USER MOD reduce.3.24.130724 H: found=0, std=0, add=788, rem=0, adj=34 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 Single : A 1 THR N :NH3+ -149:sc= -0.0228 (180deg=-0.322) USER MOD Single : A 1 THR OG1 : rot 34:sc= 0.389 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 USER MOD Single : A 8 HIS : no HD1:sc= -0.285 X(o=-0.28,f=-0.17) USER MOD Single : A 9 TYR OH : rot 180:sc= 0 USER MOD Single : A 10 GLN : amide:sc= 0 X(o=0,f=-0.016) USER MOD Single : A 12 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 14 ASN : amide:sc= 0 X(o=0,f=-0.024) USER MOD Single : A 15 SER OG : rot 180:sc= -0.0213 USER MOD Single : A 19 HIS : no HD1:sc= -0.451 X(o=-0.45,f=-0.043) USER MOD Single : A 20 THR OG1 : rot 180:sc= 0 USER MOD Single : A 22 THR OG1 : rot 52:sc= 0.401 USER MOD Single : A 28 SER OG : rot 180:sc= 0 USER MOD Single : A 30 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 34 MET CE :methyl -152:sc= -0.196 (180deg=-2.69) USER MOD Single : A 35 THR OG1 : rot -111:sc= 0.0113 USER MOD Single : A 38 MET CE :methyl -125:sc= 0 (180deg=-2.19!) 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 -105:sc= -1.22 USER MOD Single : A 45 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 52 THR OG1 : rot 180:sc= 0.00535 USER MOD Single : A 53 THR OG1 : rot 129:sc= 0.222 USER MOD Single : A 67 GLN :FLIP amide:sc= -2.74 F(o=-3.6!,f=-2.7) USER MOD Single : A 68 THR OG1 : rot -37:sc= 0.56 USER MOD Single : A 69 SER OG : rot 21:sc= 1.35 USER MOD Single : A 70 THR OG1 : rot 180:sc= 0 USER MOD Single : A 71 THR OG1 : rot -11:sc= 0.858 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+ 180:sc= 0 (180deg=0) USER MOD Single : A 77 SER OG : rot 180:sc= -2.12 USER MOD Single : A 79 THR OG1 : rot 180:sc= 0 USER MOD Single : A 82 TYR OH : rot 86:sc= -0.702 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 97 LYS NZ :NH3+ -129:sc= -1.19 (180deg=-3.27!) USER MOD Single : A 99 THR OG1 : rot 180:sc=-0.00306 USER MOD Single : A 104 THR OG1 : rot -53:sc= 0.762 USER MOD Single : A 107 SER OG : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N THR A 1 -1.371 -24.548 34.898 1.00 0.00 N ATOM 2 CA THR A 1 -0.554 -23.903 33.877 1.00 0.00 C ATOM 3 C THR A 1 0.387 -24.903 33.214 1.00 0.00 C ATOM 4 O THR A 1 1.168 -25.575 33.887 1.00 0.00 O ATOM 5 CB THR A 1 0.276 -22.749 34.469 1.00 0.00 C ATOM 6 OG1 THR A 1 1.119 -23.238 35.517 1.00 0.00 O ATOM 7 CG2 THR A 1 -0.630 -21.653 35.010 1.00 0.00 C ATOM 0 H1 THR A 1 -2.292 -24.069 34.959 1.00 0.00 H new ATOM 0 H2 THR A 1 -1.516 -25.547 34.647 1.00 0.00 H new ATOM 0 H3 THR A 1 -0.889 -24.488 35.817 1.00 0.00 H new ATOM 0 HA THR A 1 -1.239 -23.502 33.130 1.00 0.00 H new ATOM 0 HB THR A 1 0.893 -22.330 33.674 1.00 0.00 H new ATOM 0 HG1 THR A 1 1.410 -24.149 35.305 1.00 0.00 H new ATOM 0 HG21 THR A 1 -0.021 -20.849 35.423 1.00 0.00 H new ATOM 0 HG22 THR A 1 -1.249 -21.262 34.203 1.00 0.00 H new ATOM 0 HG23 THR A 1 -1.269 -22.062 35.792 1.00 0.00 H new ATOM 15 N SER A 2 0.308 -24.995 31.890 1.00 0.00 N ATOM 16 CA SER A 2 1.151 -25.915 31.136 1.00 0.00 C ATOM 17 C SER A 2 1.386 -25.399 29.720 1.00 0.00 C ATOM 18 O SER A 2 0.485 -24.844 29.091 1.00 0.00 O ATOM 19 CB SER A 2 0.510 -27.303 31.086 1.00 0.00 C ATOM 20 OG SER A 2 1.297 -28.201 30.323 1.00 0.00 O ATOM 0 H SER A 2 -0.331 -24.444 31.318 1.00 0.00 H new ATOM 0 HA SER A 2 2.113 -25.986 31.643 1.00 0.00 H new ATOM 0 HB2 SER A 2 0.391 -27.689 32.098 1.00 0.00 H new ATOM 0 HB3 SER A 2 -0.488 -27.231 30.653 1.00 0.00 H new ATOM 0 HG SER A 2 0.867 -29.081 30.308 1.00 0.00 H new ATOM 26 N LYS A 3 2.604 -25.587 29.223 1.00 0.00 N ATOM 27 CA LYS A 3 2.960 -25.144 27.881 1.00 0.00 C ATOM 28 C LYS A 3 4.195 -25.882 27.373 1.00 0.00 C ATOM 29 O LYS A 3 5.142 -26.114 28.123 1.00 0.00 O ATOM 30 CB LYS A 3 3.216 -23.635 27.871 1.00 0.00 C ATOM 31 CG LYS A 3 3.673 -23.104 26.523 1.00 0.00 C ATOM 32 CD LYS A 3 4.048 -21.634 26.601 1.00 0.00 C ATOM 33 CE LYS A 3 4.990 -21.238 25.474 1.00 0.00 C ATOM 34 NZ LYS A 3 6.401 -21.608 25.775 1.00 0.00 N ATOM 0 H LYS A 3 3.362 -26.044 29.731 1.00 0.00 H new ATOM 0 HA LYS A 3 2.125 -25.370 27.218 1.00 0.00 H new ATOM 0 HB2 LYS A 3 2.302 -23.118 28.165 1.00 0.00 H new ATOM 0 HB3 LYS A 3 3.971 -23.398 28.620 1.00 0.00 H new ATOM 0 HG2 LYS A 3 4.530 -23.681 26.175 1.00 0.00 H new ATOM 0 HG3 LYS A 3 2.878 -23.239 25.789 1.00 0.00 H new ATOM 0 HD2 LYS A 3 3.146 -21.024 26.553 1.00 0.00 H new ATOM 0 HD3 LYS A 3 4.521 -21.429 27.561 1.00 0.00 H new ATOM 0 HE2 LYS A 3 4.676 -21.724 24.550 1.00 0.00 H new ATOM 0 HE3 LYS A 3 4.924 -20.163 25.306 1.00 0.00 H new ATOM 0 HZ1 LYS A 3 7.011 -21.322 24.983 1.00 0.00 H new ATOM 0 HZ2 LYS A 3 6.709 -21.124 26.642 1.00 0.00 H new ATOM 0 HZ3 LYS A 3 6.469 -22.637 25.910 1.00 0.00 H new ATOM 48 N GLU A 4 4.176 -26.248 26.095 1.00 0.00 N ATOM 49 CA GLU A 4 5.295 -26.960 25.489 1.00 0.00 C ATOM 50 C GLU A 4 5.347 -26.710 23.984 1.00 0.00 C ATOM 51 O GLU A 4 4.314 -26.566 23.330 1.00 0.00 O ATOM 52 CB GLU A 4 5.183 -28.461 25.764 1.00 0.00 C ATOM 53 CG GLU A 4 3.947 -29.101 25.156 1.00 0.00 C ATOM 54 CD GLU A 4 3.776 -30.549 25.569 1.00 0.00 C ATOM 55 OE1 GLU A 4 3.666 -30.811 26.785 1.00 0.00 O ATOM 56 OE2 GLU A 4 3.753 -31.422 24.676 1.00 0.00 O ATOM 0 H GLU A 4 3.399 -26.063 25.460 1.00 0.00 H new ATOM 0 HA GLU A 4 6.216 -26.584 25.935 1.00 0.00 H new ATOM 0 HB2 GLU A 4 6.070 -28.960 25.373 1.00 0.00 H new ATOM 0 HB3 GLU A 4 5.174 -28.625 26.842 1.00 0.00 H new ATOM 0 HG2 GLU A 4 3.065 -28.535 25.456 1.00 0.00 H new ATOM 0 HG3 GLU A 4 4.009 -29.042 24.069 1.00 0.00 H new ATOM 63 N THR A 5 6.560 -26.660 23.440 1.00 0.00 N ATOM 64 CA THR A 5 6.748 -26.427 22.014 1.00 0.00 C ATOM 65 C THR A 5 8.188 -26.706 21.597 1.00 0.00 C ATOM 66 O THR A 5 9.131 -26.305 22.279 1.00 0.00 O ATOM 67 CB THR A 5 6.386 -24.980 21.629 1.00 0.00 C ATOM 68 OG1 THR A 5 7.149 -24.571 20.488 1.00 0.00 O ATOM 69 CG2 THR A 5 6.648 -24.030 22.788 1.00 0.00 C ATOM 0 H THR A 5 7.426 -26.778 23.966 1.00 0.00 H new ATOM 0 HA THR A 5 6.081 -27.112 21.491 1.00 0.00 H new ATOM 0 HB THR A 5 5.324 -24.947 21.386 1.00 0.00 H new ATOM 0 HG1 THR A 5 6.912 -23.651 20.249 1.00 0.00 H new ATOM 0 HG21 THR A 5 6.385 -23.014 22.493 1.00 0.00 H new ATOM 0 HG22 THR A 5 6.044 -24.327 23.645 1.00 0.00 H new ATOM 0 HG23 THR A 5 7.703 -24.068 23.058 1.00 0.00 H new ATOM 77 N PHE A 6 8.350 -27.396 20.473 1.00 0.00 N ATOM 78 CA PHE A 6 9.675 -27.730 19.965 1.00 0.00 C ATOM 79 C PHE A 6 9.598 -28.211 18.519 1.00 0.00 C ATOM 80 O PHE A 6 8.746 -29.028 18.168 1.00 0.00 O ATOM 81 CB PHE A 6 10.324 -28.805 20.839 1.00 0.00 C ATOM 82 CG PHE A 6 11.322 -29.653 20.104 1.00 0.00 C ATOM 83 CD1 PHE A 6 12.647 -29.259 20.007 1.00 0.00 C ATOM 84 CD2 PHE A 6 10.936 -30.843 19.509 1.00 0.00 C ATOM 85 CE1 PHE A 6 13.568 -30.037 19.331 1.00 0.00 C ATOM 86 CE2 PHE A 6 11.852 -31.626 18.832 1.00 0.00 C ATOM 87 CZ PHE A 6 13.170 -31.222 18.743 1.00 0.00 C ATOM 0 H PHE A 6 7.580 -27.735 19.897 1.00 0.00 H new ATOM 0 HA PHE A 6 10.287 -26.828 19.997 1.00 0.00 H new ATOM 0 HB2 PHE A 6 10.819 -28.325 21.684 1.00 0.00 H new ATOM 0 HB3 PHE A 6 9.545 -29.448 21.249 1.00 0.00 H new ATOM 0 HD1 PHE A 6 12.964 -28.333 20.465 1.00 0.00 H new ATOM 0 HD2 PHE A 6 9.907 -31.163 19.575 1.00 0.00 H new ATOM 0 HE1 PHE A 6 14.598 -29.719 19.263 1.00 0.00 H new ATOM 0 HE2 PHE A 6 11.538 -32.552 18.373 1.00 0.00 H new ATOM 0 HZ PHE A 6 13.888 -31.832 18.215 1.00 0.00 H new ATOM 97 N THR A 7 10.495 -27.699 17.682 1.00 0.00 N ATOM 98 CA THR A 7 10.529 -28.074 16.274 1.00 0.00 C ATOM 99 C THR A 7 11.841 -27.651 15.624 1.00 0.00 C ATOM 100 O THR A 7 12.330 -26.544 15.852 1.00 0.00 O ATOM 101 CB THR A 7 9.357 -27.444 15.497 1.00 0.00 C ATOM 102 OG1 THR A 7 9.368 -27.901 14.140 1.00 0.00 O ATOM 103 CG2 THR A 7 9.442 -25.925 15.527 1.00 0.00 C ATOM 0 H THR A 7 11.208 -27.023 17.955 1.00 0.00 H new ATOM 0 HA THR A 7 10.441 -29.160 16.233 1.00 0.00 H new ATOM 0 HB THR A 7 8.426 -27.749 15.975 1.00 0.00 H new ATOM 0 HG1 THR A 7 8.619 -27.498 13.653 1.00 0.00 H new ATOM 0 HG21 THR A 7 8.604 -25.503 14.972 1.00 0.00 H new ATOM 0 HG22 THR A 7 9.404 -25.579 16.560 1.00 0.00 H new ATOM 0 HG23 THR A 7 10.378 -25.604 15.071 1.00 0.00 H new ATOM 111 N HIS A 8 12.406 -28.538 14.811 1.00 0.00 N ATOM 112 CA HIS A 8 13.662 -28.255 14.126 1.00 0.00 C ATOM 113 C HIS A 8 13.478 -28.304 12.612 1.00 0.00 C ATOM 114 O HIS A 8 13.256 -29.370 12.038 1.00 0.00 O ATOM 115 CB HIS A 8 14.737 -29.256 14.553 1.00 0.00 C ATOM 116 CG HIS A 8 15.528 -28.812 15.744 1.00 0.00 C ATOM 117 ND1 HIS A 8 16.176 -27.596 15.807 1.00 0.00 N ATOM 118 CD2 HIS A 8 15.773 -29.429 16.924 1.00 0.00 C ATOM 119 CE1 HIS A 8 16.787 -27.485 16.974 1.00 0.00 C ATOM 120 NE2 HIS A 8 16.557 -28.584 17.670 1.00 0.00 N ATOM 0 H HIS A 8 12.014 -29.458 14.611 1.00 0.00 H new ATOM 0 HA HIS A 8 13.980 -27.250 14.404 1.00 0.00 H new ATOM 0 HB2 HIS A 8 14.263 -30.212 14.777 1.00 0.00 H new ATOM 0 HB3 HIS A 8 15.417 -29.425 13.718 1.00 0.00 H new ATOM 0 HD2 HIS A 8 15.418 -30.404 17.223 1.00 0.00 H new ATOM 0 HE1 HIS A 8 17.374 -26.640 17.302 1.00 0.00 H new ATOM 0 HE2 HIS A 8 16.905 -28.774 18.610 1.00 0.00 H new ATOM 128 N TYR A 9 13.571 -27.144 11.972 1.00 0.00 N ATOM 129 CA TYR A 9 13.411 -27.053 10.526 1.00 0.00 C ATOM 130 C TYR A 9 14.190 -25.868 9.964 1.00 0.00 C ATOM 131 O TYR A 9 14.677 -25.021 10.713 1.00 0.00 O ATOM 