM 541 CD1 LEU A 39 -5.769 -29.284 1.145 1.00 0.00 C ATOM 542 CD2 LEU A 39 -6.927 -29.160 3.358 1.00 0.00 C ATOM 0 H LEU A 39 -9.389 -30.840 3.224 1.00 0.00 H new ATOM 0 HA LEU A 39 -8.471 -29.511 0.874 1.00 0.00 H new ATOM 0 HB2 LEU A 39 -7.608 -31.764 2.646 1.00 0.00 H new ATOM 0 HB3 LEU A 39 -6.914 -31.701 1.038 1.00 0.00 H new ATOM 0 HG LEU A 39 -5.503 -30.636 2.771 1.00 0.00 H new ATOM 0 HD11 LEU A 39 -5.029 -28.573 1.512 1.00 0.00 H new ATOM 0 HD12 LEU A 39 -5.299 -29.959 0.430 1.00 0.00 H new ATOM 0 HD13 LEU A 39 -6.580 -28.744 0.656 1.00 0.00 H new ATOM 0 HD21 LEU A 39 -6.171 -28.450 3.695 1.00 0.00 H new ATOM 0 HD22 LEU A 39 -7.767 -28.617 2.924 1.00 0.00 H new ATOM 0 HD23 LEU A 39 -7.276 -29.748 4.207 1.00 0.00 H new ATOM 554 N ASP A 40 -8.536 -31.368 -0.979 1.00 0.00 N ATOM 555 CA ASP A 40 -8.951 -32.167 -2.125 1.00 0.00 C ATOM 556 C ASP A 40 -8.596 -33.637 -1.920 1.00 0.00 C ATOM 557 O ASP A 40 -7.908 -33.993 -0.963 1.00 0.00 O ATOM 558 CB ASP A 40 -8.294 -31.644 -3.403 1.00 0.00 C ATOM 559 CG ASP A 40 -9.051 -32.050 -4.652 1.00 0.00 C ATOM 560 OD1 ASP A 40 -10.258 -31.742 -4.740 1.00 0.00 O ATOM 561 OD2 ASP A 40 -8.438 -32.677 -5.541 1.00 0.00 O ATOM 0 H ASP A 40 -7.695 -30.812 -1.135 1.00 0.00 H new ATOM 0 HA ASP A 40 -10.033 -32.084 -2.222 1.00 0.00 H new ATOM 0 HB2 ASP A 40 -8.232 -30.557 -3.357 1.00 0.00 H new ATOM 0 HB3 ASP A 40 -7.273 -32.020 -3.463 1.00 0.00 H new ATOM 566 N THR A 41 -9.071 -34.487 -2.825 1.00 0.00 N ATOM 567 CA THR A 41 -8.806 -35.918 -2.743 1.00 0.00 C ATOM 568 C THR A 41 -7.316 -36.192 -2.570 1.00 0.00 C ATOM 569 O THR A 41 -6.920 -37.044 -1.775 1.00 0.00 O ATOM 570 CB THR A 41 -9.310 -36.656 -3.997 1.00 0.00 C ATOM 571 OG1 THR A 41 -8.958 -38.042 -3.925 1.00 0.00 O ATOM 572 CG2 THR A 41 -8.721 -36.043 -5.259 1.00 0.00 C ATOM 0 H THR A 41 -9.641 -34.209 -3.624 1.00 0.00 H new ATOM 0 HA THR A 41 -9.345 -36.290 -1.871 1.00 0.00 H new ATOM 0 HB THR A 41 -10.395 -36.559 -4.037 1.00 0.00 H new ATOM 0 HG1 THR A 41 -9.284 -38.504 -4.725 1.00 0.00 H new ATOM 0 HG21 THR A 41 -9.091 -36.581 -6.132 1.00 0.00 H new ATOM 0 HG22 THR A 41 -9.015 -34.996 -5.326 1.00 0.00 H new ATOM 0 HG23 THR A 41 -7.634 -36.113 -5.224 1.00 0.00 H new ATOM 580 N SER A 42 -6.494 -35.464 -3.320 1.00 0.00 N ATOM 581 CA SER A 42 -5.047 -35.631 -3.252 1.00 0.00 C ATOM 582 C SER A 42 -4.413 -34.532 -2.405 1.00 0.00 C ATOM 583 O SER A 42 -3.202 -34.317 -2.454 1.00 0.00 O ATOM 584 CB SER A 42 -4.445 -35.620 -4.658 1.00 0.00 C ATOM 585 OG SER A 42 -4.934 -36.702 -5.431 1.00 0.00 O ATOM 0 H SER A 42 -6.806 -34.753 -3.982 1.00 0.00 H new ATOM 0 HA SER A 42 -4.838 -36.593 -2.783 1.00 0.00 H new ATOM 0 HB2 SER A 42 -4.685 -34.678 -5.152 1.00 0.00 H new ATOM 0 HB3 SER A 42 -3.359 -35.678 -4.592 1.00 0.00 H new ATOM 0 HG SER A 42 -4.535 -36.671 -6.326 1.00 0.00 H new ATOM 591 N SER A 43 -5.240 -33.838 -1.630 1.00 0.00 N ATOM 592 CA SER A 43 -4.762 -32.758 -0.775 1.00 0.00 C ATOM 593 C SER A 43 -3.909 -31.774 -1.570 1.00 0.00 C ATOM 594 O SER A 43 -2.829 -31.378 -1.132 1.00 0.00 O ATOM 595 CB SER A 43 -3.953 -33.324 0.393 1.00 0.00 C ATOM 596 OG SER A 43 -4.730 -34.224 1.164 1.00 0.00 O ATOM 0 H SER A 43 -6.245 -34.004 -1.577 1.00 0.00 H new ATOM 0 HA SER A 43 -5.629 -32.227 -0.383 1.00 0.00 H new ATOM 0 HB2 SER A 43 -3.069 -33.836 0.013 1.00 0.00 H new ATOM 0 HB3 SER A 43 -3.602 -32.508 1.025 1.00 0.00 H new ATOM 0 HG SER A 43 -4.189 -34.573 1.903 1.00 0.00 H new ATOM 602 N ARG A 44 -4.403 -31.384 -2.740 1.00 0.00 N ATOM 603 CA ARG A 44 -3.686 -30.447 -3.597 1.00 0.00 C ATOM 604 C ARG A 44 -4.381 -29.089 -3.619 1.00 0.00 C ATOM 605 O ARG A 44 -3.732 -28.045 -3.542 1.00 0.00 O ATOM 606 CB ARG A 44 -3.582 -31.001 -5.020 1.00 0.00 C ATOM 607 CG ARG A 44 -2.445 -31.992 -5.205 1.00 0.00 C ATOM 608 CD ARG A 44 -2.527 -32.687 -6.555 1.00 0.00 C ATOM 609 NE ARG A 44 -2.046 -31.835 -7.640 1.00 0.00 N ATOM 610 CZ ARG A 44 -2.386 -32.004 -8.913 1.00 0.00 C ATOM 611 NH1 ARG A 44 -3.204 -32.988 -9.259 1.00 0.00 N ATOM 612 NH2 ARG A 44 -1.907 -31.187 -9.842 1.00 0.00 N ATOM 0 H ARG A 44 -5.296 -31.702 -3.116 1.00 0.00 H new ATOM 0 HA ARG A 44 -2.683 -30.317 -3.190 1.00 0.00 H new ATOM 0 HB2 ARG A 44 -4.522 -31.486 -5.282 1.00 0.00 H new ATOM 0 HB3 ARG A 44 -3.447 -30.172 -5.715 1.00 0.00 H new ATOM 0 HG2 ARG A 44 -1.491 -31.473 -5.119 1.00 0.00 H new ATOM 0 HG3 ARG A 44 -2.476 -32.736 -4.409 1.00 0.00 H new ATOM 0 HD2 ARG A 44 -1.939 -33.604 -6.527 1.00 0.00 H new ATOM 0 HD3 ARG A 44 -3.559 -32.976 -6.752 1.00 0.00 H new ATOM 0 HE ARG A 44 -1.415 -31.068 -7.407 1.00 0.00 H new ATOM 0 HH11 ARG A 44 -3.574 -33.618 -8.547 1.00 0.00 H new ATOM 0 HH12 ARG A 44 -3.463 -33.115 -10.237 1.00 0.00 H new ATOM 0 HH21 ARG A 44 -1.277 -30.429 -9.579 1.00 0.00 H new ATOM 0 HH22 ARG A 44 -2.168 -31.317 -10.819 1.00 0.00 H new ATOM 626 N LYS A 45 -5.706 -29.110 -3.724 1.00 0.00 N ATOM 627 CA LYS A 45 -6.491 -27.881 -3.755 1.00 0.00 C ATOM 628 C LYS A 45 -7.337 -27.744 -2.494 1.00 0.00 C ATOM 629 O LYS A 45 -7.285 -28.594 -1.603 1.00 0.00 O ATOM 630 CB LYS A 45 -7.392 -27.859 -4.992 1.00 0.00 C ATOM 631 CG LYS A 45 -6.631 -27.703 -6.297 1.00 0.00 C ATOM 632 CD LYS A 45 -7.361 -28.368 -7.451 1.00 0.00 C ATOM 633 CE LYS A 45 -6.620 -28.173 -8.765 1.00 0.00 C ATOM 634 NZ LYS A 45 -7.170 -29.038 -9.846 1.00 0.00 N ATOM 0 H LYS A 45 -6.259 -29.965 -3.789 1.00 0.00 H new ATOM 0 HA LYS A 45 -5.800 -27.039 -3.801 1.00 0.00 H new ATOM 0 HB2 LYS A 45 -7.970 -28.783 -5.026 1.00 0.00 H new ATOM 0 HB3 LYS A 45 -8.105 -27.040 -4.897 1.00 0.00 H new ATOM 0 HG2 LYS A 45 -6.493 -26.644 -6.514 1.00 0.00 H new ATOM 0 HG3 LYS A 45 -5.637 -28.139 -6.194 1.00 0.00 H new ATOM 0 HD2 LYS A 45 -7.470 -29.433 -7.248 1.00 0.00 H new ATOM 0 HD3 LYS A 45 -8.366 -27.954 -7.534 1.00 0.00 H new ATOM 0 HE2 LYS A 45 -6.686 -27.128 -9.067 1.00 0.00 H new ATOM 0 HE3 LYS A 45 -5.563 -28.398 -8.623 1.00 0.00 H new ATOM 0 HZ1 LYS A 45 -6.638 -28.876 -10.725 1.00 0.00 H new ATOM 0 HZ2 LYS A 45 -7.084 -30.037 -9.569 1.00 0.00 H new ATOM 0 HZ3 LYS A 45 -8.172 -28.806 -10.000 1.00 0.00 H new ATOM 648 N LEU A 46 -8.117 -26.671 -2.424 1.00 0.00 N ATOM 649 CA LEU A 46 -8.977 -26.424 -1.272 1.00 0.00 C ATOM 650 C LEU A 46 -10.438 -26.313 -1.696 1.00 0.00 C ATOM 651 O LEU A 46 -10.781 -25.523 -2.575 1.00 0.00 O ATOM 652 CB LEU A 46 -8.544 -25.145 -0.553 1.00 0.00 C ATOM 653 CG LEU A 46 -8.793 -25.106 0.956 1.00 0.00 C ATOM 654 CD1 LEU A 46 -10.008 -25.945 1.318 1.00 0.00 C ATOM 655 CD2 LEU A 46 -7.563 -25.589 1.712 1.00 0.00 C ATOM 0 H LEU A 46 -8.172 -25.958 -3.151 1.00 0.00 H new ATOM 0 HA LEU A 46 -8.880 -27.268 -0.590 1.00 0.00 H new ATOM 0 HB2 LEU A 46 -7.479 -24.996 -0.729 1.00 0.00 H new ATOM 0 HB3 LEU A 46 -9.064 -24.302 -1.009 1.00 0.00 H new ATOM 0 HG LEU A 46 -8.991 -24.074 1.246 1.00 0.00 H new ATOM 0 HD11 LEU A 46 -10.170 -25.905 2.395 1.00 0.00 H new ATOM 0 HD12 LEU A 46 -10.886 -25.554 0.805 1.00 0.00 H new ATOM 0 HD13 LEU A 46 -9.840 -26.978 1.014 1.00 0.00 H new ATOM 0 HD21 LEU A 46 -7.758 -25.555 2.784 1.00 0.00 H new ATOM 0 HD22 LEU A 46 -7.334 -26.613 1.418 1.00 0.00 H new ATOM 0 HD23 LEU A 46 -6.715 -24.946 1.477 1.00 0.00 H new ATOM 667 N VAL A 47 -11.295 -27.108 -1.063 1.00 0.00 N ATOM 668 CA VAL A 47 -12.719 -27.096 -1.372 1.00 0.00 C ATOM 669 C VAL A 47 -13.557 -27.008 -0.101 1.00 0.00 C ATOM 670 O VAL A 47 -13.054 -27.221 1.002 1.00 0.00 O ATOM 671 CB VAL A 47 -13.133 -28.354 -2.159 1.00 0.00 C ATOM 672 CG1 VAL A 47 -12.213 -28.564 -3.352 1.00 0.00 C ATOM 673 CG2 VAL A 47 -13.130 -29.575 -1.252 1.00 0.00 C ATOM 