132 CB TYR A 9 11.931 -26.924 10.162 1.00 0.00 C ATOM 133 CG TYR A 9 11.636 -27.225 8.710 1.00 0.00 C ATOM 134 CD1 TYR A 9 11.406 -28.527 8.283 1.00 0.00 C ATOM 135 CD2 TYR A 9 11.585 -26.207 7.766 1.00 0.00 C ATOM 136 CE1 TYR A 9 11.137 -28.806 6.957 1.00 0.00 C ATOM 137 CE2 TYR A 9 11.315 -26.477 6.438 1.00 0.00 C ATOM 138 CZ TYR A 9 11.092 -27.778 6.039 1.00 0.00 C ATOM 139 OH TYR A 9 10.822 -28.053 4.717 1.00 0.00 O ATOM 0 H TYR A 9 13.757 -26.253 12.432 1.00 0.00 H new ATOM 0 HA TYR A 9 13.808 -27.967 10.085 1.00 0.00 H new ATOM 0 HB2 TYR A 9 11.351 -27.600 10.790 1.00 0.00 H new ATOM 0 HB3 TYR A 9 11.596 -25.912 10.390 1.00 0.00 H new ATOM 0 HD1 TYR A 9 11.438 -29.334 9.000 1.00 0.00 H new ATOM 0 HD2 TYR A 9 11.759 -25.187 8.075 1.00 0.00 H new ATOM 0 HE1 TYR A 9 10.963 -29.824 6.641 1.00 0.00 H new ATOM 0 HE2 TYR A 9 11.279 -25.674 5.717 1.00 0.00 H new ATOM 0 HH TYR A 9 10.826 -27.219 4.202 1.00 0.00 H new ATOM 149 N GLN A 10 14.302 -25.815 8.641 1.00 0.00 N ATOM 150 CA GLN A 10 15.021 -24.733 7.978 1.00 0.00 C ATOM 151 C GLN A 10 14.059 -23.825 7.220 1.00 0.00 C ATOM 152 O GLN A 10 13.890 -23.935 6.005 1.00 0.00 O ATOM 153 CB GLN A 10 16.069 -25.301 7.019 1.00 0.00 C ATOM 154 CG GLN A 10 15.481 -26.184 5.930 1.00 0.00 C ATOM 155 CD GLN A 10 16.454 -27.240 5.446 1.00 0.00 C ATOM 156 OE1 GLN A 10 17.627 -26.955 5.204 1.00 0.00 O ATOM 157 NE2 GLN A 10 15.972 -28.469 5.303 1.00 0.00 N ATOM 0 H GLN A 10 13.904 -26.508 8.007 1.00 0.00 H new ATOM 0 HA GLN A 10 15.523 -24.141 8.743 1.00 0.00 H new ATOM 0 HB2 GLN A 10 16.609 -24.476 6.554 1.00 0.00 H new ATOM 0 HB3 GLN A 10 16.797 -25.878 7.589 1.00 0.00 H new ATOM 0 HG2 GLN A 10 14.582 -26.670 6.308 1.00 0.00 H new ATOM 0 HG3 GLN A 10 15.177 -25.562 5.088 1.00 0.00 H new ATOM 0 HE21 GLN A 10 14.993 -28.661 5.515 1.00 0.00 H new ATOM 0 HE22 GLN A 10 16.581 -29.221 4.981 1.00 0.00 H new ATOM 166 N PRO A 11 13.413 -22.904 7.951 1.00 0.00 N ATOM 167 CA PRO A 11 12.457 -21.958 7.367 1.00 0.00 C ATOM 168 C PRO A 11 13.137 -20.920 6.481 1.00 0.00 C ATOM 169 O PRO A 11 13.501 -19.839 6.944 1.00 0.00 O ATOM 170 CB PRO A 11 11.830 -21.288 8.592 1.00 0.00 C ATOM 171 CG PRO A 11 12.858 -21.415 9.662 1.00 0.00 C ATOM 172 CD PRO A 11 13.567 -22.715 9.403 1.00 0.00 C ATOM 0 HA PRO A 11 11.735 -22.455 6.719 1.00 0.00 H new ATOM 0 HB2 PRO A 11 11.593 -20.243 8.393 1.00 0.00 H new ATOM 0 HB3 PRO A 11 10.899 -21.778 8.878 1.00 0.00 H new ATOM 0 HG2 PRO A 11 13.556 -20.578 9.634 1.00 0.00 H new ATOM 0 HG3 PRO A 11 12.396 -21.412 10.649 1.00 0.00 H new ATOM 0 HD2 PRO A 11 14.617 -22.665 9.693 1.00 0.00 H new ATOM 0 HD3 PRO A 11 13.120 -23.535 9.965 1.00 0.00 H new ATOM 180 N GLN A 12 13.303 -21.255 5.206 1.00 0.00 N ATOM 181 CA GLN A 12 13.940 -20.350 4.256 1.00 0.00 C ATOM 182 C GLN A 12 13.091 -19.101 4.041 1.00 0.00 C ATOM 183 O GLN A 12 12.019 -19.162 3.441 1.00 0.00 O ATOM 184 CB GLN A 12 14.171 -21.060 2.920 1.00 0.00 C ATOM 185 CG GLN A 12 15.390 -21.968 2.917 1.00 0.00 C ATOM 186 CD GLN A 12 15.374 -22.962 1.772 1.00 0.00 C ATOM 187 OE1 GLN A 12 15.328 -22.578 0.602 1.00 0.00 O ATOM 188 NE2 GLN A 12 15.412 -24.247 2.102 1.00 0.00 N ATOM 0 H GLN A 12 13.006 -22.145 4.807 1.00 0.00 H new ATOM 0 HA GLN A 12 14.902 -20.047 4.670 1.00 0.00 H new ATOM 0 HB2 GLN A 12 13.288 -21.650 2.674 1.00 0.00 H new ATOM 0 HB3 GLN A 12 14.283 -20.312 2.135 1.00 0.00 H new ATOM 0 HG2 GLN A 12 16.292 -21.359 2.852 1.00 0.00 H new ATOM 0 HG3 GLN A 12 15.438 -22.509 3.862 1.00 0.00 H new ATOM 0 HE21 GLN A 12 15.450 -24.520 3.084 1.00 0.00 H new ATOM 0 HE22 GLN A 12 15.404 -24.961 1.374 1.00 0.00 H new ATOM 197 N GLY A 13 13.579 -17.968 4.537 1.00 0.00 N ATOM 198 CA GLY A 13 12.852 -16.720 4.390 1.00 0.00 C ATOM 199 C GLY A 13 11.412 -16.831 4.849 1.00 0.00 C ATOM 200 O GLY A 13 10.969 -17.897 5.275 1.00 0.00 O ATOM 0 H GLY A 13 14.464 -17.892 5.038 1.00 0.00 H new ATOM 0 HA2 GLY A 13 13.354 -15.941 4.964 1.00 0.00 H new ATOM 0 HA3 GLY A 13 12.874 -16.411 3.345 1.00 0.00 H new ATOM 204 N ASN A 14 10.678 -15.726 4.762 1.00 0.00 N ATOM 205 CA ASN A 14 9.280 -15.703 5.174 1.00 0.00 C ATOM 206 C ASN A 14 8.355 -15.803 3.965 1.00 0.00 C ATOM 207 O ASN A 14 8.644 -15.255 2.901 1.00 0.00 O ATOM 208 CB ASN A 14 8.978 -14.423 5.956 1.00 0.00 C ATOM 209 CG ASN A 14 9.434 -14.506 7.399 1.00 0.00 C ATOM 210 OD1 ASN A 14 8.979 -15.363 8.158 1.00 0.00 O ATOM 211 ND2 ASN A 14 10.338 -13.613 7.787 1.00 0.00 N ATOM 0 H ASN A 14 11.029 -14.835 4.410 1.00 0.00 H new ATOM 0 HA ASN A 14 9.103 -16.565 5.818 1.00 0.00 H new ATOM 0 HB2 ASN A 14 9.469 -13.580 5.471 1.00 0.00 H new ATOM 0 HB3 ASN A 14 7.906 -14.227 5.927 1.00 0.00 H new ATOM 0 HD21 ASN A 14 10.682 -13.620 8.747 1.00 0.00 H new ATOM 0 HD22 ASN A 14 10.688 -12.921 7.125 1.00 0.00 H new ATOM 218 N SER A 15 7.241 -16.508 4.136 1.00 0.00 N ATOM 219 CA SER A 15 6.274 -16.684 3.058 1.00 0.00 C ATOM 220 C SER A 15 5.110 -15.709 3.208 1.00 0.00 C ATOM 221 O SER A 15 4.735 -15.023 2.257 1.00 0.00 O ATOM 222 CB SER A 15 5.752 -18.121 3.042 1.00 0.00 C ATOM 223 OG SER A 15 5.214 -18.482 4.303 1.00 0.00 O ATOM 0 H SER A 15 6.986 -16.967 5.011 1.00 0.00 H new ATOM 0 HA SER A 15 6.778 -16.478 2.114 1.00 0.00 H new ATOM 0 HB2 SER A 15 4.986 -18.225 2.273 1.00 0.00 H new ATOM 0 HB3 SER A 15 6.561 -18.802 2.780 1.00 0.00 H new ATOM 0 HG SER A 15 4.885 -19.405 4.266 1.00 0.00 H new ATOM 229 N ASP A 16 4.543 -15.655 4.408 1.00 0.00 N ATOM 230 CA ASP A 16 3.422 -14.764 4.684 1.00 0.00 C ATOM 231 C ASP A 16 3.472 -14.258 6.123 1.00 0.00 C ATOM 232 O ASP A 16 3.543 -15.033 7.077 1.00 0.00 O ATOM 233 CB ASP A 16 2.097 -15.483 4.429 1.00 0.00 C ATOM 234 CG ASP A 16 1.733 -16.440 5.547 1.00 0.00 C ATOM 235 OD1 ASP A 16 2.507 -17.389 5.792 1.00 0.00 O ATOM 236 OD2 ASP A 16 0.674 -16.239 6.178 1.00 0.00 O ATOM 0 H ASP A 16 4.841 -16.217 5.205 1.00 0.00 H new ATOM 0 HA ASP A 16 3.496 -13.908 4.014 1.00 0.00 H new ATOM 0 HB2 ASP A 16 1.303 -14.745 4.313 1.00 0.00 H new ATOM 0 HB3 ASP A 16 2.160 -16.033 3.490 1.00 0.00 H new ATOM 241 N PRO A 17 3.436 -12.927 6.284 1.00 0.00 N ATOM 242 CA PRO A 17 3.476 -12.288 7.603 1.00 0.00 C ATOM 243 C PRO A 17 2.196 -12.518 8.398 1.00 0.00 C ATOM 244 O PRO A 17 2.154 -12.287 9.606 1.00 0.00 O ATOM 245 CB PRO A 17 3.641 -10.802 7.272 1.00 0.00 C ATOM 246 CG PRO A 17 3.064 -10.652 5.906 1.00 0.00 C ATOM 247 CD PRO A 17 3.351 -11.943 5.191 1.00 0.00 C ATOM 0 HA PRO A 17 4.274 -12.691 8.227 1.00 0.00 H new ATOM 0 HB2 PRO A 17 3.118 -10.175 7.994 1.00 0.00 H new ATOM 0 HB3 PRO A 17 4.690 -10.506 7.294 1.00 0.00 H new ATOM 0 HG2 PRO A 17 1.992 -10.463 5.954 1.00 0.00 H new ATOM 0 HG3 PRO A 17 3.514 -9.808 5.383 1.00 0.00 H new ATOM 0 HD2 PRO A 17 2.561 -12.195 4.484 1.00 0.00 H new ATOM 0 HD3 PRO A 17 4.281 -11.890 4.624 1.00 0.00 H new ATOM 255 N ALA A 18 1.153 -12.974 7.712 1.00 0.00 N ATOM 256 CA ALA A 18 -0.128 -13.238 8.356 1.00 0.00 C ATOM 257 C ALA A 18 -0.193 -14.666 8.886 1.00 0.00 C ATOM 258 O ALA A 18 0.670 -15.491 8.583 1.00 0.00 O ATOM 259 CB ALA A 18 -1.270 -12.981 7.383 1.00 0.00 C ATOM 0 H ALA A 18 1.170 -13.168 6.711 1.00 0.00 H new ATOM 0 HA ALA A 18 -0.227 -12.560 9.204 1.00 0.00 H new ATOM 0 HB1 ALA A 18 -2.221 -13.182 7.877 1.00 0.00 H new ATOM 0 HB2 ALA A 18 -1.243 -11.941 7.057 1.00 0.00 H new ATOM 0 HB3 ALA A 18 -1.165 -13.635 6.518 1.00 0.00 H new ATOM 265 N HIS A 19 -1.221 -14.953 9.678 1.00 0.00 N ATOM 266 CA HIS A 19 -1.398 -16.283 10.251 1.00 0.00 C ATOM 267 C HIS A 19 -2.516 -17.036 9.538 1.00 0.00 C ATOM 268 O HIS A 19 -3.367 -17.657 10.177 1.00 0.00 O ATOM 269 CB HIS A 19 -1.707 -16.181 11.745 1.00 0.00 C ATOM 270 CG HIS A 19 -0.719 -15.351 12.505 1.00 0.00 C ATOM 271 ND1 HIS A 19 0.128 -15.875 13.459 1.00 0.00 N ATOM 272 CD2 HIS A 19 -0.445 -14.027 12.447 1.00 0.00 C ATOM 273 CE1 HIS A 19 0.879 -14.908 13.956 1.00 0.00 C ATOM 274 NE2 HIS A 19 0.552 -13.777 13.359 1.00 0.00 N ATOM 0 H HIS A 19 -1.944 -14.282 9.938 1.00 0.00 H new ATOM 0 HA HIS A 19 -0.468 -16.836 10.118 1.00 0.00 H new ATOM 0 HB2 HIS A 19 -2.702 -15.755 11.874 1.00 0.00 H new ATOM 0 HB3 HIS A 19 -1.732 -17.184 12.172 1.00 0.00 H new ATOM 0 HD2 HIS A 19 -0.921 -13.302 11.804 1.00 0.00 H new ATOM 0 HE1 HIS A 19 1.633 -15.023 14.721 1.00 0.00 H new ATOM 0 HE2 HIS A 19 0.971 -12.866 13.544 1.00 0.00 H new ATOM 282 N THR A 20 -2.510 -16.978 8.210 1.00 0.00 N ATOM 283 CA THR A 20 -3.525 -17.653 7.410 1.00 0.00 C ATOM 284 C THR A 20 -2.891 -18.447 6.274 1.00 0.00 C ATOM 285 O THR A 20 -1.767 -18.166 5.859 1.00 0.00 O ATOM 286 CB THR A 20 -4.534 -16.650 6.819 1.00 0.00 C ATOM 287 OG1 THR A 20 -3.837 -15.579 6.172 1.00 0.00 O ATOM 288 CG2 THR A 20 -5.440 -16.090 7.905 1.00 0.00 C ATOM 0 H THR A 20 -1.813 -16.470 7.665 1.00 0.00 H new ATOM 0 HA THR A 20 -4.051 -18.335 8.078 1.00 0.00 H new ATOM 0 HB THR A 20 -5.151 -17.175 6.090 1.00 0.00 H new ATOM 0 HG1 THR A 20 -4.485 -14.946 5.797 1.00 0.00 H new ATOM 0 HG21 THR A 20 -6.144 -15.384 7.464 1.00 0.00 H new ATOM 0 HG22 THR A 20 -5.990 -16.905 8.376 1.00 0.00 H new ATOM 0 HG23 THR A 20 -4.836 -15.579 8.655 1.00 0.00 H new ATOM 296 N ALA A 21 -3.619 -19.441 5.775 1.00 0.00 N ATOM 297 CA ALA A 21 -3.129 -20.275 4.685 1.00 0.00 C ATOM 298 C ALA A 21 -3.750 -19.861 3.355 1.00 0.00 C ATOM 299 O ALA A 21 -4.865 -19.340 3.314 1.00 0.00 O ATOM 300 CB ALA A 21 -3.416 -21.741 4.971 1.00 0.00 C ATOM 0 H ALA A 21 -4.551 -19.688 6.109 1.00 0.00 H new ATOM 0 HA ALA A 21 -2.050 -20.136 4.611 1.00 0.00 H new ATOM 0 HB1 ALA A 21 -3.044 -22.352 4.148 1.00 0.00 H new ATOM 0 HB2 ALA A 21 -2.919 -22.036 5.895 1.00 0.00 H new ATOM 0 HB3 ALA A 21 -4.491 -21.888 5.075 1.00 0.00 H new ATOM 306 N THR A 22 -3.022 -20.096 2.268 1.00 0.00 N ATOM 307 CA THR A 22 -3.501 -19.747 0.937 1.00 0.00 C ATOM 308 C THR A 22 -3.450 -20.949 0.001 1.00 0.00 C ATOM 309 O THR A 22 -2.394 -21.287 -0.533 1.00 0.00 O ATOM 310 CB THR A 22 -2.675 -18.599 0.326 1.00 0.00 C ATOM 311 OG1 THR A 22 -1.278 -18.900 0.414 1.00 0.00 O ATOM 312 CG2 THR A 22 -2.962 -17.286 1.039 1.00 0.00 C ATOM 0 H THR A 22 -2.098 -20.527 2.284 1.00 0.00 H new ATOM 0 HA THR A 22 -4.535 -19.421 1.049 1.00 0.00 H new ATOM 0 HB THR A 22 -2.959 -18.495 -0.721 1.00 0.00 H new ATOM 0 HG1 THR A 22 -1.111 -19.790 0.039 1.00 0.00 H new ATOM 0 HG21 THR A 22 -2.367 -16.491 0.590 1.00 0.00 H new ATOM 0 HG22 THR A 22 -4.021 -17.045 0.945 1.00 0.00 H new ATOM 0 HG23 THR A 22 -2.704 -17.381 2.094 1.00 0.00 H new ATOM 320 N ALA A 23 -4.598 -21.590 -0.194 1.00 0.00 N ATOM 321 CA ALA A 23 -4.684 -22.754 -1.068 1.00 0.00 C ATOM 322 C ALA A 23 -4.843 -22.334 -2.526 1.00 0.00 C ATOM 323 O ALA A 23 -5.249 -21.214 -2.834 1.00 0.00 O ATOM 324 CB ALA A 23 -5.840 -23.648 -0.645 1.00 0.00 C ATOM 0 H ALA A 23 -5.481 -21.323 0.241 1.00 0.00 H new ATOM 0 HA ALA A 23 -3.754 -23.315 -0.978 1.00 0.00 H new ATOM 0 HB1 ALA A 23 -5.892 -24.513 -1.306 1.00 0.00 H new ATOM 0 HB2 ALA A 23 -5.684 -23.984 0.380 1.00 0.00 H new ATOM 0 HB3 ALA A 23 -6.774 -23.089 -0.705 1.00 0.00 H new ATOM 330 N PRO A 24 -4.515 -23.254 -3.446 1.00 0.00 N ATOM 331 CA PRO A 24 -4.613 -23.002 -4.887 1.00 0.00 C ATOM 332 C PRO A 24 -6.059 -22.901 -5.360 1.00 0.00 C ATOM 333 O PRO A 24 -6.322 -22.723 -6.549 1.00 0.00 O ATOM 334 CB PRO A 24 -3.931 -24.223 -5.508 1.00 0.00 C ATOM 335 CG PRO A 24 -4.076 -25.298 -4.487 1.00 0.00 C ATOM 336 CD PRO A 24 -4.024 -24.610 -3.151 1.00 0.00 C ATOM 0 HA PRO A 24 -4.155 -22.053 -5.167 1.00 0.00 H new ATOM 0 HB2 PRO A 24 -4.404 -24.504 -6.449 1.00 0.00 H new ATOM 0 HB3 PRO A 24 -2.882 -24.023 -5.726 1.00 0.00 H new ATOM 0 HG2 PRO A 24 -5.017 -25.833 -4.614 1.00 0.00 H new ATOM 0 HG3 PRO A 24 -3.277 -26.034 -4.579 1.00 0.00 H new ATOM 0 HD2 PRO A 24 -4.651 -25.113 -2.415 1.00 0.00 H new ATOM 0 HD3 PRO A 24 -3.012 -24.592 -2.748 1.00 0.00 H new ATOM 344 N GLY A 25 -6.994 -23.015 -4.421 1.00 0.00 N ATOM 345 CA GLY A 25 -8.402 -22.933 -4.763 1.00 0.00 C ATOM 346 C GLY A 25 -8.822 -24.004 -5.751 1.00 0.00 C ATOM 347 O GLY A 25 -8.262 -24.105 -6.842 1.00 0.00 O ATOM 0 H GLY A 25 -6.801 -23.163 -3.430 1.00 0.00 H new ATOM 0 HA2 GLY A 25 -8.999 -23.026 -3.856 1.00 0.00 H new ATOM 0 HA3 GLY A 25 -8.614 -21.951 -5.185 1.00 0.00 H new ATOM 351 N GLY A 26 -9.810 -24.806 -5.368 1.00 0.00 N ATOM 352 CA GLY A 26 -10.286 -25.865 -6.239 1.00 0.00 C ATOM 353 C GLY A 26 -11.762 -26.154 -6.047 1.00 0.00 C ATOM 354 O GLY A 26 -12.244 -27.228 -6.408 1.00 0.00 O ATOM 0 H GLY A 26 -10.290 -24.742 -4.470 1.00 0.00 H new ATOM 0 HA2 GLY A 26 -10.106 -25.586 -7.277 1.00 0.00 H new ATOM 0 HA3 GLY A 26 -9.713 -26.773 -6.049 1.00 0.00 H new ATOM 358 N LEU A 27 -12.482 -25.194 -5.476 1.00 0.00 N ATOM 359 CA LEU A 27 -13.912 -25.351 -5.234 1.00 0.00 C ATOM 360 C LEU A 27 -14.654 -25.645 -6.534 1.00 0.00 C ATOM 361 O LEU A 27 -14.178 -25.317 -7.621 1.00 0.00 O ATOM 362 CB LEU A 27 -14.481 -24.090 -4.582 1.00 0.00 C ATOM 363 CG LEU A 27 -14.503 -24.077 -3.054 1.00 0.00 C ATOM 364 CD1 LEU A 27 -14.436 -22.650 -2.531 1.00 0.00 C ATOM 365 CD2 LEU A 27 -15.748 -24.779 -2.532 1.00 0.00 C ATOM 0 H LEU A 27 -12.099 -24.299 -5.172 1.00 0.00 H new ATOM 0 HA LEU A 27 -14.051 -26.195 -4.558 1.00 0.00 H new ATOM 0 HB2 LEU A 27 -13.900 -23.234 -4.924 1.00 0.00 H new ATOM 0 HB3 LEU A 27 -15.500 -23.947 -4.941 1.00 0.00 H new ATOM 0 HG LEU A 27 -13.627 -24.617 -2.693 1.00 0.00 H new ATOM 0 HD11 LEU A 27 -14.453 -22.661 -1.441 1.00 0.00 H new ATOM 0 HD12 LEU A 27 -13.515 -22.179 -2.875 1.00 0.00 H new ATOM 0 HD13 LEU A 27 -15.292 -22.086 -2.901 1.00 0.00 H new ATOM 0 HD21 LEU A 27 -15.746 -24.760 -1.442 1.00 0.00 H new ATOM 0 HD22 LEU A 27 -16.636 -24.268 -2.903 1.00 0.00 H new ATOM 0 HD23 LEU A 27 -15.754 -25.813 -2.877 1.00 0.00 H new ATOM 377 N SER A 28 -15.825 -26.263 -6.414 1.00 0.00 N ATOM 378 CA SER A 28 -16.633 -26.602 -7.580 1.00 0.00 C ATOM 379 C SER A 28 -17.907 -25.763 -7.620 1.00 0.00 C ATOM 380 O SER A 28 -18.732 -25.909 -8.522 1.00 0.00 O ATOM 381 CB SER A 28 -16.989 -28.089 -7.565 1.00 0.00 C ATOM 382 OG SER A 28 -15.872 -28.884 -7.923 1.00 0.00 O ATOM 0 H SER A 28 -16.235 -26.539 -5.522 1.00 0.00 H new ATOM 0 HA SER A 28 -16.047 -26.385 -8.473 1.00 0.00 H new ATOM 0 HB2 SER A 28 -17.338 -28.373 -6.572 1.00 0.00 H new ATOM 0 HB3 SER A 28 -17.810 -28.277 -8.257 1.00 0.00 H new ATOM 0 HG SER A 28 -16.125 -29.831 -7.904 1.00 0.00 H new ATOM 388 N ALA A 29 -18.061 -24.884 -6.635 1.00 0.00 N ATOM 389 CA ALA A 29 -19.233 -24.020 -6.558 1.00 0.00 C ATOM 390 C ALA A 29 -18.990 -22.850 -5.611 1.00 0.00 C ATOM 391 O ALA A 29 -18.025 -22.845 -4.846 1.00 0.00 O ATOM 392 CB ALA A 29 -20.448 -24.819 -6.112 1.00 0.00 C ATOM 0 H ALA A 29 -17.389 -24.751 -5.879 1.00 0.00 H new ATOM 0 HA ALA A 29 -19.423 -23.616 -7.552 1.00 0.00 H new ATOM 0 HB1 ALA A 29 -21.316 -24.162 -6.059 1.00 0.00 H new ATOM 0 HB2 ALA A 29 -20.641 -25.618 -6.828 1.00 0.00 H new ATOM 0 HB3 ALA A 29 -20.259 -25.251 -5.129 1.00 0.00 H new ATOM 398 N LYS A 30 -19.871 -21.857 -5.668 1.00 0.00 N ATOM 399 CA LYS A 30 -19.754 -20.679 -4.816 1.00 0.00 C ATOM 400 C LYS A 30 -20.036 -21.032 -3.359 1.00 0.00 C ATOM 401 O LYS A 30 -21.010 -21.719 -3.054 1.00 0.00 O ATOM 402 CB LYS A 30 -20.719 -19.588 -5.283 1.00 0.00 C ATOM 403 CG LYS A 30 -22.162 -20.051 -5.378 1.00 0.00 C ATOM 404 CD LYS A 30 -23.059 -18.969 -5.953 1.00 0.00 C ATOM 405 CE LYS A 30 -23.147 -19.064 -7.469 1.00 0.00 C ATOM 406 NZ LYS A 30 -23.517 -17.761 -8.086 1.00 0.00 N ATOM 0 H LYS A 30 -20.675 -21.844 -6.296 1.00 0.00 H new ATOM 0 HA LYS A 30 -18.732 -20.307 -4.891 1.00 0.00 H new ATOM 0 HB2 LYS A 30 -20.662 -18.745 -4.594 1.00 0.00 H new ATOM 0 HB3 LYS A 30 -20.398 -19.225 -6.259 1.00 0.00 H new ATOM 0 HG2 LYS A 30 -22.219 -20.942 -6.004 1.00 0.00 H new ATOM 0 HG3 LYS A 30 -22.520 -20.333 -4.388 1.00 0.00 H new ATOM 0 HD2 LYS A 30 -24.057 -19.056 -5.524 1.00 0.00 H new ATOM 0 HD3 LYS A 30 -22.675 -17.989 -5.671 1.00 0.00 H new ATOM 0 HE2 LYS A 30 -22.188 -19.396 -7.868 1.00 0.00 H new ATOM 0 HE3 LYS A 30 -23.885 -19.818 -7.743 1.00 0.00 H new ATOM 0 HZ1 LYS A 30 -23.567 -17.868 -9.119 1.00 0.00 H new ATOM 0 HZ2 LYS A 30 -24.443 -17.456 -7.725 1.00 0.00 H new ATOM 0 HZ3 LYS A 30 -22.800 -17.047 -7.846 1.00 0.00 H new ATOM 420 N ALA A 31 -19.177 -20.556 -2.463 1.00 0.00 N ATOM 421 CA ALA A 31 -19.337 -20.818 -1.038 1.00 0.00 C ATOM 422 C ALA A 31 -19.022 -19.576 -0.212 1.00 0.00 C ATOM 423 O ALA A 31 -18.011 -18.904 -0.418 1.00 0.00 O ATOM 424 CB ALA A 31 -18.447 -21.977 -0.612 1.00 0.00 C ATOM 0 H ALA A 31 -18.364 -19.987 -2.699 1.00 0.00 H new ATOM 0 HA ALA A 31 -20.378 -21.087 -0.858 1.00 0.00 H new ATOM 0 HB1 ALA A 31 -18.576 -22.162 0.454 1.00 0.00 H new ATOM 0 HB2 ALA A 31 -18.722 -22.871 -1.171 1.00 0.00 H new ATOM 0 HB3 ALA A 31 -17.405 -21.729 -0.813 1.00 0.00 H new ATOM 430 N PRO A 32 -19.907 -19.260 0.745 1.00 0.00 N ATOM 431 CA PRO A 32 -19.745 -18.096 1.621 1.00 0.00 C ATOM 432 C PRO A 32 -18.593 -18.268 2.606 1.00 0.00 C ATOM 433 O PRO A 32 -18.132 -19.383 2.848 1.00 0.00 O ATOM 434 CB PRO A 32 -21.080 -18.024 2.367 1.00 0.00 C ATOM 435 CG PRO A 32 -21.601 -19.419 2.345 1.00 0.00 C ATOM 436 CD PRO A 32 -21.134 -20.016 1.046 1.00 0.00 C ATOM 0 HA PRO A 32 -19.506 -17.193 1.059 1.00 0.00 H new ATOM 0 HB2 PRO A 32 -20.944 -17.668 3.388 1.00 0.00 H new ATOM 0 HB3 PRO A 32 -21.770 -17.336 1.879 1.00 0.00 H new ATOM 0 HG2 PRO A 32 -21.225 -19.989 3.194 1.00 0.00 H new ATOM 0 HG3 PRO A 32 -22.689 -19.430 2.411 1.00 0.00 H new ATOM 0 HD2 PRO A 32 -20.935 -21.083 1.143 1.00 0.00 H new ATOM 0 HD3 PRO A 32 -21.880 -19.901 0.260 1.00 0.00 H new ATOM 444 N ALA A 33 -18.133 -17.156 3.170 1.00 0.00 N ATOM 445 CA ALA A 33 -17.037 -17.184 4.131 1.00 0.00 C ATOM 446 C ALA A 33 -17.530 -17.591 5.515 1.00 0.00 C ATOM 447 O ALA A 33 -18.698 -17.936 5.691 1.00 0.00 O ATOM 448 CB ALA A 33 -16.352 -15.827 4.190 1.00 0.00 C ATOM 0 H ALA A 33 -18.502 -16.225 2.978 1.00 0.00 H new ATOM 0 HA ALA A 33 -16.314 -17.929 3.799 1.00 0.00 H new ATOM 0 HB1 ALA A 33 -15.536 -15.863 4.912 1.00 0.00 H new ATOM 0 HB2 ALA A 33 -15.956 -15.576 3.206 1.00 0.00 H new ATOM 0 HB3 ALA A 33 -17.073 -15.068 4.495 1.00 0.00 H new ATOM 454 N MET A 34 -16.632 -17.549 6.494 1.00 0.00 N ATOM 455 CA MET A 34 -16.978 -17.913 7.863 1.00 0.00 C ATOM 456 C MET A 34 -17.507 -19.342 7.929 1.00 0.00 C ATOM 457 O MET A 34 -18.583 -19.593 8.474 1.00 0.00 O ATOM 458 CB MET A 34 -18.021 -16.944 8.423 1.00 0.00 C ATOM 459 CG MET A 34 -17.417 -15.706 9.067 1.00 0.00 C ATOM 460 SD MET A 34 -16.258 -16.106 10.389 1.00 0.00 S ATOM 461 CE MET A 34 -17.277 -17.149 11.429 1.00 0.00 C ATOM 0 H MET A 34 -15.660 -17.267 6.365 1.00 0.00 H new ATOM 0 HA MET A 34 -16.074 -17.851 8.468 1.00 0.00 H new ATOM 0 HB2 MET A 34 -18.688 -16.636 7.618 1.00 0.00 H new ATOM 0 HB3 MET A 34 -18.631 -17.466 9.160 1.00 0.00 H new ATOM 0 HG2 MET A 34 -16.905 -15.118 8.305 1.00 0.00 H new ATOM 0 HG3 MET A 34 -18.217 -15.082 9.467 1.00 0.00 H new ATOM 0 HE1 MET A 34 -16.937 -17.076 12.462 1.00 0.00 H new ATOM 0 HE2 MET A 34 -18.315 -16.824 11.365 1.00 0.00 H new ATOM 0 HE3 MET A 34 -17.200 -18.183 11.094 1.00 0.00 H new ATOM 471 N THR A 35 -16.744 -20.277 7.371 1.00 0.00 N ATOM 472 CA THR A 35 -17.137 -21.680 7.365 1.00 0.00 C ATOM 473 C THR A 35 -15.924 -22.590 7.208 1.00 0.00 C ATOM 474 O THR A 35 -14.940 -22.245 6.553 1.00 0.00 O ATOM 475 CB THR A 35 -18.138 -21.979 6.233 1.00 0.00 C ATOM 476 OG1 THR A 35 -17.508 -21.796 4.961 1.00 0.00 O ATOM 477 CG2 THR A 35 -19.357 -21.074 6.336 1.00 0.00 C ATOM 0 H THR A 35 -15.850 -20.087 6.917 1.00 0.00 H new ATOM 0 HA THR A 35 -17.615 -21.878 8.324 1.00 0.00 H new ATOM 0 HB THR A 35 -18.464 -23.014 6.330 1.00 0.00 H new ATOM 0 HG1 THR A 35 -17.887 -21.008 4.518 1.00 0.00 H new ATOM 0 HG21 THR A 35 -20.050 -21.303 5.526 1.00 0.00 H new ATOM 0 HG22 THR A 35 -19.851 -21.237 7.294 1.00 0.00 H new ATOM 0 HG23 THR A 35 -19.044 -20.032 6.262 1.00 0.00 H new ATOM 485 N PRO A 36 -15.993 -23.781 7.821 1.00 0.00 N ATOM 486 CA PRO A 36 -14.908 -24.765 7.763 1.00 0.00 C ATOM 487 C PRO A 36 -14.757 -25.379 6.375 1.00 0.00 C ATOM 488 O PRO A 36 -15.744 -25.606 5.674 1.00 0.00 O ATOM 489 CB PRO A 36 -15.341 -25.830 8.774 1.00 0.00 C ATOM 490 CG PRO A 36 -16.825 -25.713 8.836 1.00 0.00 C ATOM 491 CD PRO A 36 -17.135 -24.258 8.619 1.00 0.00 C ATOM 0 HA PRO A 36 -13.939 -24.317 7.983 1.00 0.00 H new ATOM 0 HB2 PRO A 36 -15.036 -26.826 8.455 1.00 0.00 H new ATOM 0 HB3 PRO A 36 -14.889 -25.656 9.750 1.00 0.00 H new ATOM 0 HG2 PRO A 36 -17.297 -26.331 8.072 1.00 0.00 H new ATOM 0 HG3 PRO A 36 -17.203 -26.053 9.800 1.00 0.00 H new ATOM 0 HD2 PRO A 36 -18.079 -24.123 8.091 1.00 0.00 H new ATOM 0 HD3 PRO A 36 -17.218 -23.720 9.563 1.00 0.00 H new ATOM 499 N LEU A 37 -13.516 -25.646 5.983 1.00 0.00 N ATOM 500 CA LEU A 37 -13.235 -26.234 4.678 1.00 0.00 C ATOM 501 C LEU A 37 -12.524 -27.575 4.827 1.00 0.00 C ATOM 502 O LEU A 37 -12.081 -27.936 5.917 1.00 0.00 O ATOM 503 CB LEU A 37 -12.382 -25.281 3.840 1.00 0.00 C ATOM 504 CG LEU A 37 -12.821 -23.817 3.832 1.00 0.00 C ATOM 505 CD1 LEU A 37 -11.713 -22.930 3.286 1.00 0.00 C ATOM 506 CD2 LEU A 37 -14.094 -23.646 3.016 1.00 0.00 C ATOM 0 H LEU A 37 -12.688 -25.465 6.550 1.00 0.00 H new ATOM 0 HA LEU A 37 -14.185 -26.402 4.170 1.00 0.00 H new ATOM 0 HB2 LEU A 37 -11.356 -25.329 4.204 1.00 0.00 H new ATOM 0 HB3 LEU A 37 -12.373 -25.642 2.812 1.00 0.00 H new ATOM 0 HG LEU A 37 -13.028 -23.515 4.859 1.00 0.00 H new ATOM 0 HD11 LEU A 37 -12.044 -21.891 3.288 1.00 0.00 H new ATOM 0 HD12 LEU A 37 -10.826 -23.029 3.912 1.00 0.00 H new ATOM 0 HD13 LEU A 37 -11.474 -23.233 2.267 1.00 0.00 H new ATOM 0 HD21 LEU A 37 -14.392 -22.597 3.022 1.00 0.00 H new ATOM 0 HD22 LEU A 37 -13.914 -23.967 1.990 1.00 0.00 H new ATOM 0 HD23 LEU A 37 -14.889 -24.251 3.451 1.00 0.00 H new ATOM 518 N MET A 38 -12.416 -28.308 3.724 1.00 0.00 N ATOM 519 CA MET A 38 -11.754 -29.607 3.731 1.00 0.00 C ATOM 520 C MET A 38 -10.853 -29.766 2.511 1.00 0.00 C ATOM 521 O MET A 38 -11.211 -29.358 1.405 1.00 0.00 O ATOM 522 CB MET A 38 -12.791 -30.731 3.763 1.00 0.00 C ATOM 523 CG MET A 38 -13.445 -30.993 2.417 1.00 0.00 C ATOM 524 SD MET A 38 -12.553 -32.217 1.437 1.00 0.00 S ATOM 525 CE MET A 38 -13.045 -33.731 2.258 1.00 0.00 C ATOM 0 H MET A 38 -12.779 -28.024 2.814 1.00 0.00 H new ATOM 0 HA MET A 38 -11.136 -29.666 4.627 1.00 0.00 H new ATOM 0 HB2 MET A 38 -12.312 -31.647 4.109 1.00 0.00 H new ATOM 0 HB3 MET A 38 -13.563 -30.481 4.490 1.00 0.00 H new ATOM 0 HG2 MET A 38 -14.468 -31.335 2.575 1.00 0.00 H new ATOM 0 HG3 MET A 38 -13.504 -30.059 1.858 1.00 0.00 H new ATOM 0 HE1 MET A 38 -12.157 -34.284 2.565 1.00 0.00 H new ATOM 0 HE2 MET A 38 -13.644 -33.491 3.136 1.00 0.00 H new ATOM 0 HE3 MET A 38 -13.634 -34.342 1.573 1.00 0.00 H new ATOM 535 N LEU A 39 -9.683 -30.360 2.718 1.00 0.00 N ATOM 536 CA LEU A 39 -8.730 -30.572 1.634 1.00 0.00 C ATOM 537 C LEU A 39 -8.949 -31.930 0.975 1.00 0.00 C ATOM 538 O LEU A 39 -9.022 -32.956 1.652 1.00 0.00 O ATOM 539 CB LEU A 39 -7.297 -30.474 2.162 1.00 0.00 C ATOM 540 CG LEU A 39 -6.213 -31.090 1.277 1.00 0.00 C ATOM 541 CD1 LEU A 39 -5.909 -30.183 0.095 1.00 0.00 C ATOM 542 CD2 LEU A 39 -4.951 -31.354 2.087 1.00 0.00 C ATOM 0 H LEU A 39 -9.371 -30.703 3.626 1.00 0.00 H new ATOM 0 HA LEU A 39 -8.889 -29.795 0.886 1.00 0.00 H new ATOM 0 HB2 LEU A 39 -7.058 -29.421 2.315 1.00 0.00 H new ATOM 0 HB3 LEU A 39 -7.257 -30.955 3.139 1.00 0.00 H new ATOM 0 HG LEU A 39 -6.581 -32.041 0.893 1.00 0.00 H new ATOM 0 HD11 LEU A 39 -5.135 -30.638 -0.523 1.00 0.00 H new ATOM 0 HD12 LEU A 39 -6.813 -30.044 -0.499 1.00 0.00 H new ATOM 0 HD13 LEU A 39 -5.561 -29.216 0.458 1.00 0.00 H new ATOM 0 HD21 LEU A 39 -4.190 -31.792 1.442 1.00 0.00 H new ATOM 0 HD22 LEU A 39 -4.580 -30.416 2.500 1.00 0.00 H new ATOM 0 HD23 LEU A 39 -5.178 -32.043 2.900 1.00 0.00 H new ATOM 554 N ASP A 40 -9.050 -31.929 -0.350 1.00 0.00 N ATOM 555 CA ASP A 40 -9.256 -33.162 -1.102 1.00 0.00 C ATOM 556 C ASP A 40 -7.996 -34.020 -1.095 1.00 0.00 C ATOM 557 O ASP A 40 -6.932 -33.578 -0.660 1.00 0.00 O ATOM 558 CB ASP A 40 -9.664 -32.843 -2.541 1.00 0.00 C ATOM 559 CG ASP A 40 -11.169 -32.796 -2.719 1.00 0.00 C ATOM 560 OD1 ASP A 40 -11.826 -32.011 -2.005 1.00 0.00 O ATOM 561 OD2 ASP A 40 -11.690 -33.545 -3.573 1.00 0.00 O ATOM 0 H ASP A 40 -8.993 -31.089 -0.925 1.00 0.00 H new ATOM 0 HA ASP A 40 -10.057 -33.723 -0.621 1.00 0.00 H new ATOM 0 HB2 ASP A 40 -9.236 -31.884 -2.833 1.00 0.00 H new ATOM 0 HB3 ASP A 40 -9.245 -33.595 -3.210 1.00 0.00 H new ATOM 566 N THR A 41 -8.122 -35.252 -1.580 1.00 0.00 N ATOM 567 CA THR A 41 -6.994 -36.173 -1.628 1.00 0.00 C ATOM 568 C THR A 41 -6.603 -36.489 -3.067 1.00 0.00 C ATOM 569 O THR A 41 -5.421 -36.490 -3.413 1.00 0.00 O ATOM 570 CB THR A 41 -7.313 -37.490 -0.894 1.00 0.00 C ATOM 571 OG1 THR A 41 -7.483 -37.241 0.506 1.00 0.00 O ATOM 572 CG2 THR A 41 -6.201 -38.508 -1.102 1.00 0.00 C ATOM 0 H THR A 41 -8.994 -35.634 -1.945 1.00 0.00 H new ATOM 0 HA THR A 41 -6.161 -35.679 -1.128 1.00 0.00 H new ATOM 0 HB THR A 41 -8.237 -37.896 -1.305 1.00 0.00 H new ATOM 0 HG1 THR A 41 -7.687 -38.082 0.965 1.00 0.00 H new ATOM 0 HG21 THR A 41 -6.448 -39.429 -0.575 1.00 0.00 H new ATOM 0 HG22 THR A 41 -6.093 -38.717 -2.166 1.00 0.00 H new ATOM 0 HG23 THR A 41 -5.264 -38.108 -0.714 1.00 0.00 H new ATOM 580 N SER A 42 -7.602 -36.756 -3.902 1.00 0.00 N ATOM 581 CA SER A 42 -7.361 -37.076 -5.304 1.00 0.00 C ATOM 582 C SER A 42 -6.938 -35.833 -6.081 1.00 0.00 C ATOM 583 O SER A 42 -5.866 -35.800 -6.686 1.00 0.00 O ATOM 584 CB SER A 42 -8.617 -37.681 -5.934 1.00 0.00 C ATOM 585 OG SER A 42 -8.288 -38.506 -7.038 1.00 0.00 O ATOM 0 H SER A 42 -8.586 -36.757 -3.632 1.00 0.00 H new ATOM 0 HA SER A 42 -6.552 -37.805 -5.350 1.00 0.00 H new ATOM 0 HB2 SER A 42 -9.157 -38.265 -5.188 1.00 0.00 H new ATOM 0 HB3 SER A 42 -9.285 -36.883 -6.259 1.00 0.00 H new ATOM 0 HG SER A 42 -9.108 -38.882 -7.421 1.00 0.00 H new ATOM 591 N SER A 43 -7.787 -34.811 -6.058 1.00 0.00 N ATOM 592 CA SER A 43 -7.504 -33.566 -6.763 1.00 0.00 C ATOM 593 C SER A 43 -6.516 -32.709 -5.976 1.00 0.00 C ATOM 594 O SER A 43 -5.952 -31.750 -6.504 1.00 0.00 O ATOM 595 CB SER A 43 -8.798 -32.784 -7.000 1.00 0.00 C ATOM 596 OG SER A 43 -9.363 -32.350 -5.776 1.00 0.00 O ATOM 0 H SER A 43 -8.677 -34.820 -5.559 1.00 0.00 H new ATOM 0 HA SER A 43 -7.057 -33.815 -7.725 1.00 0.00 H new ATOM 0 HB2 SER A 43 -8.595 -31.922 -7.636 1.00 0.00 H new ATOM 0 HB3 SER A 43 -9.513 -33.411 -7.532 1.00 0.00 H new ATOM 0 HG SER A 43 -10.142 -32.904 -5.561 1.00 0.00 H new ATOM 602 N ARG A 44 -6.312 -33.063 -4.712 1.00 0.00 N ATOM 603 CA ARG A 44 -5.394 -32.327 -3.851 1.00 0.00 C ATOM 604 C ARG A 44 -5.652 -30.825 -3.939 1.00 0.00 C ATOM 605 O ARG A 44 -4.739 -30.041 -4.198 1.00 0.00 O ATOM 606 CB ARG A 44 -3.945 -32.629 -4.239 1.00 0.00 C ATOM 607 CG ARG A 44 -3.539 -34.074 -3.997 1.00 0.00 C ATOM 608 CD ARG A 44 -2.106 -34.330 -4.435 1.00 0.00 C ATOM 609 NE ARG A 44 -1.526 -35.488 -3.758 1.00 0.00 N ATOM 610 CZ ARG A 44 -0.277 -35.900 -3.948 1.00 0.00 C ATOM 611 NH1 ARG A 44 0.518 -35.253 -4.788 1.00 0.00 N ATOM 612 NH2 ARG A 44 0.178 -36.962 -3.295 1.00 0.00 N ATOM 0 H ARG A 44 -6.770 -33.855 -4.261 1.00 0.00 H new ATOM 0 HA ARG A 44 -5.563 -32.648 -2.823 1.00 0.00 H new ATOM 0 HB2 ARG A 44 -3.803 -32.392 -5.293 1.00 0.00 H new ATOM 0 HB3 ARG A 44 -3.282 -31.974 -3.673 1.00 0.00 H new ATOM 0 HG2 ARG A 44 -3.645 -34.310 -2.938 1.00 0.00 H new ATOM 0 HG3 ARG A 44 -4.211 -34.738 -4.541 1.00 0.00 H new ATOM 0 HD2 ARG A 44 -2.079 -34.489 -5.513 1.00 0.00 H new ATOM 0 HD3 ARG A 44 -1.500 -33.448 -4.228 1.00 0.00 H new ATOM 0 HE ARG A 44 -2.111 -36.008 -3.104 1.00 0.00 H new ATOM 0 HH11 ARG A 44 0.172 -34.436 -5.291 1.00 0.00 H new ATOM 0 HH12 ARG A 44 1.476 -35.572 -4.931 1.00 0.00 H new ATOM 0 HH21 ARG A 44 -0.431 -37.462 -2.647 1.00 0.00 H new ATOM 0 HH22 ARG A 44 1.137 -37.278 -3.441 1.00 0.00 H new ATOM 626 N LYS A 45 -6.902 -30.432 -3.722 1.00 0.00 N ATOM 627 CA LYS A 45 -7.282 -29.025 -3.775 1.00 0.00 C ATOM 628 C LYS A 45 -8.117 -28.640 -2.558 1.00 0.00 C ATOM 629 O LYS A 45 -8.725 -29.496 -1.914 1.00 0.00 O ATOM 630 CB LYS A 