0 H VAL A 47 -11.027 -27.768 -0.333 1.00 0.00 H new ATOM 0 HA VAL A 47 -12.902 -26.214 -1.986 1.00 0.00 H new ATOM 0 HB VAL A 47 -14.147 -28.210 -2.533 1.00 0.00 H new ATOM 0 HG11 VAL A 47 -12.521 -29.457 -3.896 1.00 0.00 H new ATOM 0 HG12 VAL A 47 -12.271 -27.699 -4.013 1.00 0.00 H new ATOM 0 HG13 VAL A 47 -11.188 -28.687 -3.004 1.00 0.00 H new ATOM 0 HG21 VAL A 47 -13.425 -30.454 -1.825 1.00 0.00 H new ATOM 0 HG22 VAL A 47 -12.129 -29.725 -0.847 1.00 0.00 H new ATOM 0 HG23 VAL A 47 -13.834 -29.422 -0.434 1.00 0.00 H new ATOM 683 N ALA A 48 -14.837 -26.691 -0.264 1.00 0.00 N ATOM 684 CA ALA A 48 -15.746 -26.576 0.870 1.00 0.00 C ATOM 685 C ALA A 48 -15.927 -27.921 1.567 1.00 0.00 C ATOM 686 O ALA A 48 -15.755 -28.975 0.956 1.00 0.00 O ATOM 687 CB ALA A 48 -17.091 -26.030 0.415 1.00 0.00 C ATOM 0 H ALA A 48 -15.268 -26.509 -1.170 1.00 0.00 H new ATOM 0 HA ALA A 48 -15.308 -25.881 1.586 1.00 0.00 H new ATOM 0 HB1 ALA A 48 -17.760 -25.949 1.272 1.00 0.00 H new ATOM 0 HB2 ALA A 48 -16.952 -25.045 -0.031 1.00 0.00 H new ATOM 0 HB3 ALA A 48 -17.526 -26.704 -0.323 1.00 0.00 H new ATOM 693 N TRP A 49 -16.274 -27.876 2.848 1.00 0.00 N ATOM 694 CA TRP A 49 -16.477 -29.091 3.628 1.00 0.00 C ATOM 695 C TRP A 49 -17.739 -29.820 3.181 1.00 0.00 C ATOM 696 O TRP A 49 -18.767 -29.197 2.919 1.00 0.00 O ATOM 697 CB TRP A 49 -16.567 -28.757 5.118 1.00 0.00 C ATOM 698 CG TRP A 49 -16.727 -29.965 5.989 1.00 0.00 C ATOM 699 CD1 TRP A 49 -16.171 -31.197 5.792 1.00 0.00 C ATOM 700 CD2 TRP A 49 -17.495 -30.058 7.194 1.00 0.00 C ATOM 701 NE1 TRP A 49 -16.547 -32.050 6.802 1.00 0.00 N ATOM 702 CE2 TRP A 49 -17.359 -31.375 7.675 1.00 0.00 C ATOM 703 CE3 TRP A 49 -18.283 -29.156 7.915 1.00 0.00 C ATOM 704 CZ2 TRP A 49 -17.982 -31.809 8.842 1.00 0.00 C ATOM 705 CZ3 TRP A 49 -18.901 -29.589 9.072 1.00 0.00 C ATOM 706 CH2 TRP A 49 -18.748 -30.906 9.527 1.00 0.00 C ATOM 0 H TRP A 49 -16.421 -27.011 3.369 1.00 0.00 H new ATOM 0 HA TRP A 49 -15.622 -29.747 3.461 1.00 0.00 H new ATOM 0 HB2 TRP A 49 -15.668 -28.219 5.417 1.00 0.00 H new ATOM 0 HB3 TRP A 49 -17.410 -28.085 5.282 1.00 0.00 H new ATOM 0 HD1 TRP A 49 -15.530 -31.462 4.964 1.00 0.00 H new ATOM 0 HE1 TRP A 49 -16.267 -33.027 6.888 1.00 0.00 H new ATOM 0 HE3 TRP A 49 -18.406 -28.139 7.574 1.00 0.00 H new ATOM 0 HZ2 TRP A 49 -17.865 -32.823 9.194 1.00 0.00 H new ATOM 0 HZ3 TRP A 49 -19.513 -28.901 9.636 1.00 0.00 H new ATOM 0 HH2 TRP A 49 -19.244 -31.214 10.436 1.00 0.00 H new ATOM 717 N ASP A 50 -17.653 -31.143 3.095 1.00 0.00 N ATOM 718 CA ASP A 50 -18.790 -31.958 2.680 1.00 0.00 C ATOM 719 C ASP A 50 -19.939 -31.834 3.675 1.00 0.00 C ATOM 720 O ASP A 50 -21.103 -31.747 3.287 1.00 0.00 O ATOM 721 CB ASP A 50 -18.372 -33.423 2.544 1.00 0.00 C ATOM 722 CG ASP A 50 -17.222 -33.609 1.575 1.00 0.00 C ATOM 723 OD1 ASP A 50 -17.109 -32.805 0.626 1.00 0.00 O ATOM 724 OD2 ASP A 50 -16.435 -34.560 1.763 1.00 0.00 O ATOM 0 H ASP A 50 -16.808 -31.674 3.307 1.00 0.00 H new ATOM 0 HA ASP A 50 -19.132 -31.595 1.711 1.00 0.00 H new ATOM 0 HB2 ASP A 50 -18.085 -33.808 3.522 1.00 0.00 H new ATOM 0 HB3 ASP A 50 -19.226 -34.012 2.208 1.00 0.00 H new ATOM 729 N GLY A 51 -19.604 -31.827 4.962 1.00 0.00 N ATOM 730 CA GLY A 51 -20.619 -31.715 5.993 1.00 0.00 C ATOM 731 C GLY A 51 -20.784 -32.996 6.786 1.00 0.00 C ATOM 732 O GLY A 51 -21.242 -32.974 7.929 1.00 0.00 O ATOM 0 H GLY A 51 -18.647 -31.897 5.309 1.00 0.00 H new ATOM 0 HA2 GLY A 51 -20.356 -30.903 6.671 1.00 0.00 H new ATOM 0 HA3 GLY A 51 -21.571 -31.451 5.534 1.00 0.00 H new ATOM 736 N THR A 52 -20.412 -34.119 6.178 1.00 0.00 N ATOM 737 CA THR A 52 -20.524 -35.416 6.833 1.00 0.00 C ATOM 738 C THR A 52 -19.150 -35.976 7.181 1.00 0.00 C ATOM 739 O THR A 52 -18.942 -36.506 8.273 1.00 0.00 O ATOM 740 CB THR A 52 -21.270 -36.430 5.946 1.00 0.00 C ATOM 741 OG1 THR A 52 -20.690 -36.457 4.637 1.00 0.00 O ATOM 742 CG2 THR A 52 -22.747 -36.078 5.845 1.00 0.00 C ATOM 0 H THR A 52 -20.031 -34.156 5.233 1.00 0.00 H new ATOM 0 HA THR A 52 -21.092 -35.260 7.750 1.00 0.00 H new ATOM 0 HB THR A 52 -21.178 -37.415 6.404 1.00 0.00 H new ATOM 0 HG1 THR A 52 -21.169 -37.106 4.080 1.00 0.00 H new ATOM 0 HG21 THR A 52 -23.253 -36.808 5.213 1.00 0.00 H new ATOM 0 HG22 THR A 52 -23.192 -36.088 6.840 1.00 0.00 H new ATOM 0 HG23 THR A 52 -22.855 -35.085 5.409 1.00 0.00 H new ATOM 750 N THR A 53 -18.213 -35.856 6.246 1.00 0.00 N ATOM 751 CA THR A 53 -16.858 -36.351 6.454 1.00 0.00 C ATOM 752 C THR A 53 -16.317 -35.919 7.812 1.00 0.00 C ATOM 753 O THR A 53 -16.173 -34.726 8.082 1.00 0.00 O ATOM 754 CB THR A 53 -15.903 -35.855 5.352 1.00 0.00 C ATOM 755 OG1 THR A 53 -16.420 -36.204 4.063 1.00 0.00 O ATOM 756 CG2 THR A 53 -14.516 -36.456 5.527 1.00 0.00 C ATOM 0 H THR A 53 -18.368 -35.420 5.337 1.00 0.00 H new ATOM 0 HA THR A 53 -16.910 -37.439 6.416 1.00 0.00 H new ATOM 0 HB THR A 53 -15.824 -34.771 5.431 1.00 0.00 H new ATOM 0 HG1 THR A 53 -16.301 -35.451 3.448 1.00 0.00 H new ATOM 0 HG21 THR A 53 -13.859 -36.091 4.737 1.00 0.00 H new ATOM 0 HG22 THR A 53 -14.113 -36.165 6.497 1.00 0.00 H new ATOM 0 HG23 THR A 53 -14.581 -37.543 5.472 1.00 0.00 H new ATOM 764 N ASP A 54 -16.017 -36.894 8.662 1.00 0.00 N ATOM 765 CA ASP A 54 -15.489 -36.614 9.992 1.00 0.00 C ATOM 766 C ASP A 54 -14.020 -36.212 9.920 1.00 0.00 C ATOM 767 O ASP A 54 -13.255 -36.754 9.123 1.00 0.00 O ATOM 768 CB ASP A 54 -15.653 -37.836 10.897 1.00 0.00 C ATOM 769 CG ASP A 54 -15.682 -37.468 12.368 1.00 0.00 C ATOM 770 OD1 ASP A 54 -16.782 -37.187 12.888 1.00 0.00 O ATOM 771 OD2 ASP A 54 -14.604 -37.461 12.998 1.00 0.00 O ATOM 0 H ASP A 54 -16.130 -37.886 8.454 1.00 0.00 H new ATOM 0 HA ASP A 54 -16.054 -35.782 10.412 1.00 0.00 H new ATOM 0 HB2 ASP A 54 -16.575 -38.356 10.637 1.00 0.00 H new ATOM 0 HB3 ASP A 54 -14.833 -38.531 10.716 1.00 0.00 H new ATOM 776 N GLY A 55 -13.631 -35.255 10.758 1.00 0.00 N ATOM 777 CA GLY A 55 -12.254 -34.796 10.773 1.00 0.00 C ATOM 778 C GLY A 55 -11.794 -34.301 9.416 1.00 0.00 C ATOM 779 O GLY A 55 -10.601 -34.317 9.114 1.00 0.00 O ATOM 0 H GLY A 55 -14.245 -34.790 11.427 1.00 0.00 H new ATOM 0 HA2 GLY A 55 -12.149 -33.994 11.504 1.00 0.00 H new ATOM 0 HA3 GLY A 55 -11.606 -35.610 11.098 1.00 0.00 H new ATOM 783 N ALA A 56 -12.743 -33.863 8.595 1.00 0.00 N ATOM 784 CA ALA A 56 -12.428 -33.361 7.263 1.00 0.00 C ATOM 785 C ALA A 56 -12.087 -31.876 7.302 1.00 0.00 C ATOM 786 O ALA A 56 -11.201 -31.413 6.584 1.00 0.00 O ATOM 787 CB ALA A 56 -13.592 -33.613 6.315 1.00 0.00 C ATOM 0 H ALA A 56 -13.736 -33.846 8.829 1.00 0.00 H new ATOM 0 HA ALA A 56 -11.553 -33.898 6.897 1.00 0.00 H new ATOM 0 HB1 ALA A 56 -13.343 -33.233 5.324 1.00 0.00 H new ATOM 0 HB2 ALA A 56 -13.787 -34.684 6.255 1.00 0.00 H new ATOM 0 HB3 ALA A 56 -14.481 -33.103 6.686 1.00 0.00 H new ATOM 793 N ALA A 57 -12.797 -31.132 8.144 1.00 0.00 N ATOM 794 CA ALA A 57 -12.569 -29.699 8.277 1.00 0.00 C ATOM 795 C ALA A 57 -11.157 -29.412 8.779 1.00 0.00 C ATOM 796 O ALA A 57 -10.773 -29.847 9.864 1.00 0.00 O ATOM 797 CB ALA A 57 -13.599 -29.085 9.214 1.00 0.00 C ATOM 0 H ALA A 57 -13.535 -31.499 8.745 1.00 0.00 H new ATOM 0 HA ALA A 57 -12.675 -29.246 7.291 1.00 0.00 H new ATOM 0 HB1 ALA A 57 -13.416 -28.014 9.304 1.00 0.00 H new ATOM 0 HB2 ALA A 57 -14.599 -29.250 8.814 1.00 0.00 H new ATOM 0 HB3 ALA A 57 -13.520 -29.550 10.197 1.00 0.00 H new ATOM 803 N VAL A 58 -10.389 -28.678 7.981 1.00 0.00 N ATOM 804 CA VAL A 58 -9.019 -28.333 8.344 1.00 0.00 C ATOM 805 C VAL A 58 -8.907 -26.862 8.731 1.00 0.00 C ATOM 806 O VAL A 58 -8.244 -26.516 9.707 1.00 0.00 O ATOM 807 CB VAL A 58 -8.042 -28.624 7.190 1.00 0.00 C ATOM 808 CG1 VAL A 58 -8.277 -30.019 6.631 1.00 0.00 C ATOM 809 CG2 VAL A 58 -8.179 -27.573 6.099 1.00 0.00 C ATOM 0 H VAL A 58 -10.692 -28.311 7.079 1.00 0.00 H new ATOM 0 HA VAL A 58 -8.753 -28.953 9.200 1.00 0.00 H new ATOM 0 HB VAL A 58 -7.024 -28.581 7.578 1.00 0.00 H new ATOM 0 HG11 VAL A 58 -7.578 -30.207 5.816 1.00 0.00 H new ATOM 0 HG12 VAL A 58 -8.124 -30.757 7.418 1.00 0.00 H new ATOM 0 HG13 VAL A 58 -9.298 -30.094 6.257 1.00 0.00 H new ATOM 0 HG21 VAL A 58 -7.481 -27.794 5.291 1.00 0.00 H new ATOM 0 HG22 VAL A 58 -9.198 -27.582 5.711 1.00 0.00 H new ATOM 0 HG23 VAL A 58 -7.956 -26.589 6.512 1.00 0.00 H new ATOM 819 N GLY A 59 -9.562 -26.001 7.959 1.00 0.00 N ATOM 820 CA GLY A 59 -9.524 -24.577 8.237 1.00 0.00 C ATOM 821 C GLY A 59 -10.856 -23.900 7.981 1.00 0.00 C ATOM 822 O GLY A 59 -11.782 -24.518 7.455 1.00 0.00 O ATOM 0 H GLY A 59 -10.119 -26.264 7.146 1.00 0.00 H new ATOM 0 HA2 GLY A 59 -9.234 -24.421 9.276 1.00 0.00 H new ATOM 0 HA3 GLY A 59 -8.758 -24.110 7.619 1.00 0.00 H new ATOM 826 N ILE A 60 -10.953 -22.629 8.354 1.00 0.00 N ATOM 827 CA ILE A 60 -12.182 -21.868 8.162 1.00 0.00 C ATOM 828 C ILE A 60 -11.987 -20.761 7.132 1.00 0.00 C ATOM 829 O ILE A 60 -11.185 -19.847 7.330 1.00 0.00 O ATOM 830 CB ILE A 60 -12.670 -21.245 9.483 1.00 0.00 C ATOM 831 CG1 ILE A 60 -12.805 -22.323 10.561 1.00 0.00 C ATOM 832 CG2 ILE A 60 -13.997 -20.530 9.272 1.00 0.00 C ATOM 833 CD1 ILE A 60 -12.726 -21.780 11.971 1.00 0.00 C ATOM 0 H ILE A 60 -10.196 -22.104 8.791 1.00 0.00 H new ATOM 0 HA ILE A 60 -12.935 -22.569 7.801 1.00 0.00 H new ATOM 0 HB ILE A 60 -11.934 -20.514 9.817 1.00 0.00 H new ATOM 0 HG12 ILE A 60 -13.757 -22.838 10.431 1.00 0.00 H new ATOM 0 HG13 ILE A 60 -12.019 -23.065 10.422 1.00 0.00 H new ATOM 0 HG21 ILE A 60 -14.330 -20.095 10.214 1.00 0.00 H new ATOM 0 HG22 ILE A 60 -13.871 -19.740 8.532 1.00 0.00 H new ATOM 0 HG23 ILE A 60 -14.742 -21.243 8.919 1.00 0.00 H new ATOM 0 HD11 ILE A 60 -12.829 -22.599 12.683 1.00 0.00 H new ATOM 0 HD12 ILE A 60 -11.764 -21.290 12.119 1.00 0.00 H new ATOM 0 HD13 ILE A 60 -13.528 -21.059 12.129 1.00 0.00 H new ATOM 845 N LEU A 61 -12.728 -20.847 6.032 1.00 0.00 N ATOM 846 CA LEU A 61 -12.639 -19.851 4.970 1.00 0.00 C ATOM 847 C LEU A 61 -13.055 -18.475 5.478 1.00 0.00 C ATOM 848 O LEU A 61 -14.200 -18.271 5.882 1.00 0.00 O ATOM 849 CB LEU A 61 -13.519 -20.259 3.787 1.00 0.00 C ATOM 850 CG LEU A 61 -13.027 -19.829 2.405 1.00 0.00 C ATOM 851 CD1 LEU A 61 -14.202 -19.587 1.471 1.00 0.00 C ATOM 852 CD2 LEU A 61 -12.162 -18.581 2.511 1.00 0.00 C ATOM 0 H LEU A 61 -13.397 -21.596 5.853 1.00 0.00 H new ATOM 0 HA LEU A 61 -11.601 -19.797 4.641 1.00 0.00 H new ATOM 0 HB2 LEU A 61 -13.621 -21.344 3.793 1.00 0.00 H new ATOM 0 HB3 LEU A 61 -14.515 -19.845 3.941 1.00 0.00 H new ATOM 0 HG LEU A 61 -12.420 -20.634 1.991 1.00 0.00 H new ATOM 0 HD11 LEU A 61 -13.832 -19.282 0.492 1.00 0.00 H new ATOM 0 HD12 LEU A 61 -14.781 -20.505 1.370 1.00 0.00 H new ATOM 0 HD13 LEU A 61 -14.836 -18.801 1.880 1.00 0.00 H new ATOM 0 HD21 LEU A 61 -11.821 -18.289 1.518 1.00 0.00 H new ATOM 0 HD22 LEU A 61 -12.745 -17.770 2.947 1.00 0.00 H new ATOM 0 HD23 LEU A 61 -11.300 -18.789 3.144 1.00 0.00 H new ATOM 864 N ALA A 62 -12.118 -17.532 5.453 1.00 0.00 N ATOM 865 CA ALA A 62 -12.389 -16.174 5.908 1.00 0.00 C ATOM 866 C ALA A 62 -13.184 -15.395 4.865 1.00 0.00 C ATOM 867 O ALA A 62 -14.142 -14.696 5.195 1.00 0.00 O ATOM 868 CB ALA A 62 -11.087 -15.455 6.227 1.00 0.00 C ATOM 0 H ALA A 62 -11.165 -17.684 5.123 1.00 0.00 H new ATOM 0 HA ALA A 62 -12.990 -16.234 6.815 1.00 0.00 H new ATOM 0 HB1 ALA A 62 -11.304 -14.442 6.566 1.00 0.00 H new ATOM 0 HB2 ALA A 62 -10.557 -15.994 7.012 1.00 0.00 H new ATOM 0 HB3 ALA A 62 -10.466 -15.413 5.332 1.00 0.00 H new ATOM 874 N VAL A 63 -12.779 -15.518 3.605 1.00 0.00 N ATOM 875 CA VAL A 63 -13.454 -14.826 2.514 1.00 0.00 C ATOM 876 C VAL A 63 -14.288 -15.793 1.681 1.00 0.00 C ATOM 877 O VAL A 63 -13.931 -16.960 1.525 1.00 0.00 O ATOM 878 CB VAL A 63 -12.446 -14.111 1.594 1.00 0.00 C ATOM 879 CG1 VAL A 63 -11.888 -15.078 0.560 1.00 0.00 C ATOM 880 CG2 VAL A 63 -13.097 -12.914 0.919 1.00 0.00 C ATOM 0 H VAL A 63 -11.986 -16.091 3.315 1.00 0.00 H new ATOM 0 HA VAL A 63 -14.110 -14.084 2.969 1.00 0.00 H new ATOM 0 HB VAL A 63 -11.618 -13.749 2.203 1.00 0.00 H new ATOM 0 HG11 VAL A 63 -11.178 -14.555 -0.081 1.00 0.00 H new ATOM 0 HG12 VAL A 63 -11.383 -15.900 1.066 1.00 0.00 H new ATOM 0 HG13 VAL A 63 -12.703 -15.472 -0.047 1.00 0.00 H new ATOM 0 HG21 VAL A 63 -12.371 -12.421 0.273 1.00 0.00 H new ATOM 0 HG22 VAL A 63 -13.945 -13.250 0.322 1.00 0.00 H new ATOM 0 HG23 VAL A 63 -13.443 -12.212 1.678 1.00 0.00 H new ATOM 890 N ALA A 64 -15.401 -15.299 1.149 1.00 0.00 N ATOM 891 CA ALA A 64 -16.285 -16.119 0.330 1.00 0.00 C ATOM 892 C ALA A 64 -15.711 -16.316 -1.069 1.00 0.00 C ATOM 893 O ALA A 64 -15.234 -15.369 -1.694 1.00 0.00 O ATOM 894 CB ALA A 64 -17.667 -15.488 0.251 1.00 0.00 C ATOM 0 H ALA A 64 -15.712 -14.335 1.270 1.00 0.00 H new ATOM 0 HA ALA A 64 -16.371 -17.098 0.801 1.00 0.00 H new ATOM 0 HB1 ALA A 64 -18.317 -16.111 -0.364 1.00 0.00 H new ATOM 0 HB2 ALA A 64 -18.087 -15.404 1.253 1.00 0.00 H new ATOM 0 HB3 ALA A 64 -17.589 -14.496 -0.193 1.00 0.00 H new ATOM 900 N ALA A 65 -15.761 -17.552 -1.555 1.00 0.00 N ATOM 901 CA ALA A 65 -15.247 -17.873 -2.881 1.00 0.00 C ATOM 902 C ALA A 65 -16.104 -18.936 -3.559 1.00 0.00 C ATOM 903 O ALA A 65 -17.022 -19.487 -2.952 1.00 0.00 O ATOM 904 CB ALA A 65 -13.801 -18.338 -2.788 1.00 0.00 C ATOM 0 H ALA A 65 -16.152 -18.347 -1.050 1.00 0.00 H new ATOM 0 HA ALA A 65 -15.288 -16.969 -3.488 1.00 0.00 H new ATOM 0 HB1 ALA A 65 -13.430 -18.574 -3.785 1.00 0.00 H new ATOM 0 HB2 ALA A 65 -13.192 -17.546 -2.352 1.00 0.00 H new ATOM 0 HB3 ALA A 65 -13.744 -19.227 -2.160 1.00 0.00 H new ATOM 910 N ASP A 66 -15.798 -19.220 -4.821 1.00 0.00 N ATOM 911 CA ASP A 66 -16.540 -20.218 -5.582 1.00 0.00 C ATOM 912 C ASP A 66 -15.591 -21.130 -6.353 1.00 0.00 C ATOM 913 O ASP A 66 -14.377 -20.927 -6.344 1.00 0.00 O ATOM 914 CB ASP A 66 -17.510 -19.536 -6.548 1.00 0.00 C ATOM 915 CG ASP A 66 -17.009 -18.182 -7.012 1.00 0.00 C ATOM 916 OD1 ASP A 66 -15.790 -17.933 -6.906 1.00 0.00 O ATOM 917 OD2 ASP A 66 -17.836 -17.371 -7.479 1.00 0.00 O ATOM 0 H ASP A 66 -15.041 -18.773 -5.338 1.00 0.00 H new ATOM 0 HA ASP A 66 -17.108 -20.827 -4.879 1.00 0.00 H new ATOM 0 HB2 ASP A 66 -17.667 -20.178 -7.414 1.00 0.00 H new ATOM 0 HB3 ASP A 66 -18.478 -19.415 -6.061 1.00 0.00 H new ATOM 922 N GLN A 67 -16.153 -22.134 -7.017 1.00 0.00 N ATOM 923 CA GLN A 67 -15.356 -23.078 -7.792 1.00 0.00 C ATOM 924 C GLN A 67 -14.542 -22.355 -8.860 1.00 0.00 C ATOM 925 O GLN A 67 -13.530 -22.868 -9.339 1.00 0.00 O ATOM 926 CB GLN A 67 -16.259 -24.126 -8.444 1.00 0.00 C ATOM 927 CG GLN A 67 -17.410 -23.528 -9.238 1.00 0.00 C ATOM 928 CD GLN A 67 -17.015 -23.166 -10.656 1.00 0.00 C ATOM 929 OE1 GLN A 67 -17.209 -21.904 -11.021 1.00 0.00 O flip ATOM 930 NE2 GLN A 67 -16.540 -24.011 -11.416 1.00 0.00 N flip ATOM 0 H GLN A 67 -17.157 -22.315 -7.034 1.00 0.00 H new ATOM 0 HA GLN A 67 -14.666 -23.577 -7.111 1.00 0.00 H new ATOM 0 HB2 GLN A 67 -15.658 -24.751 -9.105 1.00 0.00 H new ATOM 0 HB3 GLN A 67 -16.663 -24.778 -7.670 1.00 0.00 H new ATOM 0 HG2 GLN A 67 -18.236 -24.239 -9.265 1.00 0.00 H new ATOM 0 HG3 GLN A 67 -17.774 -22.636 -8.727 1.00 0.00 H new ATOM 0 HE21 GLN A 67 -16.408 -24.970 -11.094 1.00 0.00 H new ATOM 0 HE22 GLN A 67 -16.279 -23.752 -12.367 1.00 