45 -8.067 -28.736 -5.057 1.00 0.00 C ATOM 631 CG LYS A 45 -9.462 -29.336 -5.065 1.00 0.00 C ATOM 632 CD LYS A 45 -9.991 -29.497 -6.481 1.00 0.00 C ATOM 633 CE LYS A 45 -11.344 -30.193 -6.494 1.00 0.00 C ATOM 634 NZ LYS A 45 -11.808 -30.478 -7.880 1.00 0.00 N ATOM 0 H LYS A 45 -7.670 -31.068 -3.508 1.00 0.00 H new ATOM 0 HA LYS A 45 -6.370 -28.428 -3.771 1.00 0.00 H new ATOM 0 HB2 LYS A 45 -8.144 -27.657 -5.190 1.00 0.00 H new ATOM 0 HB3 LYS A 45 -7.509 -29.123 -5.910 1.00 0.00 H new ATOM 0 HG2 LYS A 45 -9.445 -30.307 -4.569 1.00 0.00 H new ATOM 0 HG3 LYS A 45 -10.137 -28.698 -4.494 1.00 0.00 H new ATOM 0 HD2 LYS A 45 -10.080 -28.518 -6.951 1.00 0.00 H new ATOM 0 HD3 LYS A 45 -9.279 -30.072 -7.074 1.00 0.00 H new ATOM 0 HE2 LYS A 45 -11.278 -31.126 -5.934 1.00 0.00 H new ATOM 0 HE3 LYS A 45 -12.079 -29.568 -5.986 1.00 0.00 H new ATOM 0 HZ1 LYS A 45 -12.733 -30.952 -7.846 1.00 0.00 H new ATOM 0 HZ2 LYS A 45 -11.896 -29.586 -8.407 1.00 0.00 H new ATOM 0 HZ3 LYS A 45 -11.120 -31.095 -8.356 1.00 0.00 H new ATOM 648 N LEU A 46 -8.144 -27.349 -2.249 1.00 0.00 N ATOM 649 CA LEU A 46 -8.907 -26.850 -1.110 1.00 0.00 C ATOM 650 C LEU A 46 -10.350 -26.557 -1.507 1.00 0.00 C ATOM 651 O LEU A 46 -10.609 -25.728 -2.380 1.00 0.00 O ATOM 652 CB LEU A 46 -8.253 -25.586 -0.547 1.00 0.00 C ATOM 653 CG LEU A 46 -8.350 -25.398 0.967 1.00 0.00 C ATOM 654 CD1 LEU A 46 -9.718 -25.830 1.472 1.00 0.00 C ATOM 655 CD2 LEU A 46 -7.249 -26.175 1.673 1.00 0.00 C ATOM 0 H LEU A 46 -7.646 -26.628 -2.771 1.00 0.00 H new ATOM 0 HA LEU A 46 -8.912 -27.622 -0.341 1.00 0.00 H new ATOM 0 HB2 LEU A 46 -7.199 -25.591 -0.826 1.00 0.00 H new ATOM 0 HB3 LEU A 46 -8.706 -24.720 -1.030 1.00 0.00 H new ATOM 0 HG LEU A 46 -8.220 -24.339 1.191 1.00 0.00 H new ATOM 0 HD11 LEU A 46 -9.768 -25.689 2.552 1.00 0.00 H new ATOM 0 HD12 LEU A 46 -10.490 -25.229 0.991 1.00 0.00 H new ATOM 0 HD13 LEU A 46 -9.878 -26.882 1.236 1.00 0.00 H new ATOM 0 HD21 LEU A 46 -7.334 -26.029 2.750 1.00 0.00 H new ATOM 0 HD22 LEU A 46 -7.346 -27.236 1.442 1.00 0.00 H new ATOM 0 HD23 LEU A 46 -6.277 -25.818 1.334 1.00 0.00 H new ATOM 667 N VAL A 47 -11.287 -27.240 -0.858 1.00 0.00 N ATOM 668 CA VAL A 47 -12.705 -27.051 -1.140 1.00 0.00 C ATOM 669 C VAL A 47 -13.527 -27.056 0.144 1.00 0.00 C ATOM 670 O VAL A 47 -13.121 -27.637 1.150 1.00 0.00 O ATOM 671 CB VAL A 47 -13.240 -28.144 -2.084 1.00 0.00 C ATOM 672 CG1 VAL A 47 -12.314 -28.321 -3.277 1.00 0.00 C ATOM 673 CG2 VAL A 47 -13.413 -29.457 -1.334 1.00 0.00 C ATOM 0 H VAL A 47 -11.090 -27.930 -0.133 1.00 0.00 H new ATOM 0 HA VAL A 47 -12.804 -26.081 -1.627 1.00 0.00 H new ATOM 0 HB VAL A 47 -14.216 -27.832 -2.456 1.00 0.00 H new ATOM 0 HG11 VAL A 47 -12.709 -29.097 -3.932 1.00 0.00 H new ATOM 0 HG12 VAL A 47 -12.246 -27.382 -3.827 1.00 0.00 H new ATOM 0 HG13 VAL A 47 -11.323 -28.610 -2.928 1.00 0.00 H new ATOM 0 HG21 VAL A 47 -13.792 -30.218 -2.016 1.00 0.00 H new ATOM 0 HG22 VAL A 47 -12.451 -29.776 -0.932 1.00 0.00 H new ATOM 0 HG23 VAL A 47 -14.120 -29.318 -0.516 1.00 0.00 H new ATOM 683 N ALA A 48 -14.685 -26.405 0.102 1.00 0.00 N ATOM 684 CA ALA A 48 -15.565 -26.337 1.261 1.00 0.00 C ATOM 685 C ALA A 48 -15.766 -27.716 1.880 1.00 0.00 C ATOM 686 O ALA A 48 -15.644 -28.735 1.200 1.00 0.00 O ATOM 687 CB ALA A 48 -16.905 -25.731 0.871 1.00 0.00 C ATOM 0 H ALA A 48 -15.035 -25.917 -0.723 1.00 0.00 H new ATOM 0 HA ALA A 48 -15.093 -25.698 2.007 1.00 0.00 H new ATOM 0 HB1 ALA A 48 -17.553 -25.686 1.747 1.00 0.00 H new ATOM 0 HB2 ALA A 48 -16.750 -24.724 0.483 1.00 0.00 H new ATOM 0 HB3 ALA A 48 -17.374 -26.348 0.104 1.00 0.00 H new ATOM 693 N TRP A 49 -16.075 -27.741 3.171 1.00 0.00 N ATOM 694 CA TRP A 49 -16.292 -28.996 3.881 1.00 0.00 C ATOM 695 C TRP A 49 -17.566 -29.681 3.398 1.00 0.00 C ATOM 696 O TRP A 49 -18.584 -29.028 3.170 1.00 0.00 O ATOM 697 CB TRP A 49 -16.373 -28.746 5.388 1.00 0.00 C ATOM 698 CG TRP A 49 -16.582 -29.997 6.187 1.00 0.00 C ATOM 699 CD1 TRP A 49 -16.067 -31.234 5.923 1.00 0.00 C ATOM 700 CD2 TRP A 49 -17.363 -30.131 7.379 1.00 0.00 C ATOM 701 NE1 TRP A 49 -16.482 -32.129 6.879 1.00 0.00 N ATOM 702 CE2 TRP A 49 -17.277 -31.478 7.784 1.00 0.00 C ATOM 703 CE3 TRP A 49 -18.125 -29.245 8.145 1.00 0.00 C ATOM 704 CZ2 TRP A 49 -17.926 -31.956 8.920 1.00 0.00 C ATOM 705 CZ3 TRP A 49 -18.769 -29.722 9.272 1.00 0.00 C ATOM 706 CH2 TRP A 49 -18.665 -31.067 9.651 1.00 0.00 C ATOM 0 H TRP A 49 -16.181 -26.906 3.748 1.00 0.00 H new ATOM 0 HA TRP A 49 -15.447 -29.653 3.674 1.00 0.00 H new ATOM 0 HB2 TRP A 49 -15.454 -28.261 5.719 1.00 0.00 H new ATOM 0 HB3 TRP A 49 -17.190 -28.053 5.591 1.00 0.00 H new ATOM 0 HD1 TRP A 49 -15.428 -31.473 5.086 1.00 0.00 H new ATOM 0 HE1 TRP A 49 -16.237 -33.119 6.910 1.00 0.00 H new ATOM 0 HE3 TRP A 49 -18.210 -28.206 7.862 1.00 0.00 H new ATOM 0 HZ2 TRP A 49 -17.848 -32.992 9.213 1.00 0.00 H new ATOM 0 HZ3 TRP A 49 -19.362 -29.046 9.870 1.00 0.00 H new ATOM 0 HH2 TRP A 49 -19.178 -31.408 10.538 1.00 0.00 H new ATOM 717 N ASP A 50 -17.502 -30.999 3.245 1.00 0.00 N ATOM 718 CA ASP A 50 -18.651 -31.773 2.791 1.00 0.00 C ATOM 719 C ASP A 50 -19.782 -31.717 3.813 1.00 0.00 C ATOM 720 O ASP A 50 -20.948 -31.557 3.456 1.00 0.00 O ATOM 721 CB ASP A 50 -18.247 -33.226 2.537 1.00 0.00 C ATOM 722 CG ASP A 50 -16.986 -33.339 1.704 1.00 0.00 C ATOM 723 OD1 ASP A 50 -16.823 -32.534 0.763 1.00 0.00 O ATOM 724 OD2 ASP A 50 -16.162 -34.233 1.991 1.00 0.00 O ATOM 0 H ASP A 50 -16.666 -31.554 3.429 1.00 0.00 H new ATOM 0 HA ASP A 50 -19.007 -31.335 1.858 1.00 0.00 H new ATOM 0 HB2 ASP A 50 -18.095 -33.730 3.491 1.00 0.00 H new ATOM 0 HB3 ASP A 50 -19.062 -33.743 2.030 1.00 0.00 H new ATOM 729 N GLY A 51 -19.429 -31.853 5.088 1.00 0.00 N ATOM 730 CA GLY A 51 -20.425 -31.817 6.142 1.00 0.00 C ATOM 731 C GLY A 51 -20.583 -33.155 6.836 1.00 0.00 C ATOM 732 O GLY A 51 -21.031 -33.220 7.982 1.00 0.00 O ATOM 0 H GLY A 51 -18.470 -31.988 5.409 1.00 0.00 H new ATOM 0 HA2 GLY A 51 -20.146 -31.061 6.876 1.00 0.00 H new ATOM 0 HA3 GLY A 51 -21.384 -31.514 5.721 1.00 0.00 H new ATOM 736 N THR A 52 -20.217 -34.228 6.142 1.00 0.00 N ATOM 737 CA THR A 52 -20.322 -35.571 6.697 1.00 0.00 C ATOM 738 C THR A 52 -18.963 -36.084 7.158 1.00 0.00 C ATOM 739 O THR A 52 -18.807 -36.524 8.297 1.00 0.00 O ATOM 740 CB THR A 52 -20.910 -36.558 5.671 1.00 0.00 C ATOM 741 OG1 THR A 52 -20.298 -36.359 4.392 1.00 0.00 O ATOM 742 CG2 THR A 52 -22.416 -36.381 5.551 1.00 0.00 C ATOM 0 H THR A 52 -19.845 -34.192 5.193 1.00 0.00 H new ATOM 0 HA THR A 52 -20.992 -35.507 7.554 1.00 0.00 H new ATOM 0 HB THR A 52 -20.705 -37.571 6.017 1.00 0.00 H new ATOM 0 HG1 THR A 52 -20.676 -36.992 3.746 1.00 0.00 H new ATOM 0 HG21 THR A 52 -22.808 -37.089 4.821 1.00 0.00 H new ATOM 0 HG22 THR A 52 -22.882 -36.563 6.519 1.00 0.00 H new ATOM 0 HG23 THR A 52 -22.638 -35.364 5.227 1.00 0.00 H new ATOM 750 N THR A 53 -17.979 -36.025 6.265 1.00 0.00 N ATOM 751 CA THR A 53 -16.633 -36.484 6.580 1.00 0.00 C ATOM 752 C THR A 53 -16.197 -36.004 7.960 1.00 0.00 C ATOM 753 O THR A 53 -16.126 -34.802 8.216 1.00 0.00 O ATOM 754 CB THR A 53 -15.613 -35.996 5.534 1.00 0.00 C ATOM 755 OG1 THR A 53 -16.032 -36.388 4.222 1.00 0.00 O ATOM 756 CG2 THR A 53 -14.230 -36.561 5.820 1.00 0.00 C ATOM 0 H THR A 53 -18.090 -35.663 5.318 1.00 0.00 H new ATOM 0 HA THR A 53 -16.661 -37.574 6.569 1.00 0.00 H new ATOM 0 HB THR A 53 -15.561 -34.909 5.590 1.00 0.00 H new ATOM 0 HG1 THR A 53 -16.025 -35.607 3.630 1.00 0.00 H new ATOM 0 HG21 THR A 53 -13.528 -36.202 5.068 1.00 0.00 H new ATOM 0 HG22 THR A 53 -13.901 -36.237 6.807 1.00 0.00 H new ATOM 0 HG23 THR A 53 -14.268 -37.650 5.790 1.00 0.00 H new ATOM 764 N ASP A 54 -15.906 -36.951 8.845 1.00 0.00 N ATOM 765 CA ASP A 54 -15.474 -36.624 10.200 1.00 0.00 C ATOM 766 C ASP A 54 -14.012 -36.189 10.214 1.00 0.00 C ATOM 767 O ASP A 54 -13.176 -36.764 9.520 1.00 0.00 O ATOM 768 CB ASP A 54 -15.671 -37.827 11.124 1.00 0.00 C ATOM 769 CG ASP A 54 -15.952 -37.416 12.556 1.00 0.00 C ATOM 770 OD1 ASP A 54 -16.491 -36.308 12.761 1.00 0.00 O ATOM 771 OD2 ASP A 54 -15.634 -38.203 13.472 1.00 0.00 O ATOM 0 H ASP A 54 -15.961 -37.951 8.649 1.00 0.00 H new ATOM 0 HA ASP A 54 -16.084 -35.795 10.560 1.00 0.00 H new ATOM 0 HB2 ASP A 54 -16.497 -38.434 10.754 1.00 0.00 H new ATOM 0 HB3 ASP A 54 -14.779 -38.453 11.097 1.00 0.00 H new ATOM 776 N GLY A 55 -13.712 -35.167 11.011 1.00 0.00 N ATOM 777 CA GLY A 55 -12.351 -34.671 11.100 1.00 0.00 C ATOM 778 C GLY A 55 -11.810 -34.219 9.758 1.00 0.00 C ATOM 779 O GLY A 55 -10.609 -34.311 9.503 1.00 0.00 O ATOM 0 H GLY A 55 -14.387 -34.674 11.596 1.00 0.00 H new ATOM 0 HA2 GLY A 55 -12.316 -33.838 11.802 1.00 0.00 H new ATOM 0 HA3 GLY A 55 -11.708 -35.454 11.503 1.00 0.00 H new ATOM 783 N ALA A 56 -12.697 -33.732 8.897 1.00 0.00 N ATOM 784 CA ALA A 56 -12.301 -33.264 7.575 1.00 0.00 C ATOM 785 C ALA A 56 -11.979 -31.774 7.593 1.00 0.00 C ATOM 786 O ALA A 56 -11.145 -31.300 6.823 1.00 0.00 O ATOM 787 CB ALA A 56 -13.398 -33.557 6.561 1.00 0.00 C ATOM 0 H ALA A 56 -13.695 -33.651 9.091 1.00 0.00 H new ATOM 0 HA ALA A 56 -11.398 -33.800 7.283 1.00 0.00 H new ATOM 0 HB1 ALA A 56 -13.089 -33.202 5.578 1.00 0.00 H new ATOM 0 HB2 ALA A 56 -13.577 -34.631 6.519 1.00 0.00 H new ATOM 0 HB3 ALA A 56 -14.314 -33.048 6.859 1.00 0.00 H new ATOM 793 N ALA A 57 -12.647 -31.040 8.477 1.00 0.00 N ATOM 794 CA ALA A 57 -12.431 -29.603 8.596 1.00 0.00 C ATOM 795 C ALA A 57 -10.972 -29.292 8.911 1.00 0.00 C ATOM 796 O ALA A 57 -10.452 -29.693 9.953 1.00 0.00 O ATOM 797 CB ALA A 57 -13.340 -29.019 9.667 1.00 0.00 C ATOM 0 H ALA A 57 -13.342 -31.417 9.121 1.00 0.00 H new ATOM 0 HA ALA A 57 -12.675 -29.143 7.638 1.00 0.00 H new ATOM 0 HB1 ALA A 57 -13.168 -27.946 9.745 1.00 0.00 H new ATOM 0 HB2 ALA A 57 -14.381 -29.201 9.400 1.00 0.00 H new ATOM 0 HB3 ALA A 57 -13.124 -29.491 10.625 1.00 0.00 H new ATOM 803 N VAL A 58 -10.315 -28.575 8.005 1.00 0.00 N ATOM 804 CA VAL A 58 -8.915 -28.210 8.187 1.00 0.00 C ATOM 805 C VAL A 58 -8.780 -26.761 8.641 1.00 0.00 C ATOM 806 O VAL A 58 -7.964 -26.444 9.506 1.00 0.00 O ATOM 807 CB VAL A 58 -8.110 -28.406 6.888 1.00 0.00 C ATOM 808 CG1 VAL A 58 -8.165 -29.859 6.440 1.00 0.00 C ATOM 809 CG2 VAL A 58 -8.629 -27.483 5.796 1.00 0.00 C ATOM 0 H VAL A 58 -10.730 -28.235 7.137 1.00 0.00 H new ATOM 0 HA VAL A 58 -8.514 -28.869 8.957 1.00 0.00 H new ATOM 0 HB VAL A 58 -7.069 -28.150 7.084 1.00 0.00 H new ATOM 0 HG11 VAL A 58 -7.591 -29.978 5.521 1.00 0.00 H new ATOM 0 HG12 VAL A 58 -7.742 -30.496 7.217 1.00 0.00 H new ATOM 0 HG13 VAL A 58 -9.201 -30.145 6.260 1.00 0.00 H new ATOM 0 HG21 VAL A 58 -8.049 -27.635 4.886 1.00 0.00 H new ATOM 0 HG22 VAL A 58 -9.678 -27.706 5.600 1.00 0.00 H new ATOM 0 HG23 VAL A 58 -8.532 -26.447 6.119 1.00 0.00 H new ATOM 819 N GLY A 59 -9.587 -25.884 8.052 1.00 0.00 N ATOM 820 CA GLY A 59 -9.542 -24.478 8.410 1.00 0.00 C ATOM 821 C GLY A 59 -10.855 -23.770 8.143 1.00 0.00 C ATOM 822 O GLY A 59 -11.809 -24.378 7.656 1.00 0.00 O ATOM 0 H GLY A 59 -10.271 -26.122 7.334 1.00 0.00 H new ATOM 0 HA2 GLY A 59 -9.290 -24.383 9.466 1.00 0.00 H new ATOM 0 HA3 GLY A 59 -8.747 -23.988 7.847 1.00 0.00 H new ATOM 826 N ILE A 60 -10.907 -22.481 8.464 1.00 0.00 N ATOM 827 CA ILE A 60 -12.114 -21.691 8.257 1.00 0.00 C ATOM 828 C ILE A 60 -11.878 -20.587 7.230 1.00 0.00 C ATOM 829 O ILE A 60 -11.001 -19.741 7.403 1.00 0.00 O ATOM 830 CB ILE A 60 -12.604 -21.057 9.572 1.00 0.00 C ATOM 831 CG1 ILE A 60 -12.776 -22.131 10.648 1.00 0.00 C ATOM 832 CG2 ILE A 60 -13.911 -20.312 9.345 1.00 0.00 C ATOM 833 CD1 ILE A 60 -12.963 -21.567 12.039 1.00 0.00 C ATOM 0 H ILE A 60 -10.127 -21.962 8.868 1.00 0.00 H new ATOM 0 HA ILE A 60 -12.879 -22.373 7.885 1.00 0.00 H new ATOM 0 HB ILE A 60 -11.856 -20.342 9.915 1.00 0.00 H new ATOM 0 HG12 ILE A 60 -13.637 -22.751 10.397 1.00 0.00 H new ATOM 0 HG13 ILE A 60 -11.902 -22.782 10.643 1.00 0.00 H new ATOM 0 HG21 ILE A 60 -14.245 -19.869 10.283 1.00 0.00 H new ATOM 0 HG22 ILE A 60 -13.758 -19.525 8.607 1.00 0.00 H new ATOM 0 HG23 ILE A 60 -14.668 -21.007 8.982 1.00 0.00 H new ATOM 0 HD11 ILE A 60 -13.079 -22.385 12.751 1.00 0.00 H new ATOM 0 HD12 ILE A 60 -12.092 -20.971 12.310 1.00 0.00 H new ATOM 0 HD13 ILE A 60 -13.854 -20.939 12.060 1.00 0.00 H new ATOM 845 N LEU A 61 -12.669 -20.602 6.163 1.00 0.00 N ATOM 846 CA LEU A 61 -12.549 -19.601 5.108 1.00 0.00 C ATOM 847 C LEU A 61 -12.819 -18.202 5.652 1.00 0.00 C ATOM 848 O LEU A 61 -13.886 -17.936 6.205 1.00 0.00 O ATOM 849 CB LEU A 61 -13.519 -19.915 3.968 1.00 0.00 C ATOM 850 CG LEU A 61 -13.072 -19.486 2.570 1.00 0.00 C ATOM 851 CD1 LEU A 61 -14.268 -19.384 1.635 1.00 0.00 C ATOM 852 CD2 LEU A 61 -12.326 -18.161 2.631 1.00 0.00 C ATOM 0 H LEU A 61 -13.400 -21.296 6.005 1.00 0.00 H new ATOM 0 HA LEU A 61 -11.528 -19.631 4.726 1.00 0.00 H new ATOM 0 HB2 LEU A 61 -13.699 -20.990 3.956 1.00 0.00 H new ATOM 0 HB3 LEU A 61 -14.473 -19.435 4.186 1.00 0.00 H new ATOM 0 HG LEU A 61 -12.394 -20.244 2.178 1.00 0.00 H new ATOM 0 HD11 LEU A 61 -13.931 -19.078 0.645 1.00 0.00 H new ATOM 0 HD12 LEU A 61 -14.760 -20.354 1.567 1.00 0.00 H new ATOM 0 HD13 LEU A 61 -14.971 -18.647 2.023 1.00 0.00 H new ATOM 0 HD21 LEU A 61 -12.016 -17.872 1.627 1.00 0.00 H new ATOM 0 HD22 LEU A 61 -12.981 -17.393 3.044 1.00 0.00 H new ATOM 0 HD23 LEU A 61 -11.447 -18.268 3.266 1.00 0.00 H new ATOM 864 N ALA A 62 -11.847 -17.311 5.488 1.00 0.00 N ATOM 865 CA ALA A 62 -11.982 -15.938 5.958 1.00 0.00 C ATOM 866 C ALA A 62 -12.872 -15.123 5.025 1.00 0.00 C ATOM 867 O ALA A 62 -13.766 -14.405 5.473 1.00 0.00 O ATOM 868 CB ALA A 62 -10.613 -15.287 6.087 1.00 0.00 C ATOM 0 H ALA A 62 -10.957 -17.516 5.033 1.00 0.00 H new ATOM 0 HA ALA A 62 -12.455 -15.961 6.940 1.00 0.00 H new ATOM 0 HB1 ALA A 62 -10.729 -14.262 6.439 1.00 0.00 H new ATOM 0 HB2 ALA A 62 -10.009 -15.849 6.799 1.00 0.00 H new ATOM 0 HB3 ALA A 62 -10.119 -15.283 5.115 1.00 0.00 H new ATOM 874 N VAL A 63 -12.620 -15.239 3.725 1.00 0.00 N ATOM 875 CA VAL A 63 -13.399 -14.513 2.728 1.00 0.00 C ATOM 876 C VAL A 63 -14.057 -15.470 1.741 1.00 0.00 C ATOM 877 O VAL A 63 -13.388 -16.301 1.127 1.00 0.00 O ATOM 878 CB VAL A 63 -12.522 -13.513 1.950 1.00 0.00 C ATOM 879 CG1 VAL A 63 -13.356 -12.752 0.931 1.00 0.00 C ATOM 880 CG2 VAL A 63 -11.830 -12.555 2.908 1.00 0.00 C ATOM 0 H VAL A 63 -11.883 -15.828 3.338 1.00 0.00 H new ATOM 0 HA VAL A 63 -14.171 -13.965 3.267 1.00 0.00 H new ATOM 0 HB VAL A 63 -11.755 -14.070 1.412 1.00 0.00 H new ATOM 0 HG11 VAL A 63 -12.720 -12.051 0.391 1.00 0.00 H new ATOM 0 HG12 VAL A 63 -13.800 -13.455 0.226 1.00 0.00 H new ATOM 0 HG13 VAL A 63 -14.146 -12.204 1.444 1.00 0.00 H new ATOM 0 HG21 VAL A 63 -11.215 -11.856 2.342 1.00 0.00 H new ATOM 0 HG22 VAL A 63 -12.579 -12.003 3.475 1.00 0.00 H new ATOM 0 HG23 VAL A 63 -11.199 -13.120 3.595 1.00 0.00 H new ATOM 890 N ALA A 64 -15.372 -15.347 1.593 1.00 0.00 N ATOM 891 CA ALA A 64 -16.121 -16.200 0.678 1.00 0.00 C ATOM 892 C ALA A 64 -15.385 -16.361 -0.648 1.00 0.00 C ATOM 893 O ALA A 64 -14.647 -15.473 -1.071 1.00 0.00 O ATOM 894 CB ALA A 64 -17.513 -15.631 0.446 1.00 0.00 C ATOM 0 H ALA A 64 -15.941 -14.665 2.095 1.00 0.00 H new ATOM 0 HA ALA A 64 -16.215 -17.186 1.134 1.00 0.00 H new ATOM 0 HB1 ALA A 64 -18.061 -16.278 -0.239 1.00 0.00 H new ATOM 0 HB2 ALA A 64 -18.046 -15.574 1.395 1.00 0.00 H new ATOM 0 HB3 ALA A 64 -17.431 -14.633 0.015 1.00 0.00 H new ATOM 900 N ALA A 65 -15.592 -17.501 -1.299 1.00 0.00 N ATOM 901 CA ALA A 65 -14.950 -17.778 -2.578 1.00 0.00 C ATOM 902 C ALA A 65 -15.813 -18.694 -3.439 1.00 0.00 C ATOM 903 O ALA A 65 -16.899 -19.105 -3.030 1.00 0.00 O ATOM 904 CB ALA A 65 -13.578 -18.398 -2.356 1.00 0.00 C ATOM 0 H ALA A 65 -16.199 -18.248 -0.962 1.00 0.00 H new ATOM 0 HA ALA A 65 -14.829 -16.833 -3.108 1.00 0.00 H new ATOM 0 HB1 ALA A 65 -13.110 -18.600 -3.319 1.00 0.00 H new ATOM 0 HB2 ALA A 65 -12.955 -17.708 -1.787 1.00 0.00 H new ATOM 0 HB3 ALA A 65 -13.686 -19.331 -1.802 1.00 0.00 H new ATOM 910 N ASP A 66 -15.325 -19.008 -4.634 1.00 0.00 N ATOM 911 CA ASP A 66 -16.052 -19.876 -5.553 1.00 0.00 C ATOM 912 C ASP A 66 -15.090 -20.756 -6.345 1.00 0.00 C ATOM 913 O ASP A 66 -13.872 -20.613 -6.237 1.00 0.00 O ATOM 914 CB ASP A 66 -16.904 -19.041 -6.510 1.00 0.00 C ATOM 915 CG ASP A 66 -16.303 -17.675 -6.778 1.00 0.00 C ATOM 916 OD1 ASP A 66 -15.060 -17.556 -6.740 1.00 0.00 O ATOM 917 OD2 ASP A 66 -17.075 -16.725 -7.027 1.00 0.00 O ATOM 0 H ASP A 66 -14.429 -18.674 -4.989 1.00 0.00 H new ATOM 0 HA ASP A 66 -16.705 -20.521 -4.965 1.00 0.00 H new ATOM 0 HB2 ASP A 66 -17.017 -19.576 -7.453 1.00 0.00 H new ATOM 0 HB3 ASP A 66 -17.903 -18.919 -6.091 1.00 0.00 H new ATOM 922 N GLN A 67 -15.646 -21.666 -7.138 1.00 0.00 N ATOM 923 CA GLN A 67 -14.837 -22.571 -7.946 1.00 0.00 C ATOM 924 C GLN A 67 -13.932 -21.791 -8.895 1.00 0.00 C ATOM 925 O GLN A 67 -12.913 -22.304 -9.360 1.00 0.00 O ATOM 926 CB GLN A 67 -15.735 -23.518 -8.743 1.00 0.00 C ATOM 927 CG GLN A 67 -16.794 -22.804 -9.567 1.00 0.00 C ATOM 928 CD GLN A 67 -16.237 -22.208 -10.844 1.00 0.00 C ATOM 929 OE1 GLN A 67 -16.593 -20.958 -11.119 1.00 0.00 O flip ATOM 930 NE2 GLN A 67 -15.495 -22.863 -11.576 1.00 0.00 N flip ATOM 0 H GLN A 67 -16.653 -21.796 -7.238 1.00 0.00 H new ATOM 0 HA GLN A 67 -14.210 -23.156 -7.273 1.00 0.00 H new ATOM 0 HB2 GLN A 67 -15.115 -24.120 -9.407 1.00 0.00 H new ATOM 0 HB3 GLN A 67 -16.225 -24.206 -8.054 1.00 0.00 H new ATOM 0 HG2 GLN A 67 -17.590 -23.506 -9.815 1.00 0.00 H new ATOM 0 HG3 GLN A 67 -17.243 -22.012 -8.967 1.00 0.00 H new ATOM 0 HE21 GLN A 67 -15.247 -23.820 -11.326 1.00 0.00 H new ATOM 0 HE22 GLN A 67 -15.128 -22.448 -12.433 1.00 0.00 H new ATOM 939 N THR A 68 -14.310 -20.549 -9.178 1.00 0.00 N ATOM 940 CA THR A 68 -13.533 -19.699 -10.072 1.00 0.00 C ATOM 941 C THR A 68 -12.392 -19.016 -9.328 1.00 0.00 C ATOM 942 O THR A 68 -11.617 -18.263 -9.917 1.00 0.00 O ATOM 943 CB THR A 68 -14.417 -18.623 -10.732 1.00 0.00 C ATOM 944 OG1 THR A 68 -13.685 -17.955 -11.766 1.00 0.00 O ATOM 945 CG2 THR A 68 -14.893 -17.608 -9.704 1.00 0.00 C ATOM 0 H THR A 68 -15.149 -20.109 -8.801 1.00 0.00 H new ATOM 0 HA THR A 68 -13.122 -20.347 -10.846 1.00 0.00 H new ATOM 0 HB THR A 68 -15.289 -19.115 -11.164 1.00 0.00 H new ATOM 0 HG1 THR A 68 -12.750 -17.853 -11.491 1.00 0.00 H new ATOM 0 HG21 THR A 68 -15.515 -16.859 -10.194 1.00 0.00 H new ATOM 0 HG22 THR A 68 -15.474 -18.115 -8.934 1.00 0.00 H new ATOM 0 HG23 THR A 68 -14.031 -17.122 -9.247 1.00 0.00 H new ATOM 953 N SER A 69 -12.293 -19.285 -8.030 1.00 0.00 N ATOM 954 CA SER A 69 -11.246 -18.694 -7.204 1.00 0.00 C ATOM 955 C SER A 69 -9.923 -19.427 -7.397 1.00 0.00 C ATOM 956 O SER A 69 -9.811 -20.619 -7.107 1.00 0.00 O ATOM 957 CB SER A 69 -11.651 -18.727 -5.729 1.00 0.00 C ATOM 958 OG SER A 69 -12.855 -18.012 -5.514 1.00 0.00 O ATOM 0 H SER A 69 -12.925 -19.908 -7.528 1.00 0.00 H new ATOM 0 HA SER A 69 -11.115 -17.657 -7.514 1.00 0.00 H new ATOM 0 HB2 SER A 69 -11.776 -19.761 -5.406 1.00 0.00 H new ATOM 0 HB3 SER A 69 -10.855 -18.297 -5.121 1.00 0.00 H new ATOM 0 HG SER A 69 -13.345 -17.934 -6.359 1.00 0.00 H new ATOM 964 N THR A 70 -8.920 -18.706 -7.890 1.00 0.00 N ATOM 965 CA THR A 70 -7.604 -19.287 -8.123 1.00 0.00 C ATOM 966 C THR A 70 -6.862 -19.513 -6.811 1.00 0.00 C ATOM 967 O THR A 70 -5.839 -20.198 -6.773 1.00 0.00 O ATOM 968 CB THR A 70 -6.748 -18.389 -9.036 1.00 0.00 C ATOM 969 OG1 THR A 70 -7.545 -17.882 -10.112 1.00 0.00 O ATOM 970 CG2 THR A 70 -5.563 -19.161 -9.598 1.00 0.00 C ATOM 0 H THR A 70 -8.995 -17.719 -8.135 1.00 0.00 H new ATOM 0 HA THR A 70 -7.765 -20.246 -8.616 1.00 0.00 H new ATOM 0 HB THR A 70 -6.371 -17.558 -8.440 1.00 0.00 H new ATOM 0 HG1 THR A 70 -6.994 -17.311 -10.687 1.00 0.00 H new ATOM 0 HG21 THR A 70 -4.973 -18.506 -10.240 1.00 0.00 H new ATOM 0 HG22 THR A 70 -4.942 -19.521 -8.778 1.00 0.00 H new ATOM 0 HG23 THR A 70 -5.924 -20.009 -10.179 1.00 0.00 H new ATOM 978 N THR A 71 -7.383 -18.933 -5.734 1.00 0.00 N ATOM 979 CA THR A 71 -6.770 -19.070 -4.419 1.00 0.00 C ATOM 980 C THR A 71 -7.778 -18.790 -3.311 1.00 0.00 C ATOM 981 O THR A 71 -8.630 -17.910 -3.440 1.00 0.00 O ATOM 982 CB THR A 71 -5.568 -18.120 -4.258 1.00 0.00 C ATOM 983 OG1 THR A 71 -4.562 -18.433 -5.227 1.00 0.00 O ATOM 984 CG2 THR A 71 -4.981 -18.224 -2.858 1.00 0.00 C ATOM 0 H THR A 71 -8.229 -18.363 -5.747 1.00 0.00 H new ATOM 0 HA THR A 71 -6.422 -20.100 -4.338 1.00 0.00 H new ATOM 0 HB THR A 71 -5.916 -17.099 -4.415 1.00 0.00 H new ATOM 0 HG1 THR A 71 -4.776 -19.287 -5.657 1.00 0.00 H new ATOM 0 HG21 THR A 71 -4.134 -17.544 -2.767 1.00 0.00 H new ATOM 0 HG22 THR A 71 -5.741 -17.956 -2.124 1.00 0.00 H new ATOM 0 HG23 THR A 71 -4.647 -19.246 -2.678 1.00 0.00 H new ATOM 992 N LEU A 72 -7.675 -19.543 -2.221 1.00 0.00 N ATOM 993 CA LEU A 72 -8.578 -19.375 -1.087 1.00 0.00 C ATOM 994 C LEU A 72 -7.808 -18.980 0.169 1.00 0.00 C ATOM 995 O LEU A 72 -6.837 -19.635 0.547 1.00 0.00 O ATOM 996 CB LEU A 72 -9.358 -20.666 -0.836 1.00 0.00 C ATOM 997 CG LEU A 72 -10.101 -21.247 -2.039 1.00 0.00 C ATOM 998 CD1 LEU A 72 -10.687 -22.609 -1.699 1.00 0.00 C ATOM 999 CD2 LEU A 72 -11.195 -20.294 -2.501 1.00 0.00 C ATOM 0 H LEU A 72 -6.976 -20.275 -2.098 1.00 0.00 H new ATOM 0 HA LEU A 72 -9.278 -18.575 -1.327 1.00 0.00 H new ATOM 0 HB2 LEU A 72 -8.664 -21.420 -0.465 1.00 0.00 H new ATOM 0 HB3 LEU A 72 -10.082 -20.481 -0.042 1.00 0.00 H new ATOM 0 HG LEU A 72 -9.389 -21.375 -2.854 1.00 0.00 H new ATOM 0 HD11 LEU A 72 -11.212 -23.006 -2.568 1.00 0.00 H new ATOM 0 HD12 LEU A 72 -9.884 -23.290 -1.417 1.00 0.00 H new ATOM 0 HD13 LEU A 72 -11.385 -22.508 -0.868 1.00 0.00 H new ATOM 0 HD21 LEU A 72 -11.714 -20.724 -3.358 1.00 0.00 H new ATOM 0 HD22 LEU A 72 -11.905 -20.135 -1.690 1.00 0.00 H new ATOM 0 HD23 LEU A 72 -10.750 -19.341 -2.786 1.00 0.00 H new ATOM 1011 N THR A 73 -8.249 -17.903 0.813 1.00 0.00 N ATOM 1012 CA THR A 73 -7.602 -17.421 2.027 1.00 0.00 C ATOM 1013 C THR A 73 -8.385 -17.834 3.268 1.00 0.00 C ATOM 1014 O THR A 73 -9.371 -17.193 3.634 1.00 0.00 O ATOM 1015 CB THR A 73 -7.454 -15.888 2.013 1.00 0.00 C ATOM 1016 OG1 THR A 73 -6.715 -15.477 0.857 1.00 0.00 O ATOM 1017 CG2 THR A 73 -6.749 -15.401 3.271 1.00 0.00 C ATOM 0 H THR A 73 -9.051 -17.349 0.514 1.00 0.00 H new ATOM 0 HA THR A 73 -6.611 -17.874 2.059 1.00 0.00 H new ATOM 0 HB THR A 73 -8.451 -15.449 1.981 1.00 0.00 H new ATOM 0 HG1 THR A 73 -6.627 -14.501 0.855 1.00 0.00 H new ATOM 0 HG21 THR A 73 -6.656 -14.315 3.239 1.00 0.00 H new ATOM 0 HG22 THR A 73 -7.329 -15.690 4.148 1.00 0.00 H new ATOM 0 HG23 THR A 73 -5.757 -15.849 3.329 1.00 0.00 H new ATOM 1025 N PHE A 74 -7.940 -18.907 3.913 1.00 0.00 N ATOM 1026 CA PHE A 74 -8.600 -19.405 5.114 1.00 0.00 C ATOM 1027 C PHE A 74 -7.675 -19.307 6.323 1.00 0.00 C ATOM 1028 O PHE A 74 -6.456 -19.210 6.180 1.00 0.00 O ATOM 1029 CB PHE A 74 -9.043 -20.856 4.913 1.00 0.00 C ATOM 1030 CG PHE A 74 -7.906 -21.798 4.637 1.00 0.00 C ATOM 1031 CD1 PHE A 74 -7.298 -21.824 3.392 1.00 0.00 C ATOM 1032 CD2 PHE A 74 -7.446 -22.657 5.621 1.00 0.00 C ATOM 1033 CE1 PHE A 74 -6.251 -22.689 3.134 1.00 0.00 C ATOM 1034 CE2 PHE A 74 -6.400 -23.524 5.369 1.00 0.00 C ATOM 1035 CZ PHE A 74 -5.802 -23.541 4.124 1.00 0.00 C ATOM 0 H PHE A 74 -7.125 -19.448 3.624 1.00 0.00 H new ATOM 0 HA PHE A 74 -9.478 -18.786 5.299 1.00 0.00 H new ATOM 0 HB2 PHE A 74 -9.574 -21.192 5.804 1.00 0.00 H new ATOM 0 HB3 PHE A 74 -9.750 -20.900 4.084 1.00 0.00 H new ATOM 0 HD1 PHE A 74 -7.646 -21.161 2.614 1.00 0.00 H new ATOM 0 HD2 PHE A 74 -7.910 -22.649 6.596 1.00 0.00 H new ATOM 0 HE1 PHE A 74 -5.785 -22.699 2.160 1.00 0.00 H new ATOM 0 HE2 PHE A 74 -6.050 -24.188 6.145 1.00 0.00 H new ATOM 0 HZ PHE A 74 -4.985 -24.219 3.925 1.00 0.00 H new ATOM 1045 N TYR A 75 -8.263 -19.333 7.514 1.00 0.00 N ATOM 1046 CA TYR A 75 -7.493 -19.244 8.749 1.00 0.00 C ATOM 1047 C TYR A 75 -6.688 -20.520 8.982 1.00 0.00 C ATOM 1048 O TYR A 75 -6.814 -21.493 8.239 1.00 0.00 O ATOM 1049 CB TYR A 75 -8.422 -18.989 9.937 1.00 0.00 C ATOM 1050 CG TYR A 75 -8.839 -17.543 10.080 1.00 0.00 C ATOM 1051 CD1 TYR A 75 -8.043 -16.635 10.767 1.00 0.00 C ATOM 1052 CD2 TYR A 75 -10.030 -17.085 9.529 1.00 0.00 C ATOM 1053 CE1 TYR A 75 -8.420 -15.313 10.900 1.00 0.00 C ATOM 1054 CE2 TYR A 75 -10.414 -15.765 9.657 1.00 0.00 C ATOM 1055 CZ TYR A 75 -9.606 -14.882 10.343 1.00 0.00 C ATOM 1056 OH TYR A 75 -9.987 -13.566 10.474 1.00 0.00 O ATOM 0 H TYR A 75 -9.271 -19.415 7.650 1.00 0.00 H new ATOM 0 HA TYR A 75 -6.798 -18.410 8.655 1.00 0.00 H new ATOM 0 HB2 TYR A 75 -9.314 -19.607 9.829 1.00 0.00 H new ATOM 0 HB3 TYR A 75 -7.923 -19.307 10.852 1.00 0.00 H new ATOM 0 HD1 TYR A 75 -7.114 -16.969 11.204 1.00 0.00 H new ATOM 0 HD2 TYR A 75 -10.666 -17.773 8.992 1.00 0.00 H new ATOM 0 HE1 TYR A 75 -7.789 -14.620 11.437 1.00 0.00 H new ATOM 0 HE2 TYR A 75 -11.342 -15.425 9.222 1.00 0.00 H new ATOM 0 HH TYR A 75 -10.846 -13.428 10.023 1.00 0.00 H new ATOM 1066 N LYS A 76 -5.861 -20.508 10.022 1.00 0.00 N ATOM 1067 CA LYS A 76 -5.037 -21.662 10.358 1.00 0.00 C ATOM 1068 C LYS A 76 -5.299 -22.120 11.789 1.00 0.00 C ATOM 1069 O LYS A 76 -5.271 -23.315 12.083 1.00 0.00 O ATOM 1070 CB LYS A 76 -3.554 -21.324 10.183 1.00 0.00 C ATOM 1071 CG LYS A 76 -3.076 -20.201 11.086 1.00 0.00 C ATOM 1072 CD LYS A 76 -2.561 -20.734 12.413 1.00 0.00 C ATOM 1073 CE LYS A 76 -1.123 -21.215 12.301 1.00 0.00 C ATOM 1074 NZ LYS A 76 -0.152 -20.091 12.406 1.00 0.00 N ATOM 0 H LYS A 76 -5.744 -19.711 10.647 1.00 0.00 H new ATOM 0 HA LYS A 76 -5.301 -22.475 9.681 1.00 0.00 H new ATOM 0 HB2 LYS A 76 -2.961 -22.216 10.382 1.00 0.00 H new ATOM 0 HB3 LYS A 76 -3.373 -21.046 9.145 1.00 0.00 H new ATOM 0 HG2 LYS A 76 -2.285 -19.642 10.586 1.00 0.00 H new ATOM 0 HG3 LYS A 76 -3.894 -19.504 11.266 1.00 0.00 H new ATOM 0 HD2 LYS A 76 -2.626 -19.952 13.170 1.00 0.00 H new ATOM 0 HD3 LYS A 76 -3.195 -21.555 12.747 1.00 0.00 H new ATOM 0 HE2 LYS A 76 -0.922 -21.943 13.087 1.00 0.00 H new ATOM 0 HE3 LYS A 76 -0.984 -21.727 11.349 1.00 0.00 H new ATOM 0 HZ1 LYS A 76 0.817 -20.460 12.325 1.00 0.00 H new ATOM 0 HZ2 LYS A 76 -0.327 -19.408 11.641 1.00 0.00 H new ATOM 0 HZ3 LYS A 76 -0.266 -19.618 13.325 1.00 0.00 H new ATOM 1088 N SER A 77 -5.553 -21.163 12.675 1.00 0.00 N ATOM 1089 CA SER A 77 -5.818 -21.468 14.076 1.00 0.00 C ATOM 1090 C SER A 77 -6.364 -20.244 14.805 1.00 0.00 C ATOM 1091 O SER A 77 -6.335 -19.132 14.281 1.00 0.00 O ATOM 1092 CB SER A 77 -4.542 -21.959 14.763 1.00 0.00 C ATOM 1093 OG SER A 77 -3.613 -20.902 14.927 1.00 0.00 O ATOM 0 H SER A 77 -5.581 -20.169 12.447 1.00 0.00 H new ATOM 0 HA SER A 77 -6.569 -22.257 14.115 1.00 0.00 H new ATOM 0 HB2 SER A 77 -4.789 -22.384 15.736 1.00 0.00 H new ATOM 0 HB3 SER A 77 -4.091 -22.756 14.172 1.00 0.00 H new ATOM 0 HG SER A 77 -2.807 -21.241 15.370 1.00 0.00 H new ATOM 1099 N GLY A 78 -6.861 -20.459 16.020 1.00 0.00 N ATOM 1100 CA GLY A 78 -7.407 -19.366 16.802 1.00 0.00 C ATOM 1101 C GLY A 78 -8.755 -19.702 17.408 1.00 0.00 C ATOM 1102 O GLY A 78 -9.256 -20.816 17.248 1.00 0.00 O ATOM 0 H GLY A 78 -6.895 -21.371 16.476 1.00 0.00 H new ATOM 0 HA2 GLY A 78 -6.708 -19.109 17.598 1.00 0.00 H new ATOM 0 HA3 GLY A 78 -7.507 -18.485 16.168 1.00 0.00 H new ATOM 1106 N THR A 79 -9.345 -18.738 18.108 1.00 0.00 N ATOM 1107 CA THR A 79 -10.641 -18.938 18.742 1.00 0.00 C ATOM 1108 C THR A 79 -11.774 -18.459 17.842 1.00 0.00 C ATOM 1109 O THR A 79 -11.896 -17.266 17.562 1.00 0.00 O ATOM 1110 CB THR A 79 -10.727 -18.201 20.092 1.00 0.00 C ATOM 1111 OG1 THR A 79 -9.559 -18.474 20.874 1.00 0.00 O ATOM 1112 CG2 THR A 79 -11.969 -18.622 20.861 1.00 0.00 C ATOM 0 H THR A 79 -8.945 -17.811 18.250 1.00 0.00 H new ATOM 0 HA THR A 79 -10.745 -20.009 18.914 1.00 0.00 H new ATOM 0 HB THR A 79 -10.789 -17.131 19.893 1.00 0.00 H new ATOM 0 HG1 THR A 79 -9.620 -18.001 21.730 1.00 0.00 H new ATOM 0 HG21 THR A 79 -12.007 -18.088 21.811 1.00 0.00 H new ATOM 0 HG22 THR A 79 -12.857 -18.385 20.275 1.00 0.00 H new ATOM 0 HG23 THR A 79 -11.934 -19.695 21.049 1.00 0.00 H new ATOM 1120 N PHE A 80 -12.602 -19.396 17.390 1.00 0.00 N ATOM 1121 CA PHE A 80 -13.725 -19.068 16.520 1.00 0.00 