0.00 H new ATOM 939 N THR A 68 -14.990 -21.159 -9.230 1.00 0.00 N ATOM 940 CA THR A 68 -14.305 -20.366 -10.243 1.00 0.00 C ATOM 941 C THR A 68 -13.151 -19.577 -9.635 1.00 0.00 C ATOM 942 O THR A 68 -12.453 -18.842 -10.334 1.00 0.00 O ATOM 943 CB THR A 68 -15.270 -19.389 -10.939 1.00 0.00 C ATOM 944 OG1 THR A 68 -14.649 -18.833 -12.104 1.00 0.00 O ATOM 945 CG2 THR A 68 -15.682 -18.269 -9.995 1.00 0.00 C ATOM 0 H THR A 68 -15.825 -20.718 -8.843 1.00 0.00 H new ATOM 0 HA THR A 68 -13.914 -21.066 -10.982 1.00 0.00 H new ATOM 0 HB THR A 68 -16.162 -19.942 -11.232 1.00 0.00 H new ATOM 0 HG1 THR A 68 -13.679 -18.793 -11.970 1.00 0.00 H new ATOM 0 HG21 THR A 68 -16.364 -17.592 -10.510 1.00 0.00 H new ATOM 0 HG22 THR A 68 -16.181 -18.693 -9.123 1.00 0.00 H new ATOM 0 HG23 THR A 68 -14.797 -17.719 -9.675 1.00 0.00 H new ATOM 953 N SER A 69 -12.955 -19.734 -8.330 1.00 0.00 N ATOM 954 CA SER A 69 -11.887 -19.033 -7.627 1.00 0.00 C ATOM 955 C SER A 69 -10.533 -19.670 -7.923 1.00 0.00 C ATOM 956 O SER A 69 -10.427 -20.886 -8.087 1.00 0.00 O ATOM 957 CB SER A 69 -12.149 -19.041 -6.120 1.00 0.00 C ATOM 958 OG SER A 69 -13.262 -18.228 -5.791 1.00 0.00 O ATOM 0 H SER A 69 -13.522 -20.341 -7.738 1.00 0.00 H new ATOM 0 HA SER A 69 -11.869 -18.002 -7.980 1.00 0.00 H new ATOM 0 HB2 SER A 69 -12.329 -20.062 -5.785 1.00 0.00 H new ATOM 0 HB3 SER A 69 -11.265 -18.683 -5.592 1.00 0.00 H new ATOM 0 HG SER A 69 -12.953 -17.422 -5.327 1.00 0.00 H new ATOM 964 N THR A 70 -9.497 -18.839 -7.990 1.00 0.00 N ATOM 965 CA THR A 70 -8.149 -19.319 -8.268 1.00 0.00 C ATOM 966 C THR A 70 -7.309 -19.364 -6.996 1.00 0.00 C ATOM 967 O THR A 70 -6.207 -19.912 -6.987 1.00 0.00 O ATOM 968 CB THR A 70 -7.439 -18.430 -9.306 1.00 0.00 C ATOM 969 OG1 THR A 70 -6.185 -19.014 -9.675 1.00 0.00 O ATOM 970 CG2 THR A 70 -7.210 -17.031 -8.755 1.00 0.00 C ATOM 0 H THR A 70 -9.566 -17.830 -7.855 1.00 0.00 H new ATOM 0 HA THR A 70 -8.249 -20.327 -8.671 1.00 0.00 H new ATOM 0 HB THR A 70 -8.078 -18.356 -10.186 1.00 0.00 H new ATOM 0 HG1 THR A 70 -5.783 -19.447 -8.893 1.00 0.00 H new ATOM 0 HG21 THR A 70 -6.707 -16.422 -9.506 1.00 0.00 H new ATOM 0 HG22 THR A 70 -8.169 -16.578 -8.503 1.00 0.00 H new ATOM 0 HG23 THR A 70 -6.590 -17.089 -7.861 1.00 0.00 H new ATOM 978 N THR A 71 -7.838 -18.786 -5.922 1.00 0.00 N ATOM 979 CA THR A 71 -7.137 -18.760 -4.645 1.00 0.00 C ATOM 980 C THR A 71 -8.107 -18.540 -3.490 1.00 0.00 C ATOM 981 O THR A 71 -9.088 -17.807 -3.621 1.00 0.00 O ATOM 982 CB THR A 71 -6.062 -17.657 -4.616 1.00 0.00 C ATOM 983 OG1 THR A 71 -5.029 -17.955 -5.561 1.00 0.00 O ATOM 984 CG2 THR A 71 -5.461 -17.524 -3.225 1.00 0.00 C ATOM 0 H THR A 71 -8.750 -18.330 -5.912 1.00 0.00 H new ATOM 0 HA THR A 71 -6.654 -19.730 -4.530 1.00 0.00 H new ATOM 0 HB THR A 71 -6.535 -16.712 -4.882 1.00 0.00 H new ATOM 0 HG1 THR A 71 -5.187 -18.841 -5.949 1.00 0.00 H new ATOM 0 HG21 THR A 71 -4.705 -16.739 -3.229 1.00 0.00 H new ATOM 0 HG22 THR A 71 -6.245 -17.268 -2.513 1.00 0.00 H new ATOM 0 HG23 THR A 71 -5.002 -18.469 -2.935 1.00 0.00 H new ATOM 992 N LEU A 72 -7.826 -19.177 -2.358 1.00 0.00 N ATOM 993 CA LEU A 72 -8.674 -19.049 -1.178 1.00 0.00 C ATOM 994 C LEU A 72 -7.872 -18.546 0.017 1.00 0.00 C ATOM 995 O LEU A 72 -6.682 -18.838 0.148 1.00 0.00 O ATOM 996 CB LEU A 72 -9.321 -20.394 -0.842 1.00 0.00 C ATOM 997 CG LEU A 72 -10.169 -21.026 -1.947 1.00 0.00 C ATOM 998 CD1 LEU A 72 -10.789 -22.328 -1.466 1.00 0.00 C ATOM 999 CD2 LEU A 72 -11.249 -20.058 -2.410 1.00 0.00 C ATOM 0 H LEU A 72 -7.018 -19.787 -2.233 1.00 0.00 H new ATOM 0 HA LEU A 72 -9.455 -18.322 -1.400 1.00 0.00 H new ATOM 0 HB2 LEU A 72 -8.533 -21.096 -0.570 1.00 0.00 H new ATOM 0 HB3 LEU A 72 -9.948 -20.263 0.040 1.00 0.00 H new ATOM 0 HG LEU A 72 -9.520 -21.248 -2.794 1.00 0.00 H new ATOM 0 HD11 LEU A 72 -11.389 -22.763 -2.266 1.00 0.00 H new ATOM 0 HD12 LEU A 72 -9.999 -23.025 -1.185 1.00 0.00 H new ATOM 0 HD13 LEU A 72 -11.424 -22.131 -0.602 1.00 0.00 H new ATOM 0 HD21 LEU A 72 -11.843 -20.524 -3.196 1.00 0.00 H new ATOM 0 HD22 LEU A 72 -11.895 -19.805 -1.569 1.00 0.00 H new ATOM 0 HD23 LEU A 72 -10.784 -19.151 -2.796 1.00 0.00 H new ATOM 1011 N THR A 73 -8.530 -17.788 0.889 1.00 0.00 N ATOM 1012 CA THR A 73 -7.879 -17.245 2.074 1.00 0.00 C ATOM 1013 C THR A 73 -8.596 -17.684 3.346 1.00 0.00 C ATOM 1014 O THR A 73 -9.560 -17.052 3.777 1.00 0.00 O ATOM 1015 CB THR A 73 -7.829 -15.706 2.032 1.00 0.00 C ATOM 1016 OG1 THR A 73 -7.182 -15.270 0.832 1.00 0.00 O ATOM 1017 CG2 THR A 73 -7.089 -15.155 3.242 1.00 0.00 C ATOM 0 H THR A 73 -9.514 -17.536 0.796 1.00 0.00 H new ATOM 0 HA THR A 73 -6.861 -17.635 2.081 1.00 0.00 H new ATOM 0 HB THR A 73 -8.852 -15.331 2.050 1.00 0.00 H new ATOM 0 HG1 THR A 73 -7.156 -14.291 0.812 1.00 0.00 H new ATOM 0 HG21 THR A 73 -7.067 -14.066 3.190 1.00 0.00 H new ATOM 0 HG22 THR A 73 -7.601 -15.464 4.153 1.00 0.00 H new ATOM 0 HG23 THR A 73 -6.069 -15.539 3.250 1.00 0.00 H new ATOM 1025 N PHE A 74 -8.119 -18.771 3.944 1.00 0.00 N ATOM 1026 CA PHE A 74 -8.715 -19.295 5.167 1.00 0.00 C ATOM 1027 C PHE A 74 -7.736 -19.199 6.334 1.00 0.00 C ATOM 1028 O PHE A 74 -6.528 -19.075 6.135 1.00 0.00 O ATOM 1029 CB PHE A 74 -9.146 -20.749 4.967 1.00 0.00 C ATOM 1030 CG PHE A 74 -8.003 -21.678 4.673 1.00 0.00 C ATOM 1031 CD1 PHE A 74 -7.395 -21.678 3.428 1.00 0.00 C ATOM 1032 CD2 PHE A 74 -7.537 -22.552 5.642 1.00 0.00 C ATOM 1033 CE1 PHE A 74 -6.343 -22.532 3.154 1.00 0.00 C ATOM 1034 CE2 PHE A 74 -6.485 -23.408 5.374 1.00 0.00 C ATOM 1035 CZ PHE A 74 -5.888 -23.398 4.128 1.00 0.00 C ATOM 0 H PHE A 74 -7.321 -19.306 3.601 1.00 0.00 H new ATOM 0 HA PHE A 74 -9.592 -18.692 5.401 1.00 0.00 H new ATOM 0 HB2 PHE A 74 -9.662 -21.093 5.863 1.00 0.00 H new ATOM 0 HB3 PHE A 74 -9.863 -20.798 4.148 1.00 0.00 H new ATOM 0 HD1 PHE A 74 -7.747 -21.003 2.662 1.00 0.00 H new ATOM 0 HD2 PHE A 74 -8.001 -22.565 6.617 1.00 0.00 H new ATOM 0 HE1 PHE A 74 -5.878 -22.522 2.179 1.00 0.00 H new ATOM 0 HE2 PHE A 74 -6.130 -24.084 6.138 1.00 0.00 H new ATOM 0 HZ PHE A 74 -5.067 -24.067 3.916 1.00 0.00 H new ATOM 1045 N TYR A 75 -8.268 -19.256 7.550 1.00 0.00 N ATOM 1046 CA TYR A 75 -7.443 -19.173 8.749 1.00 0.00 C ATOM 1047 C TYR A 75 -6.644 -20.457 8.951 1.00 0.00 C ATOM 1048 O TYR A 75 -6.925 -21.482 8.330 1.00 0.00 O ATOM 1049 CB TYR A 75 -8.316 -18.904 9.976 1.00 0.00 C ATOM 1050 CG TYR A 75 -8.765 -17.465 10.096 1.00 0.00 C ATOM 1051 CD1 TYR A 75 -7.898 -16.483 10.558 1.00 0.00 C ATOM 1052 CD2 TYR A 75 -10.056 -17.088 9.748 1.00 0.00 C ATOM 1053 CE1 TYR A 75 -8.304 -15.167 10.670 1.00 0.00 C ATOM 1054 CE2 TYR A 75 -10.470 -15.775 9.856 1.00 0.00 C ATOM 1055 CZ TYR A 75 -9.591 -14.818 10.317 1.00 0.00 C ATOM 1056 OH TYR A 75 -10.000 -13.509 10.427 1.00 0.00 O ATOM 0 H TYR A 75 -9.266 -19.359 7.731 1.00 0.00 H new ATOM 0 HA TYR A 75 -6.743 -18.347 8.621 1.00 0.00 H new ATOM 0 HB2 TYR A 75 -9.195 -19.548 9.935 1.00 0.00 H new ATOM 0 HB3 TYR A 75 -7.762 -19.179 10.873 1.00 0.00 H new ATOM 0 HD1 TYR A 75 -6.889 -16.753 10.834 1.00 0.00 H new ATOM 0 HD2 TYR A 75 -10.748 -17.835 9.387 1.00 0.00 H new ATOM 0 HE1 TYR A 75 -7.618 -14.416 11.032 1.00 0.00 H new ATOM 0 HE2 TYR A 75 -11.477 -15.499 9.581 1.00 0.00 H new ATOM 0 HH TYR A 75 -10.933 -13.432 10.137 1.00 0.00 H new ATOM 1066 N LYS A 76 -5.645 -20.393 9.825 1.00 0.00 N ATOM 1067 CA LYS A 76 -4.804 -21.549 10.112 1.00 0.00 C ATOM 1068 C LYS A 76 -5.101 -22.105 11.501 1.00 0.00 C ATOM 1069 O LYS A 76 -5.138 -23.320 11.699 1.00 0.00 O ATOM 1070 CB LYS A 76 -3.325 -21.168 10.009 1.00 0.00 C ATOM 1071 CG LYS A 76 -2.897 -20.115 11.017 1.00 0.00 C ATOM 1072 CD LYS A 76 -2.412 -20.747 12.311 1.00 0.00 C ATOM 1073 CE LYS A 76 -0.988 -21.263 12.180 1.00 0.00 C ATOM 1074 NZ LYS A 76 -0.437 -21.710 13.489 1.00 0.00 N ATOM 0 H LYS A 76 -5.398 -19.552 10.347 1.00 0.00 H new ATOM 0 HA LYS A 76 -5.026 -22.321 9.375 1.00 0.00 H new ATOM 0 HB2 LYS A 76 -2.717 -22.062 10.150 1.00 0.00 H new ATOM 0 HB3 LYS A 76 -3.122 -20.800 9.003 1.00 0.00 H new ATOM 0 HG2 LYS A 76 -2.103 -19.503 10.590 1.00 0.00 H new ATOM 0 HG3 LYS A 76 -3.734 -19.450 11.227 1.00 0.00 H new ATOM 0 HD2 LYS A 76 -2.462 -20.014 13.116 1.00 0.00 H new ATOM 0 HD3 LYS A 76 -3.074 -21.568 12.586 1.00 0.00 H new ATOM 0 HE2 LYS A 76 -0.966 -22.093 11.474 1.00 0.00 H new ATOM 0 HE3 LYS A 76 -0.354 -20.478 11.768 1.00 0.00 H new ATOM 0 HZ1 LYS A 76 0.601 -21.650 13.467 1.00 0.00 H new ATOM 0 HZ2 LYS A 76 -0.803 -21.099 14.247 1.00 0.00 H new ATOM 0 HZ3 LYS A 76 -0.723 -22.694 13.668 1.00 0.00 H new ATOM 1088 N SER A 77 -5.313 -21.209 12.460 1.00 0.00 N ATOM 1089 CA SER A 77 -5.604 -21.611 13.831 1.00 0.00 C ATOM 1090 C SER A 77 -6.130 -20.431 14.643 1.00 0.00 C ATOM 1091 O SER A 77 -6.169 -19.300 14.161 1.00 0.00 O ATOM 1092 CB SER A 77 -4.350 -22.183 14.495 1.00 0.00 C ATOM 1093 OG SER A 77 -3.881 -23.325 13.798 1.00 0.00 O ATOM 0 H SER A 77 -5.289 -20.200 12.313 1.00 0.00 H new ATOM 0 HA SER A 77 -6.374 -22.382 13.801 1.00 0.00 H new ATOM 0 HB2 SER A 77 -3.569 -21.423 14.521 1.00 0.00 H new ATOM 0 HB3 SER A 77 -4.571 -22.449 15.529 1.00 0.00 H new ATOM 0 HG SER A 77 -4.586 -23.658 13.204 1.00 0.00 H new ATOM 1099 N GLY A 78 -6.532 -20.705 15.880 1.00 0.00 N ATOM 1100 CA GLY A 78 -7.050 -19.657 16.741 1.00 0.00 C ATOM 1101 C GLY A 78 -8.463 -19.939 17.212 1.00 0.00 C ATOM 1102 O GLY A 78 -9.102 -20.887 16.754 1.00 0.00 O ATOM 0 H GLY A 78 -6.508 -21.633 16.302 1.00 0.00 H new ATOM 0 HA2 GLY A 78 -6.397 -19.546 17.607 1.00 0.00 H new ATOM 0 HA3 GLY A 78 -7.032 -18.708 16.205 1.00 0.00 H new ATOM 1106 N THR A 79 -8.953 -19.116 18.134 1.00 0.00 N ATOM 1107 CA THR A 79 -10.298 -19.283 18.670 1.00 0.00 C ATOM 1108 C THR A 79 -11.332 -18.593 17.787 1.00 0.00 C ATOM 1109 O THR A 79 -11.202 -17.411 17.470 1.00 0.00 O ATOM 1110 CB THR A 79 -10.406 -18.723 20.101 1.00 0.00 C ATOM 1111 OG1 THR A 79 -9.354 -19.254 20.915 1.00 0.00 O ATOM 1112 CG2 THR A 79 -11.754 -19.067 20.717 1.00 0.00 C ATOM 0 H THR A 79 -8.438 -18.327 18.525 1.00 0.00 H new ATOM 0 HA THR A 79 -10.499 -20.354 18.691 1.00 0.00 H new ATOM 0 HB THR A 79 -10.314 -17.638 20.051 1.00 0.00 H new ATOM 0 HG1 THR A 79 -9.428 -18.892 21.823 1.00 0.00 H new ATOM 0 HG21 THR A 79 -11.807 -18.661 21.727 1.00 0.00 H new ATOM 0 HG22 THR A 79 -12.551 -18.637 20.111 1.00 0.00 H new ATOM 0 HG23 THR A 79 -11.871 -20.150 20.755 1.00 0.00 H new ATOM 1120 N PHE A 80 -12.359 -19.339 17.394 1.00 0.00 N ATOM 1121 CA PHE A 80 -13.416 -18.798 16.547 1.00 0.00 C ATOM 1122 C PHE A 80 -14.790 -19.061 17.157 1.00 0.00 C ATOM 1123 O PHE A 80 -14.974 -20.018 17.909 1.00 0.00 O ATOM 1124 CB PHE A 80 -13.341 -19.412 15.147 1.00 0.00 C ATOM 1125 CG PHE A 80 -12.108 -19.018 14.385 1.00 0.00 C ATOM 1126 CD1 PHE A 80 -10.926 -19.724 14.542 1.00 0.00 C ATOM 1127 CD2 PHE A 80 -12.131 -17.942 13.513 1.00 0.00 C ATOM 1128 CE1 PHE A 80 -9.789 -19.364 13.842 1.00 0.00 C ATOM 1129 CE2 PHE A 80 -10.998 -17.579 12.810 1.00 0.00 C ATOM 1130 CZ PHE A 80 -9.825 -18.290 12.976 1.00 0.00 C ATOM 0 H PHE A 80 -12.482 -20.319 17.648 1.00 0.00 H new ATOM 0 HA PHE A 80 -13.272 -17.720 16.472 1.00 0.00 H new ATOM 0 HB2 PHE A 80 -13.374 -20.498 15.233 1.00 0.00 H new ATOM 0 HB3 PHE A 80 -14.221 -19.111 14.579 1.00 0.00 H new ATOM 0 HD1 PHE A 80 -10.892 -20.565 15.219 1.00 0.00 H new ATOM 0 HD2 PHE A 80 -13.044 -17.381 13.381 1.00 0.00 H new ATOM 0 HE1 PHE A 80 -8.874 -19.923 13.973 1.00 0.00 H new ATOM 0 HE2 PHE A 80 -11.029 -16.740 12.131 1.00 0.00 H new ATOM 0 HZ PHE A 80 -8.938 -18.006 12.429 1.00 0.00 H new ATOM 1140 N ARG A 81 -15.751 -18.204 16.828 1.00 0.00 N ATOM 1141 CA ARG A 81 -17.107 -18.342 17.344 1.00 0.00 C ATOM 1142 C ARG A 81 -17.932 -19.274 16.462 1.00 0.00 C ATOM 1143 O ARG A 81 -17.935 -19.147 15.237 1.00 0.00 O ATOM 1144 CB ARG A 81 -17.784 -16.973 17.430 1.00 0.00 C ATOM 1145 CG ARG A 81 -17.449 -16.207 18.700 1.00 0.00 C ATOM 1146 CD ARG A 81 -17.580 -14.706 18.496 1.00 0.00 C ATOM 1147 NE ARG A 81 -18.010 -14.023 19.713 1.00 0.00 N ATOM 1148 CZ ARG A 81 -17.789 -12.735 19.950 1.00 0.00 C ATOM 1149 NH1 ARG A 81 -17.147 -11.994 19.058 1.00 0.00 N ATOM 1150 NH2 ARG A 81 -18.212 -12.186 21.082 1.00 0.00 N ATOM 0 H ARG A 81 -15.615 -17.407 16.206 1.00 0.00 H new ATOM 0 HA ARG A 81 -17.047 -18.774 18.343 1.00 0.00 H new ATOM 0 HB2 ARG A 81 -17.489 -16.376 16.567 1.00 0.00 H new ATOM 0 HB3 ARG A 81 -18.864 -17.107 17.371 1.00 0.00 H new ATOM 0 HG2 ARG A 81 -18.113 -16.525 19.504 1.00 0.00 H new ATOM 0 HG3 ARG A 81 -16.432 -16.445 19.013 1.00 0.00 H new ATOM 0 HD2 ARG A 81 -16.622 -14.299 18.172 1.00 0.00 H new ATOM 0 HD3 ARG A 81 -18.296 -14.510 17.698 1.00 0.00 H new ATOM 0 HE ARG A 81 -18.507 -14.565 20.420 1.00 0.00 H new ATOM 0 HH11 ARG A 81 -16.821 -12.413 18.187 1.00 0.00 H new ATOM 0 HH12 ARG A 81 -16.979 -11.005 19.243 1.00 0.00 H new ATOM 0 HH21 ARG A 81 -18.707 -12.753 21.770 1.00 0.00 H new ATOM 0 HH22 ARG A 81 -18.042 -11.197 21.264 1.00 0.00 H new ATOM 1164 N TYR A 82 -18.631 -20.212 17.092 1.00 0.00 N ATOM 1165 CA TYR A 82 -19.457 -21.168 16.365 1.00 0.00 C ATOM 1166 C TYR A 82 -20.756 -20.519 15.896 1.00 0.00 C ATOM 1167 O TYR A 82 -21.099 -20.576 14.716 1.00 0.00 O ATOM 1168 CB TYR A 82 -19.769 -22.379 17.247 1.00 0.00 C ATOM 1169 CG TYR A 82 -20.765 -23.335 16.632 1.00 0.00 C ATOM 1170 CD1 TYR A 82 -22.095 -22.971 16.462 1.00 0.00 C ATOM 1171 CD2 TYR A 82 -20.376 -24.604 16.219 1.00 0.00 C ATOM 1172 CE1 TYR A 82 -23.008 -23.842 15.901 1.00 0.00 C ATOM 1173 CE2 TYR A 82 -21.282 -25.481 15.656 1.00 0.00 C ATOM 1174 CZ TYR A 82 -22.597 -25.096 15.499 1.00 0.00 C ATOM 1175 OH TYR A 82 -23.504 -25.966 14.939 1.00 0.00 O ATOM 0 H TYR A 82 -18.642 -20.330 18.105 1.00 0.00 H new ATOM 0 HA TYR A 82 -18.899 -21.499 15.489 1.00 0.00 H new ATOM 0 HB2 TYR A 82 -18.843 -22.916 17.454 1.00 0.00 H new ATOM 0 HB3 TYR A 82 -20.156 -22.030 18.205 1.00 0.00 H new ATOM 0 HD1 TYR A 82 -22.421 -21.990 16.774 1.00 0.00 H new ATOM 0 HD2 TYR A 82 -19.347 -24.909 16.341 1.00 0.00 H new ATOM 0 HE1 TYR A 82 -24.038 -23.543 15.778 1.00 0.00 H new ATOM 0 HE2 TYR A 82 -20.963 -26.463 15.340 1.00 0.00 H new ATOM 0 HH TYR A 82 -24.198 -25.458 14.470 1.00 0.00 H new ATOM 1185 N GLU A 83 -21.473 -19.902 16.830 1.00 0.00 N ATOM 1186 CA GLU A 83 -22.734 -19.243 16.512 1.00 0.00 C ATOM 1187 C GLU A 83 -22.632 -18.479 15.195 1.00 0.00 C ATOM 1188 O GLU A 83 -23.616 -18.339 14.468 1.00 0.00 O ATOM 1189 CB GLU A 83 -23.134 -18.287 17.639 1.00 0.00 C ATOM 1190 CG GLU A 83 -22.091 -17.222 17.932 1.00 0.00 C ATOM 1191 CD GLU A 83 -22.629 -16.102 18.801 1.00 0.00 C ATOM 1192 OE1 GLU A 83 -23.780 -15.675 18.572 1.00 0.00 O ATOM 1193 OE2 GLU A 83 -21.900 -15.653 19.710 1.00 0.00 O ATOM 0 H GLU A 83 -21.202 -19.845 17.812 1.00 0.00 H new ATOM 0 HA GLU A 83 -23.500 -20.012 16.408 1.00 0.00 H new ATOM 0 HB2 GLU A 83 -24.073 -17.801 17.376 1.00 0.00 H new ATOM 0 HB3 GLU A 83 -23.317 -18.864 18.546 1.00 0.00 H new ATOM 0 HG2 GLU A 83 -21.236 -17.683 18.427 1.00 0.00 H new ATOM 0 HG3 GLU A 83 -21.729 -16.806 16.992 1.00 0.00 H new ATOM 1200 N ASP A 84 -21.436 -17.986 14.895 1.00 0.00 N ATOM 1201 CA ASP A 84 -21.203 -17.237 13.666 1.00 0.00 C ATOM 1202 C ASP A 84 -20.851 -18.175 12.516 1.00 0.00 C ATOM 1203 O ASP A 84 -21.336 -18.012 11.397 1.00 0.00 O ATOM 1204 CB ASP A 84 -20.083 -16.216 13.870 1.00 0.00 C ATOM 1205 CG ASP A 84 -20.025 -15.190 12.755 1.00 0.00 C ATOM 1206 OD1 ASP A 84 -21.099 -14.792 12.259 1.00 0.00 O ATOM 1207 OD2 ASP A 84 -18.905 -14.785 12.378 1.00 0.00 O ATOM 0 H ASP A 84 -20.612 -18.092 15.487 1.00 0.00 H new ATOM 0 HA ASP A 84 -22.122 -16.709 13.412 1.00 0.00 H new ATOM 0 HB2 ASP A 84 -20.229 -15.706 14.822 1.00 0.00 H new ATOM 0 HB3 ASP A 84 -19.127 -16.737 13.931 1.00 0.00 H new ATOM 1212 N VAL A 85 -20.002 -19.158 12.800 1.00 0.00 N ATOM 1213 CA VAL A 85 -19.584 -20.123 11.790 1.00 0.00 C ATOM 1214 C VAL A 85 -20.783 -20.856 11.200 1.00 0.00 C ATOM 1215 O VAL A 85 -21.519 -21.539 11.913 1.00 0.00 O ATOM 1216 CB VAL A 85 -18.601 -21.155 12.373 1.00 0.00 C ATOM 1217 CG1 VAL A 85 -18.220 -22.184 11.319 1.00 0.00 C ATOM 1218 CG2 VAL A 85 -17.364 -20.461 12.924 1.00 0.00 C ATOM 0 H VAL A 85 -19.590 -19.307 13.721 1.00 0.00 H new ATOM 0 HA VAL A 85 -19.083 -19.560 11.002 1.00 0.00 H new ATOM 0 HB VAL A 85 -19.093 -21.676 13.194 1.00 0.00 H new ATOM 0 HG11 VAL A 85 -17.525 -22.905 11.749 1.00 0.00 H new ATOM 0 HG12 VAL A 85 -19.115 -22.703 10.977 1.00 0.00 H new ATOM 0 HG13 VAL A 85 -17.746 -21.682 10.475 1.00 0.00 H new ATOM 0 HG21 VAL A 85 -16.680 -21.206 13.332 1.00 0.00 H new ATOM 0 HG22 VAL A 85 -16.868 -19.913 12.123 1.00 0.00 H new ATOM 0 HG23 VAL A 85 -17.657 -19.767 13.712 1.00 0.00 H new ATOM 1228 N LEU A 86 -20.975 -20.710 9.894 1.00 0.00 N ATOM 1229 CA LEU A 86 -22.087 -21.358 9.206 1.00 0.00 C ATOM 1230 C LEU A 86 -21.729 -22.791 8.825 1.00 0.00 C ATOM 1231 O LEU A 86 -21.127 -23.033 7.779 1.00 0.00 O ATOM 1232 CB LEU A 86 -22.471 -20.566 7.956 1.00 0.00 C ATOM 1233 CG LEU A 86 -23.515 -19.466 8.152 1.00 0.00 C ATOM 1234 CD1 LEU A 86 -23.392 -18.413 7.062 1.00 0.00 C ATOM 1235 CD2 LEU A 86 -24.916 -20.058 8.169 1.00 0.00 C ATOM 0 H LEU A 86 -20.375 -20.149 9.290 1.00 0.00 H new ATOM 0 HA LEU A 86 -22.938 -21.384 9.886 1.00 0.00 H new ATOM 0 HB2 LEU A 86 -21.568 -20.113 7.546 1.00 0.00 H new ATOM 0 HB3 LEU A 86 -22.845 -21.265 7.208 1.00 0.00 H new ATOM 0 HG LEU A 86 -23.333 -18.986 9.114 1.00 0.00 H new ATOM 0 HD11 LEU A 86 -24.143 -17.638 7.218 1.00 0.00 H new ATOM 0 HD12 LEU A 86 -22.398 -17.967 7.097 1.00 0.00 H new ATOM 0 HD13 LEU A 86 -23.547 -18.878 6.088 1.00 0.00 H new ATOM 0 HD21 LEU A 86 -25.646 -19.261 8.309 1.00 0.00 H new ATOM 0 HD22 LEU A 86 -25.109 -20.564 7.223 1.00 0.00 H new ATOM 0 HD23 LEU A 86 -24.999 -20.774 8.987 1.00 0.00 H new ATOM 1247 N TRP A 87 -22.105 -23.736 9.679 1.00 0.00 N ATOM 1248 CA TRP A 87 -21.826 -25.146 9.430 1.00 0.00 C ATOM 1249 C TRP A 87 -22.878 -25.755 8.509 1.00 0.00 C ATOM 1250 O TRP A 87 -24.034 -25.331 8.482 1.00 0.00 O ATOM 1251 CB TRP A 87 -21.776 -25.918 10.749 1.00 0.00 C ATOM 1252 CG TRP A 87 -20.983 -25.223 11.814 1.00 0.00 C ATOM 1253 CD1 TRP A 87 -21.415 -24.221 12.635 1.00 0.00 C ATOM 1254 CD2 TRP A 87 -19.620 -25.478 12.172 1.00 0.00 C ATOM 1255 NE1 TRP A 87 -20.403 -23.837 13.481 1.00 0.00 N ATOM 1256 CE2 TRP A 87 -19.292 -24.593 13.218 1.00 0.00 C ATOM 1257 CE3 TRP A 87 -18.646 -26.368 11.712 1.00 0.00 C ATOM 1258 CZ2 TRP A 87 -18.031 -24.574 13.808 1.00 0.00 C ATOM 1259 CZ3 TRP A 87 -17.395 -26.348 12.299 1.00 0.00 C ATOM 1260 CH2 TRP A 87 -17.097 -25.457 13.338 1.00 0.00 C ATOM 0 H TRP A 87 -22.604 -23.552 10.550 1.00 0.00 H new ATOM 0 HA TRP A 87 -20.856 -25.217 8.939 1.00 0.00 H new ATOM 0 HB2 TRP A 87 -22.793 -26.076 11.108 1.00 0.00 H new ATOM 0 HB3 TRP A 87 -21.345 -26.903 10.569 1.00 0.00 H new ATOM 0 HD1 TRP A 87 -22.407 -23.793 12.621 1.00 0.00 H new ATOM 0 HE1 TRP A 87 -20.469 -23.107 14.190 1.00 0.00 H new ATOM 0 HE3 TRP A 87 -18.867 -27.059 10.912 1.00 0.00 H new ATOM 0 HZ2 TRP A 87 -17.798 -23.887 14.608 1.00 0.00 H new ATOM 0 HZ3 TRP A 87 -16.634 -27.031 11.951 1.00 0.00 H new ATOM 0 HH2 TRP A 87 -16.110 -25.467 13.777 1.00 0.00 H new ATOM 1271 N PRO A 88 -22.472 -26.773 7.737 1.00 0.00 N ATOM 1272 CA PRO A 88 -23.366 -27.463 6.802 1.00 0.00 C ATOM 1273 C PRO A 88 -24.421 -28.298 7.518 1.00 0.00 C ATOM 1274 O PRO A 88 -24.122 -28.994 8.487 1.00 0.00 O ATOM 1275 CB PRO A 88 -22.419 -28.365 6.006 1.00 0.00 C ATOM 1276 CG PRO A 88 -21.261 -28.593 6.914 1.00 0.00 C ATOM 1277 CD PRO A 88 -21.109 -27.331 7.717 1.00 0.00 C ATOM 0 HA PRO A 88 -23.929 -26.763 6.185 1.00 0.00 H new ATOM 0 HB2 PRO A 88 -22.901 -29.304 5.736 1.00 0.00 H new ATOM 0 HB3 PRO A 88 -22.106 -27.888 5.077 1.00 0.00 H new ATOM 0 HG2 PRO A 88 -21.438 -29.450 7.564 1.00 0.00 H new ATOM 0 HG3 PRO A 88 -20.355 -28.805 6.346 1.00 0.00 H new ATOM 0 HD2 PRO A 88 -20.744 -27.537 8.723 1.00 0.00 H new ATOM 0 HD3 PRO A 88 -20.400 -26.644 7.255 1.00 0.00 H new ATOM 1285 N GLU A 89 -25.657 -28.224 7.033 1.00 0.00 N ATOM 1286 CA GLU A 89 -26.757 -28.975 7.629 1.00 0.00 C ATOM 1287 C GLU A 89 -26.469 -30.473 7.603 1.00 0.00 C ATOM 1288 O GLU A 89 -26.831 -31.201 8.528 1.00 0.00 O ATOM 1289 CB GLU A 89 -28.063 -28.682 6.888 1.00 0.00 C ATOM 1290 CG GLU A 89 -28.144 -29.332 5.517 1.00 0.00 C ATOM 1291 CD GLU A 89 -29.347 -28.865 4.720 1.00 0.00 C ATOM 1292 OE1 GLU A 89 -29.224 -27.852 4.001 1.00 0.00 O ATOM 1293 OE2 GLU A 89 -30.411 -29.512 4.816 1.00 0.00 O ATOM 0 H GLU A 89 -25.922 -27.653 6.230 1.00 0.00 H new ATOM 0 HA GLU A 89 -26.859 -28.660 8.668 1.00 0.00 H new ATOM 0 HB2 GLU A 89 -28.900 -29.027 7.494 1.00 0.00 H new ATOM 0 HB3 GLU A 89 -28.174 -27.603 6.777 1.00 0.00 H new ATOM 0 HG2 GLU A 89 -27.235 -29.109 4.959 1.00 0.00 H new ATOM 0 HG3 GLU A 89 -28.189 -30.415 5.634 1.00 0.00 H new ATOM 1300 N ALA A 90 -25.817 -30.927 6.538 1.00 0.00 N ATOM 1301 CA ALA A 90 -25.480 -32.337 6.392 1.00 0.00 C ATOM 1302 C ALA A 90 -25.109 -32.955 7.736 1.00 0.00 C ATOM 1303 O ALA A 90 -25.312 -34.148 7.959 1.00 0.00 O ATOM 1304 CB ALA A 90 -24.341 -32.507 5.398 1.00 0.00 C ATOM 0 H ALA A 90 -25.512 -30.338 5.763 1.00 0.00 H new ATOM 0 HA ALA A 90 -26.359 -32.858 6.013 1.00 0.00 H new ATOM 0 HB1 ALA A 90 -24.100 -33.565 5.299 1.00 0.00 H new ATOM 0 HB2 ALA A 90 -24.642 -32.111 4.428 1.00 0.00 H new ATOM 0 HB3 ALA A 90 -23.464 -31.967 5.754 1.00 0.00 H new ATOM 1310 N ALA A 91 -24.562 -32.135 8.628 1.00 0.00 N ATOM 1311 CA ALA A 91 -24.164 -32.601 9.950 1.00 0.00 C ATOM 1312 C ALA A 91 -25.382 -32.862 10.830 1.00 0.00 C ATOM 1313 O ALA A 91 -26.102 -31.935 11.201 1.00 0.00 O ATOM 1314 CB ALA A 91 -23.240 -31.588 10.610 1.00 0.00 C ATOM 0 H ALA A 91 -24.385 -31.145 8.459 1.00 0.00 H new ATOM 0 HA ALA A 91 -23.627 -33.542 9.830 1.00 0.00 H new ATOM 0 HB1 ALA A 91 -22.950 -31.949 11.597 1.00 0.00 H new ATOM 0 HB2 ALA A 91 -22.349 -31.454 9.997 1.00 0.00 H new ATOM 0 HB3 ALA A 91 -23.758 -30.634 10.710 1.00 0.00 H new ATOM 1320 N SER A 92 -25.606 -34.129 11.161 1.00 0.00 N ATOM 1321 CA SER A 92 -26.740 -34.513 11.994 1.00 0.00 C ATOM 1322 C SER A 92 -26.373 -34.450 13.473 1.00 0.00 C ATOM 1323 O SER A 92 -27.204 -34.112 14.317 1.00 0.00 O ATOM 1324 CB SER A 92 -27.212 -35.923 11.633 1.00 0.00 C ATOM 1325 OG SER A 92 -28.270 -36.339 12.479 1.00 0.00 O ATOM 0 H SER A 92 -25.017 -34.908 10.865 1.00 0.00 H new ATOM 0 HA SER A 92 -27.551 -33.808 11.808 1.00 0.00 H new ATOM 0 HB2 SER A 92 -27.543 -35.944 10.595 1.00 0.00 H new ATOM 0 HB3 SER A 92 -26.379 -36.621 11.717 1.00 0.00 H new ATOM 0 HG SER A 92 -28.555 -37.242 12.227 1.00 0.00 H new ATOM 1331 N ASP A 93 -25.123 -34.778 13.780 1.00 0.00 N ATOM 1332 CA ASP A 93 -24.643 -34.759 15.157 1.00 0.00 C ATOM 1333 C ASP A 93 -23.936 -33.443 15.468 1.00 0.00 C ATOM 1334 O ASP A 93 -23.292 -32.855 14.600 1.00 0.00 O ATOM 1335 CB ASP A 93 -23.696 -35.933 15.406 1.00 0.00 C ATOM 1336 CG ASP A 93 -23.733 -36.412 16.844 1.00 0.00 C ATOM 1337 OD1 ASP A 93 -23.280 -35.660 17.732 1.00 0.00 O ATOM 1338 OD2 ASP A 93 -24.214 -37.540 17.082 1.00 0.00 O ATOM 0 H ASP A 93 -24.423 -35.060 13.094 1.00 0.00 H new ATOM 0 HA ASP A 93 -25.505 -34.852 15.818 1.00 0.00 H new ATOM 0 HB2 ASP A 93 -23.962 -36.757 14.745 1.00 0.00 H new ATOM 0 HB3 ASP A 93 -22.679 -35.636 15.151 1.00 0.00 H new ATOM 1343 N GLU A 94 -24.061 -32.988 16.710 1.00 0.00 N ATOM 1344 CA GLU A 94 -23.435 -31.742 17.134 1.00 0.00 C ATOM 1345 C GLU A 94 -21.925 -31.910 17.271 1.00 0.00 C ATOM 1346 O GLU A 94 -21.156 -30.997 16.969 1.00 0.00 O ATOM 1347 CB GLU A 94 -24.030 -31.272 18.463 1.00 0.00 C ATOM 1348 CG GLU A 94 -23.867 -32.276 19.591 1.00 0.00 C ATOM 1349 CD GLU A 94 -25.007 -33.274 19.654 1.00 0.00 C ATOM 1350 OE1 GLU A 94 -26.118 -32.936 19.194 1.00 0.00 O ATOM 1351 OE2 GLU A 94 -24.788 -34.393 20.163 1.00 0.00 O ATOM 0 H GLU A 94 -24.590 -33.464 17.441 1.00 0.00 H new ATOM 0 HA GLU A 94 -23.631 -30.989 16.370 1.00 0.00 H new ATOM 0 HB2 GLU A 94 -23.557 -30.334 18.752 1.00 0.00 H new ATOM 0 HB3 GLU A 94 -25.091 -31.064 18.323 1.00 0.00 H new ATOM 0 HG2 GLU A 94 -22.927 -32.812 19.462 1.00 0.00 H new ATOM 0 HG3 GLU A 94 -23.803 -31.743 20.540 1.00 0.00 H new ATOM 1358 N THR A 95 -21.506 -33.086 17.730 1.00 0.00 N ATOM 1359 CA THR A 95 -20.089 -33.375 17.910 1.00 0.00 C ATOM 1360 C THR A 95 -19.383 -33.520 16.567 1.00 0.00 C ATOM 1361 O THR A 95 -18.156 -33.452 16.488 1.00 0.00 O ATOM 1362 CB THR A 95 -19.878 -34.662 18.729 1.00 0.00 C ATOM 1363 OG1 THR A 95 -20.476 -34.524 20.022 1.00 0.00 O ATOM 1364 CG2 THR A 95 -18.396 -34.970 18.881 1.00 0.00 C ATOM 0 H THR A 95 -22.128 -33.853 17.984 1.00 0.00 H new ATOM 0 HA THR A 95 -19.661 -32.533 18.454 1.00 0.00 H new ATOM 0 HB THR A 95 -20.352 -35.486 18.196 1.00 0.00 H new ATOM 0 HG1 THR A 95 -20.339 -35.347 20.535 1.00 0.00 H new ATOM 0 HG21 THR A 95 -18.272 -35.883 19.463 1.00 0.00 H new ATOM 0 HG22 THR A 95 -17.949 -35.104 17.896 1.00 0.00 H new ATOM 0 HG23 THR A 95 -17.903 -34.144 19.393 1.00 0.00 H new ATOM 1372 N LYS A 96 -20.164 -33.718 15.511 1.00 0.00 N ATOM 1373 CA LYS A 96 -19.615 -33.871 14.169 1.00 0.00 C ATOM 1374 C LYS A 96 -18.981 -32.568 13.689 1.00 0.00 C ATOM 1375 O LYS A 96 -17.827 -32.548 13.262 1.00 0.00 O ATOM 1376 CB LYS A 96 -20.710 -34.306 13.193 1.00 0.00 C ATOM 1377 CG LYS A 96 -20.813 -35.813 13.027 1.00 0.00 C ATOM 1378 CD LYS A 96 -19.842 -36.325 11.977 1.00 0.00 C ATOM 1379 CE LYS A 96 -20.152 -37.762 11.585 1.00 0.00 C ATOM 1380 NZ LYS A 96 -19.876 -38.712 12.698 1.00 0.00 N ATOM 0 H LYS A 96 -21.181 -33.776 15.559 1.00 0.00 H new ATOM 0 HA LYS A 96 -18.843 -34.640 14.205 1.00 0.00 H new ATOM 0 HB2 LYS A 96 -21.669 -33.921 13.540 1.00 0.00 H new ATOM 0 HB3 LYS A 96 -20.518 -33.854 12.220 1.00 0.00 H new ATOM 0 HG2 LYS A 96 -20.609 -36.300 13.981 1.00 0.00 H new ATOM 0 HG3 LYS A 96 -21.831 -36.080 12.744 1.00 0.00 H new ATOM 0 HD2 LYS A 96 -19.890 -35.688 11.094 1.00 0.00 H new ATOM 0 HD3 LYS A 96 -18.824 -36.263 12.360 1.00 0.00 H new ATOM 0 HE2 LYS A 96 -21.199 -37.841 11.291 1.00 0.00 H new ATOM 0 HE3 LYS A 96 -19.556 -38.038 10.715 1.00 0.00 H new ATOM 0 HZ1 LYS A 96 -20.100 -39.680 12.391 1.00 0.00 H new ATOM 0 HZ2 LYS A 96 -18.872 -38.656 12.961 1.00 0.00 H new ATOM 0 HZ3 LYS A 96 -20.464 -38.464 13.520 1.00 0.00 H new ATOM 1394 N LYS A 97 -19.743 -31.482 13.765 1.00 0.00 N ATOM 1395 CA LYS A 97 -19.256 -30.175 13.341 1.00 0.00 C ATOM 1396 C LYS A 97 -18.468 -29.499 14.460 1.00 0.00 C ATOM 1397 O LYS A 97 -17.528 -28.747 14.203 1.00 0.00 O ATOM 1398 CB LYS A 97 -20.426 -29.284 12.917 1.00 0.00 C ATOM 1399 CG LYS A 97 -21.376 -28.947 14.053 1.00 0.00 C ATOM 1400 CD LYS A 97 -22.511 -29.953 14.148 1.00 0.00 C ATOM 1401 CE LYS A 97 -23.786 -29.308 14.670 1.00 0.00 C ATOM 1402 NZ LYS A 97 -24.340 -28.316 13.708 1.00 0.00 N ATOM 0 H LYS A 97 -20.701 -31.481 14.116 1.00 0.00 H new ATOM 0 HA LYS A 97 -18.592 -30.321 12.489 1.00 0.00 H new ATOM 0 HB2 LYS A 97 -20.033 -28.358 12.496 1.00 0.00 H new ATOM 0 HB3 LYS A 97 -20.983 -29.783 12.124 1.00 0.00 H new ATOM 0 HG2 LYS A 97 -20.827 -28.927 14.994 1.00 0.00 H new ATOM 0 HG3 LYS A 97 -21.786 -27.948 13.902 1.00 0.00 H new ATOM 0 HD2 LYS A 97 -22.697 -30.387 13.165 1.00 0.00 H new ATOM 0 HD3 LYS A 97 -22.220 -30.771 14.807 1.00 0.00 H new ATOM 0 HE2 LYS A 97 -24.530 -30.080 14.864 1.00 0.00 H new ATOM 0 HE3 LYS A 97 -23.581 -28.816 15.621 1.00 0.00 H new ATOM 0 HZ1 LYS A 97 -25.378 -28.374 13.709 1.00 0.00 H new ATOM 0 HZ2 LYS A 97 -24.046 -27.359 13.989 1.00 0.00 H new ATOM 0 HZ3 LYS A 97 -23.983 -28.522 12.753 1.00 0.00 H new ATOM 1416 N ARG A 98 -18.857 -29.774 15.700 1.00 0.00 N ATOM 1417 CA ARG A 98 -18.187 -29.193 16.857 1.00 0.00 C ATOM 1418 C ARG A 98 -16.774 -29.751 17.005 1.00 0.00 C ATOM 1419 O ARG A 98 -15.916 -29.140 17.643 1.00 0.00 O ATOM 1420 CB ARG A 98 -18.991 -29.467 18.130 1.00 0.00 C ATOM 1421 CG ARG A 98 -20.191 -28.551 18.301 1.00 0.00 C ATOM 1422 CD ARG A 98 -20.627 -28.471 19.756 1.00 0.00 C ATOM 1423 NE ARG A 98 -19.951 -27.392 20.471 1.00 0.00 N ATOM 1424 CZ ARG A 98 -20.007 -27.236 21.789 1.00 0.00 C ATOM 1425 NH1 ARG A 98 -20.703 -28.085 22.532 1.00 0.00 N ATOM 1426 NH2 ARG A 98 -19.364 -26.229 22.367 1.00 0.00 N ATOM 0 H ARG A 98 -19.633 -30.395 15.930 1.00 0.00 H new ATOM 0 HA ARG A 98 -18.119 -28.116 16.703 1.00 0.00 H new ATOM 0 HB2 ARG A 98 -19.333 -30.502 18.118 1.00 0.00 H new ATOM 0 HB3 ARG A 98 -18.336 -29.358 18.994 1.00 0.00 H new ATOM 0 HG2 ARG A 98 -19.943 -27.553 17.939 1.00 0.00 H new ATOM 0 HG3 ARG A 98 -21.018 -28.915 17.692 1.00 0.00 H new ATOM 0 HD2 ARG A 98 -21.705 -28.318 19.804 1.00 0.00 H new ATOM 0 HD3 ARG A 98 -20.418 -29.420 20.250 1.00 0.00 H new ATOM 0 HE ARG A 98 -19.406 -26.722 19.929 1.00 0.00 H new ATOM 0 HH11 ARG A 98 -21.198 -28.861 22.092 1.00 0.00 H new ATOM 0 HH12 ARG A 98 -20.744 -27.962 23.544 1.00 0.00 H new ATOM 0 HH21 ARG A 98 -18.826 -25.574 21.799 1.00 0.00 H new ATOM 0 HH22 ARG A 98 -19.408 -26.110 23.379 1.00 0.00 H new ATOM 1440 N THR A 99 -16.539 -30.917 16.411 1.00 0.00 N ATOM 1441 CA THR A 99 -15.232 -31.559 16.477 1.00 0.00 C ATOM 1442 C THR A 99 -14.704 -31.876 15.083 1.00 0.00 C ATOM 1443 O THR A 99 -13.832 -32.728 14.919 1.00 0.00 O ATOM 1444 CB THR A 99 -15.286 -32.859 17.301 1.00 0.00 C ATOM 1445 OG1 THR A 99 -16.224 -32.721 18.374 1.00 0.00 O ATOM 1446 CG2 THR A 99 -13.914 -33.202 17.862 1.00 0.00 C ATOM 0 H THR A 99 -17.237 -31.436 15.879 1.00 0.00 H new ATOM 0 HA THR A 99 -14.559 -30.855 16.966 1.00 0.00 H new ATOM 0 HB THR A 99 -15.604 -33.667 16.642 1.00 0.00 H new ATOM 0 HG1 THR A 99 -17.136 -32.781 18.021 1.00 0.00 H new ATOM 0 HG21 THR A 99 -13.977 -34.124 18.440 1.00 0.00 H new ATOM 0 HG22 THR A 99 -13.209 -33.336 17.042 1.00 0.00 H new ATOM 0 HG23 THR A 99 -13.572 -32.392 18.507 1.00 0.00 H new ATOM 1454 N ALA A 100 -15.238 -31.184 14.082 1.00 0.00 N ATOM 1455 CA ALA A 100 -14.817 -31.390 12.701 1.00 0.00 C ATOM 1456 C ALA A 100 -13.382 -30.921 12.489 1.00 0.00 C ATOM 1457 O ALA A 100 -12.777 -31.193 11.452 1.00 0.00 O ATOM 1458 CB ALA A 100 -15.758 -30.666 11.750 1.00 0.00 C ATOM 0 H ALA A 100 -15.963 -30.476 14.201 1.00 0.00 H new ATOM 0 HA ALA A 100 -14.856 -32.459 12.490 1.00 0.00 H new ATOM 0 HB1 ALA A 100 -15.432 -30.828 10.722 1.00 0.00 H new ATOM 0 HB2 ALA A 100 -16.770 -31.052 11.875 1.00 0.00 H new ATOM 0 HB3 ALA A 100 -15.747 -29.598 11.970 1.00 0.00 H new ATOM 1464 N PHE A 101 -12.843 -30.214 13.476 1.00 0.00 N ATOM 1465 CA PHE A 101 -11.479 -29.705 13.396 1.00 0.00 C ATOM 1466 C PHE A 101 -10.531 -30.554 14.239 1.00 0.00 C ATOM 1467 O PHE A 101 -9.502 -30.072 14.710 1.00 0.00 O ATOM 1468 CB PHE A 101 -11.427 -28.248 13.862 1.00 0.00 C ATOM 1469 CG PHE A 101 -11.908 -27.271 12.828 1.00 0.00 C ATOM 1470 CD1 PHE A 101 -11.115 -26.949 11.738 1.00 0.00 C ATOM 1471 CD2 PHE A 101 -13.152 -26.672 12.947 1.00 0.00 C ATOM 1472 CE1 PHE A 101 -11.555 -26.051 10.784 1.00 0.00 C ATOM 1473 CE2 PHE A 101 -13.597 -25.773 11.996 1.00 0.00 C ATOM 1474 CZ PHE A 101 -12.797 -25.461 10.914 1.00 0.00 C ATOM 0 H PHE A 101 -13.330 -29.980 14.341 1.00 0.00 H new ATOM 0 HA PHE A 101 -11.159 -29.758 12.355 1.00 0.00 H new ATOM 0 HB2 PHE A 101 -12.033 -28.141 14.762 1.00 0.00 H new ATOM 0 HB3 PHE A 101 -10.402 -27.999 14.137 1.00 0.00 H new ATOM 0 HD1 PHE A 101 -10.142 -27.405 11.633 1.00 0.00 H new ATOM 0 HD2 PHE A 101 -13.781 -26.910 13.792 1.00 0.00 H new ATOM 0 HE1 PHE A 101 -10.928 -25.811 9.938 1.00 0.00 H new ATOM 0 HE2 PHE A 101 -14.570 -25.315 12.099 1.00 0.00 H new ATOM 0 HZ PHE A 101 -13.142 -24.757 10.171 1.00 0.00 H new ATOM 1484 N ALA A 102 -10.888 -31.821 14.423 1.00 0.00 N ATOM 1485 CA ALA A 102 -10.070 -32.738 15.207 1.00 0.00 C ATOM 1486 C ALA A 102 -8.745 -33.025 14.509 1.00 0.00 C ATOM 1487 O ALA A 102 -8.719 -33.532 13.388 1.00 0.00 O ATOM 1488 CB ALA A 102 -10.826 -34.034 15.462 1.00 0.00 C ATOM 0 H ALA A 102 -11.738 -32.235 14.040 1.00 0.00 H new ATOM 0 HA ALA A 102 -9.852 -32.264 16.164 1.00 0.00 H new ATOM 0 HB1 ALA A 102 -10.203 -34.709 16.049 1.00 0.00 H new ATOM 0 HB2 ALA A 102 -11.743 -33.818 16.010 1.00 0.00 H new ATOM 0 HB3 ALA A 102 -11.074 -34.504 14.510 1.00 0.00 H new ATOM 1494 N GLY A 103 -7.644 -32.697 15.179 1.00 0.00 N ATOM 1495 CA GLY A 103 -6.330 -32.926 14.607 1.00 0.00 C ATOM 1496 C GLY A 103 -5.568 -31.637 14.370 1.00 0.00 C ATOM 1497 O GLY A 103 -4.337 -31.632 14.335 1.00 0.00 O ATOM 0 H GLY A 103 -7.639 -32.277 16.108 1.00 0.00 H new ATOM 0 HA2 GLY A 103 -5.754 -33.568 15.274 1.00 0.00 H new ATOM 0 HA3 GLY A 103 -6.436 -33.460 13.663 1.00 0.00 H new ATOM 1501 N THR A 104 -6.301 -30.540 14.205 1.00 0.00 N ATOM 1502 CA THR A 104 -5.686 -29.240 13.968 1.00 0.00 C ATOM 1503 C THR A 104 -5.545 -28.453 15.266 1.00 0.00 C ATOM 1504 O THR A 104 -5.928 -28.927 16.335 1.00 0.00 O ATOM 1505 CB THR A 104 -6.504 -28.407 12.963 1.00 0.00 C ATOM 1506 OG1 THR A 104 -7.788 -28.094 13.516 1.00 0.00 O ATOM 1507 CG2 THR A 104 -6.681 -29.160 11.653 1.00 0.00 C ATOM 0 H THR A 104 -7.321 -30.526 14.231 1.00 0.00 H new ATOM 0 HA THR A 104 -4.696 -29.430 13.552 1.00 0.00 H new ATOM 0 HB THR A 104 -5.960 -27.484 12.763 1.00 0.00 H new ATOM 0 HG1 THR A 104 -8.254 -28.924 13.750 1.00 0.00 H new ATOM 0 HG21 THR A 104 -7.262 -28.552 10.959 1.00 0.00 H new ATOM 0 HG22 THR A 104 -5.703 -29.371 11.220 1.00 0.00 H new ATOM 0 HG23 THR A 104 -7.205 -30.097 11.840 1.00 0.00 H new ATOM 1515 N ALA A 105 -4.993 -27.248 15.165 1.00 0.00 N ATOM 1516 CA ALA A 105 -4.804 -26.395 16.331 1.00 0.00 C ATOM 1517 C ALA A 105 -5.930 -25.374 16.453 1.00 0.00 C ATOM 1518 O ALA A 105 -5.850 -24.440 17.252 1.00 0.00 O ATOM 1519 CB ALA A 105 -3.457 -25.691 16.258 1.00 0.00 C ATOM 0 H ALA A 105 -4.669 -26.841 14.288 1.00 0.00 H new ATOM 0 HA ALA A 105 -4.824 -27.027 17.219 1.00 0.00 H new ATOM 0 HB1 ALA A 105 -3.330 -25.057 17.136 1.00 0.00 H new ATOM 0 HB2 ALA A 105 -2.660 -26.433 16.228 1.00 0.00 H new ATOM 0 HB3 ALA A 105 -3.416 -25.077 15.358 1.00 0.00 H new ATOM 1525 N ILE A 106 -6.978 -25.558 15.656 1.00 0.00 N ATOM 1526 CA ILE A 106 -8.120 -24.652 15.676 1.00 0.00 C ATOM 1527 C ILE A 106 -9.069 -24.990 16.820 1.00 0.00 C ATOM 1528 O ILE A 106 -9.533 -26.124 16.941 1.00 0.00 O ATOM 1529 CB ILE A 106 -8.898 -24.698 14.347 1.00 0.00 C ATOM 1530 CG1 ILE A 106 -8.091 -24.024 13.235 1.00 0.00 C ATOM 1531 CG2 ILE A 106 -10.255 -24.029 14.505 1.00 0.00 C ATOM 1532 CD1 ILE A 106 -8.502 -24.455 11.845 1.00 0.00 C ATOM 0 H ILE A 106 -7.060 -26.326 14.989 1.00 0.00 H new ATOM 0 HA ILE A 106 -7.724 -23.647 15.821 1.00 0.00 H new ATOM 0 HB ILE A 106 -9.059 -25.740 14.072 1.00 0.00 H new ATOM 0 HG12 ILE A 106 -8.203 -22.943 13.320 1.00 0.00 H new ATOM 0 HG13 ILE A 106 -7.034 -24.247 13.378 1.00 0.00 H new ATOM 0 HG21 ILE A 106 -10.793 -24.069 13.558 1.00 0.00 H new ATOM 0 HG22 ILE A 106 -10.830 -24.549 15.271 1.00 0.00 H new ATOM 0 HG23 ILE A 106 -10.116 -22.989 14.799 1.00 0.00 H new ATOM 0 HD11 ILE A 106 -7.888 -23.938 11.107 1.00 0.00 H new ATOM 0 HD12 ILE A 106 -8.363 -25.531 11.742 1.00 0.00 H new ATOM 0 HD13 ILE A 106 -9.551 -24.207 11.682 1.00 0.00 H new ATOM 1544 N SER A 107 -9.356 -23.998 17.657 1.00 0.00 N ATOM 1545 CA SER A 107 -10.249 -24.190 18.793 1.00 0.00 C ATOM 1546 C SER A 107 -11.568 -23.453 18.578 1.00 0.00 C ATOM 1547 O SER A 107 -11.586 -22.241 18.366 1.00 0.00 O ATOM 1548 CB SER A 107 -9.583 -23.702 20.081 1.00 0.00 C ATOM 1549 OG SER A 107 -8.508 -24.548 20.452 1.00 0.00 O ATOM 0 H SER A 107 -8.983 -23.053 17.569 1.00 0.00 H new ATOM 0 HA SER A 107 -10.459 -25.256 18.882 1.00 0.00 H new ATOM 0 HB2 SER A 107 -9.218 -22.684 19.942 1.00 0.00 H new ATOM 0 HB3 SER A 107 -10.319 -23.670 20.885 1.00 0.00 H new ATOM 0 HG SER A 107 -8.098 -24.214 21.277 1.00 0.00 H new ATOM 1555 N ILE A 108 -12.669 -24.195 18.635 1.00 0.00 N ATOM 1556 CA ILE A 108 -13.992 -23.613 18.448 1.00 0.00 C ATOM 1557 C ILE A 108 -14.740 -23.511 19.773 1.00 0.00 C ATOM 1558 O ILE A 108 -14.715 -24.436 20.585 1.00 0.00 O ATOM 1559 CB ILE A 108 -14.835 -24.437 17.457 1.00 0.00 C ATOM 1560 CG1 ILE A 108 -16.186 -23.761 17.217 1.00 0.00 C ATOM 1561 CG2 ILE A 108 -15.030 -25.853 17.978 1.00 0.00 C ATOM 1562 CD1 ILE A 108 -16.125 -22.625 16.220 1.00 0.00 C ATOM 0 H ILE A 108 -12.671 -25.200 18.809 1.00 0.00 H new ATOM 0 HA ILE A 108 -13.842 -22.613 18.040 1.00 0.00 H new ATOM 0 HB ILE A 108 -14.303 -24.490 16.507 1.00 0.00 H new ATOM 0 HG12 ILE A 108 -16.898 -24.506 16.863 1.00 0.00 H new ATOM 0 HG13 ILE A 108 -16.567 -23.381 18.165 1.00 0.00 H new ATOM 0 HG21 ILE A 108 -15.628 -26.423 17.267 1.00 0.00 H new ATOM 0 HG22 ILE A 108 -14.059 -26.332 18.102 1.00 0.00 H new ATOM 0 HG23 ILE A 108 -15.543 -25.820 18.939 1.00 0.00 H new ATOM 0 HD11 ILE A 108 -17.118 -22.193 16.100 1.00 0.00 H new ATOM 0 HD12 ILE A 108 -15.438 -21.860 16.582 1.00 0.00 H new ATOM 0 HD13 ILE A 108 -15.775 -23.002 15.259 1.00 0.00 H new ATOM 1574 N VAL A 109 -15.408 -22.382 19.984 1.00 0.00 N ATOM 1575 CA VAL A 109 -16.167 -22.160 21.209 1.00 0.00 C ATOM 1576 C VAL A 109 -17.634 -21.877 20.903 1.00 0.00 C ATOM 1577 O VAL A 109 -18.387 -21.439 21.772 1.00 0.00 O ATOM 1578 CB VAL A 109 -15.589 -20.987 22.022 1.00 0.00 C ATOM 1579 CG1 VAL A 109 -14.144 -21.264 22.406 1.00 0.00 C ATOM 1580 CG2 VAL A 109 -15.701 -19.688 21.238 1.00 0.00 C ATOM 0 H VAL A 109 -15.439 -21.606 19.322 1.00 0.00 H new ATOM 0 HA VAL A 109 -16.091 -23.074 21.798 1.00 0.00 H new ATOM 0 HB VAL A 109 -16.170 -20.883 22.938 1.00 0.00 H new ATOM 0 HG11 VAL A 109 -13.753 -20.424 22.980 1.00 0.00 H new ATOM 0 HG12 VAL A 109 -14.095 -22.170 23.010 1.00 0.00 H new ATOM 0 HG13 VAL A 109 -13.547 -21.397 21.504 1.00 0.00 H new ATOM 0 HG21 VAL A 109 -15.288 -18.870 21.828 1.00 0.00 H new ATOM 0 HG22 VAL A 109 -15.147 -19.778 20.304 1.00 0.00 H new ATOM 0 HG23 VAL A 109 -16.749 -19.484 21.020 1.00 0.00 H new TER 1590 VAL A 109