C ATOM 1122 C PHE A 80 -15.045 -19.511 17.146 1.00 0.00 C ATOM 1123 O PHE A 80 -15.160 -20.627 17.652 1.00 0.00 O ATOM 1124 CB PHE A 80 -13.549 -19.731 15.152 1.00 0.00 C ATOM 1125 CG PHE A 80 -12.357 -19.226 14.391 1.00 0.00 C ATOM 1126 CD1 PHE A 80 -12.455 -18.097 13.594 1.00 0.00 C ATOM 1127 CD2 PHE A 80 -11.138 -19.881 14.472 1.00 0.00 C ATOM 1128 CE1 PHE A 80 -11.360 -17.631 12.891 1.00 0.00 C ATOM 1129 CE2 PHE A 80 -10.039 -19.419 13.772 1.00 0.00 C ATOM 1130 CZ PHE A 80 -10.150 -18.292 12.982 1.00 0.00 C ATOM 0 H PHE A 80 -12.516 -20.388 17.612 1.00 0.00 H new ATOM 0 HA PHE A 80 -13.749 -17.986 16.391 1.00 0.00 H new ATOM 0 HB2 PHE A 80 -13.453 -20.808 15.289 1.00 0.00 H new ATOM 0 HB3 PHE A 80 -14.447 -19.564 14.558 1.00 0.00 H new ATOM 0 HD1 PHE A 80 -13.398 -17.575 13.521 1.00 0.00 H new ATOM 0 HD2 PHE A 80 -11.046 -20.762 15.089 1.00 0.00 H new ATOM 0 HE1 PHE A 80 -11.450 -16.751 12.271 1.00 0.00 H new ATOM 0 HE2 PHE A 80 -9.095 -19.939 13.843 1.00 0.00 H new ATOM 0 HZ PHE A 80 -9.292 -17.928 12.436 1.00 0.00 H new ATOM 1140 N ARG A 81 -16.037 -18.628 17.107 1.00 0.00 N ATOM 1141 CA ARG A 81 -17.347 -18.925 17.672 1.00 0.00 C ATOM 1142 C ARG A 81 -18.151 -19.823 16.736 1.00 0.00 C ATOM 1143 O ARG A 81 -18.096 -19.672 15.515 1.00 0.00 O ATOM 1144 CB ARG A 81 -18.117 -17.631 17.940 1.00 0.00 C ATOM 1145 CG ARG A 81 -17.849 -17.036 19.312 1.00 0.00 C ATOM 1146 CD ARG A 81 -18.523 -17.842 20.411 1.00 0.00 C ATOM 1147 NE ARG A 81 -19.875 -17.365 20.689 1.00 0.00 N ATOM 1148 CZ ARG A 81 -20.138 -16.261 21.379 1.00 0.00 C ATOM 1149 NH1 ARG A 81 -19.146 -15.524 21.859 1.00 0.00 N ATOM 1150 NH2 ARG A 81 -21.395 -15.892 21.590 1.00 0.00 N ATOM 0 H ARG A 81 -15.958 -17.701 16.690 1.00 0.00 H new ATOM 0 HA ARG A 81 -17.197 -19.452 18.614 1.00 0.00 H new ATOM 0 HB2 ARG A 81 -17.854 -16.897 17.178 1.00 0.00 H new ATOM 0 HB3 ARG A 81 -19.185 -17.826 17.840 1.00 0.00 H new ATOM 0 HG2 ARG A 81 -16.774 -17.002 19.491 1.00 0.00 H new ATOM 0 HG3 ARG A 81 -18.209 -16.008 19.340 1.00 0.00 H new ATOM 0 HD2 ARG A 81 -18.562 -18.891 20.119 1.00 0.00 H new ATOM 0 HD3 ARG A 81 -17.925 -17.786 21.320 1.00 0.00 H new ATOM 0 HE ARG A 81 -20.661 -17.910 20.334 1.00 0.00 H new ATOM 0 HH11 ARG A 81 -18.179 -15.804 21.699 1.00 0.00 H new ATOM 0 HH12 ARG A 81 -19.350 -14.677 22.389 1.00 0.00 H new ATOM 0 HH21 ARG A 81 -22.161 -16.456 21.222 1.00 0.00 H new ATOM 0 HH22 ARG A 81 -21.595 -15.044 22.120 1.00 0.00 H new ATOM 1164 N TYR A 82 -18.896 -20.758 17.316 1.00 0.00 N ATOM 1165 CA TYR A 82 -19.709 -21.682 16.534 1.00 0.00 C ATOM 1166 C TYR A 82 -20.978 -21.001 16.032 1.00 0.00 C ATOM 1167 O TYR A 82 -21.379 -21.182 14.883 1.00 0.00 O ATOM 1168 CB TYR A 82 -20.073 -22.909 17.372 1.00 0.00 C ATOM 1169 CG TYR A 82 -20.945 -23.904 16.642 1.00 0.00 C ATOM 1170 CD1 TYR A 82 -22.250 -23.586 16.288 1.00 0.00 C ATOM 1171 CD2 TYR A 82 -20.463 -25.163 16.304 1.00 0.00 C ATOM 1172 CE1 TYR A 82 -23.050 -24.493 15.621 1.00 0.00 C ATOM 1173 CE2 TYR A 82 -21.256 -26.076 15.636 1.00 0.00 C ATOM 1174 CZ TYR A 82 -22.549 -25.737 15.297 1.00 0.00 C ATOM 1175 OH TYR A 82 -23.343 -26.642 14.631 1.00 0.00 O ATOM 0 H TYR A 82 -18.954 -20.896 18.325 1.00 0.00 H new ATOM 0 HA TYR A 82 -19.123 -22.000 15.671 1.00 0.00 H new ATOM 0 HB2 TYR A 82 -19.157 -23.406 17.690 1.00 0.00 H new ATOM 0 HB3 TYR A 82 -20.588 -22.582 18.275 1.00 0.00 H new ATOM 0 HD1 TYR A 82 -22.646 -22.613 16.539 1.00 0.00 H new ATOM 0 HD2 TYR A 82 -19.451 -25.432 16.568 1.00 0.00 H new ATOM 0 HE1 TYR A 82 -24.063 -24.230 15.354 1.00 0.00 H new ATOM 0 HE2 TYR A 82 -20.865 -27.050 15.381 1.00 0.00 H new ATOM 0 HH TYR A 82 -23.277 -26.487 13.666 1.00 0.00 H new ATOM 1185 N GLU A 83 -21.605 -20.216 16.903 1.00 0.00 N ATOM 1186 CA GLU A 83 -22.829 -19.507 16.548 1.00 0.00 C ATOM 1187 C GLU A 83 -22.645 -18.718 15.254 1.00 0.00 C ATOM 1188 O GLU A 83 -23.581 -18.567 14.469 1.00 0.00 O ATOM 1189 CB GLU A 83 -23.244 -18.564 17.679 1.00 0.00 C ATOM 1190 CG GLU A 83 -22.314 -17.375 17.853 1.00 0.00 C ATOM 1191 CD GLU A 83 -22.921 -16.279 18.707 1.00 0.00 C ATOM 1192 OE1 GLU A 83 -24.160 -16.266 18.862 1.00 0.00 O ATOM 1193 OE2 GLU A 83 -22.158 -15.435 19.221 1.00 0.00 O ATOM 0 H GLU A 83 -21.286 -20.055 17.858 1.00 0.00 H new ATOM 0 HA GLU A 83 -23.615 -20.246 16.394 1.00 0.00 H new ATOM 0 HB2 GLU A 83 -24.253 -18.200 17.485 1.00 0.00 H new ATOM 0 HB3 GLU A 83 -23.281 -19.125 18.613 1.00 0.00 H new ATOM 0 HG2 GLU A 83 -21.382 -17.711 18.308 1.00 0.00 H new ATOM 0 HG3 GLU A 83 -22.062 -16.969 16.873 1.00 0.00 H new ATOM 1200 N ASP A 84 -21.433 -18.218 15.040 1.00 0.00 N ATOM 1201 CA ASP A 84 -21.126 -17.445 13.843 1.00 0.00 C ATOM 1202 C ASP A 84 -20.754 -18.364 12.684 1.00 0.00 C ATOM 1203 O ASP A 84 -21.226 -18.187 11.560 1.00 0.00 O ATOM 1204 CB ASP A 84 -19.984 -16.466 14.121 1.00 0.00 C ATOM 1205 CG ASP A 84 -19.939 -15.330 13.119 1.00 0.00 C ATOM 1206 OD1 ASP A 84 -21.010 -14.957 12.596 1.00 0.00 O ATOM 1207 OD2 ASP A 84 -18.833 -14.813 12.857 1.00 0.00 O ATOM 0 H ASP A 84 -20.647 -18.334 15.680 1.00 0.00 H new ATOM 0 HA ASP A 84 -22.017 -16.882 13.565 1.00 0.00 H new ATOM 0 HB2 ASP A 84 -20.096 -16.057 15.125 1.00 0.00 H new ATOM 0 HB3 ASP A 84 -19.036 -17.003 14.100 1.00 0.00 H new ATOM 1212 N VAL A 85 -19.903 -19.347 12.963 1.00 0.00 N ATOM 1213 CA VAL A 85 -19.467 -20.294 11.945 1.00 0.00 C ATOM 1214 C VAL A 85 -20.655 -21.027 11.332 1.00 0.00 C ATOM 1215 O VAL A 85 -21.353 -21.780 12.013 1.00 0.00 O ATOM 1216 CB VAL A 85 -18.483 -21.328 12.524 1.00 0.00 C ATOM 1217 CG1 VAL A 85 -18.097 -22.349 11.465 1.00 0.00 C ATOM 1218 CG2 VAL A 85 -17.249 -20.634 13.081 1.00 0.00 C ATOM 0 H VAL A 85 -19.502 -19.508 13.887 1.00 0.00 H new ATOM 0 HA VAL A 85 -18.961 -19.716 11.171 1.00 0.00 H new ATOM 0 HB VAL A 85 -18.976 -21.856 13.341 1.00 0.00 H new ATOM 0 HG11 VAL A 85 -17.401 -23.071 11.892 1.00 0.00 H new ATOM 0 HG12 VAL A 85 -18.990 -22.868 11.117 1.00 0.00 H new ATOM 0 HG13 VAL A 85 -17.622 -21.841 10.626 1.00 0.00 H new ATOM 0 HG21 VAL A 85 -16.564 -21.379 13.486 1.00 0.00 H new ATOM 0 HG22 VAL A 85 -16.752 -20.080 12.284 1.00 0.00 H new ATOM 0 HG23 VAL A 85 -17.545 -19.945 13.872 1.00 0.00 H new ATOM 1228 N LEU A 86 -20.879 -20.804 10.042 1.00 0.00 N ATOM 1229 CA LEU A 86 -21.984 -21.444 9.335 1.00 0.00 C ATOM 1230 C LEU A 86 -21.619 -22.869 8.931 1.00 0.00 C ATOM 1231 O LEU A 86 -21.067 -23.098 7.855 1.00 0.00 O ATOM 1232 CB LEU A 86 -22.361 -20.632 8.096 1.00 0.00 C ATOM 1233 CG LEU A 86 -23.419 -19.546 8.301 1.00 0.00 C ATOM 1234 CD1 LEU A 86 -23.395 -18.553 7.150 1.00 0.00 C ATOM 1235 CD2 LEU A 86 -24.801 -20.168 8.443 1.00 0.00 C ATOM 0 H LEU A 86 -20.311 -20.185 9.464 1.00 0.00 H new ATOM 0 HA LEU A 86 -22.839 -21.485 10.009 1.00 0.00 H new ATOM 0 HB2 LEU A 86 -21.458 -20.162 7.705 1.00 0.00 H new ATOM 0 HB3 LEU A 86 -22.719 -21.320 7.330 1.00 0.00 H new ATOM 0 HG LEU A 86 -23.188 -19.009 9.221 1.00 0.00 H new ATOM 0 HD11 LEU A 86 -24.154 -17.788 7.313 1.00 0.00 H new ATOM 0 HD12 LEU A 86 -22.413 -18.083 7.095 1.00 0.00 H new ATOM 0 HD13 LEU A 86 -23.601 -19.074 6.215 1.00 0.00 H new ATOM 0 HD21 LEU A 86 -25.541 -19.381 8.588 1.00 0.00 H new ATOM 0 HD22 LEU A 86 -25.041 -20.730 7.541 1.00 0.00 H new ATOM 0 HD23 LEU A 86 -24.812 -20.839 9.302 1.00 0.00 H new ATOM 1247 N TRP A 87 -21.932 -23.823 9.801 1.00 0.00 N ATOM 1248 CA TRP A 87 -21.639 -25.227 9.533 1.00 0.00 C ATOM 1249 C TRP A 87 -22.642 -25.814 8.547 1.00 0.00 C ATOM 1250 O TRP A 87 -23.807 -25.418 8.500 1.00 0.00 O ATOM 1251 CB TRP A 87 -21.654 -26.029 10.835 1.00 0.00 C ATOM 1252 CG TRP A 87 -20.993 -25.320 11.978 1.00 0.00 C ATOM 1253 CD1 TRP A 87 -21.508 -24.288 12.710 1.00 0.00 C ATOM 1254 CD2 TRP A 87 -19.695 -25.590 12.518 1.00 0.00 C ATOM 1255 NE1 TRP A 87 -20.607 -23.900 13.673 1.00 0.00 N ATOM 1256 CE2 TRP A 87 -19.487 -24.683 13.576 1.00 0.00 C ATOM 1257 CE3 TRP A 87 -18.688 -26.509 12.212 1.00 0.00 C ATOM 1258 CZ2 TRP A 87 -18.315 -24.671 14.327 1.00 0.00 C ATOM 1259 CZ3 TRP A 87 -17.525 -26.496 12.957 1.00 0.00 C ATOM 1260 CH2 TRP A 87 -17.346 -25.583 14.005 1.00 0.00 C ATOM 0 H TRP A 87 -22.388 -23.650 10.697 1.00 0.00 H new ATOM 0 HA TRP A 87 -20.645 -25.287 9.089 1.00 0.00 H new ATOM 0 HB2 TRP A 87 -22.686 -26.252 11.104 1.00 0.00 H new ATOM 0 HB3 TRP A 87 -21.154 -26.983 10.671 1.00 0.00 H new ATOM 0 HD1 TRP A 87 -22.480 -23.843 12.555 1.00 0.00 H new ATOM 0 HE1 TRP A 87 -20.749 -23.151 14.350 1.00 0.00 H new ATOM 0 HE3 TRP A 87 -18.817 -27.217 11.407 1.00 0.00 H new ATOM 0 HZ2 TRP A 87 -18.175 -23.968 15.135 1.00 0.00 H new ATOM 0 HZ3 TRP A 87 -16.740 -27.202 12.728 1.00 0.00 H new ATOM 0 HH2 TRP A 87 -16.426 -25.599 14.570 1.00 0.00 H new ATOM 1271 N PRO A 88 -22.184 -26.782 7.740 1.00 0.00 N ATOM 1272 CA PRO A 88 -23.027 -27.445 6.741 1.00 0.00 C ATOM 1273 C PRO A 88 -24.084 -28.341 7.377 1.00 0.00 C ATOM 1274 O PRO A 88 -23.831 -28.990 8.391 1.00 0.00 O ATOM 1275 CB PRO A 88 -22.030 -28.283 5.935 1.00 0.00 C ATOM 1276 CG PRO A 88 -20.897 -28.528 6.872 1.00 0.00 C ATOM 1277 CD PRO A 88 -20.807 -27.304 7.741 1.00 0.00 C ATOM 0 HA PRO A 88 -23.587 -26.728 6.140 1.00 0.00 H new ATOM 0 HB2 PRO A 88 -22.478 -29.219 5.602 1.00 0.00 H new ATOM 0 HB3 PRO A 88 -21.698 -27.753 5.042 1.00 0.00 H new ATOM 0 HG2 PRO A 88 -21.073 -29.421 7.472 1.00 0.00 H new ATOM 0 HG3 PRO A 88 -19.967 -28.689 6.327 1.00 0.00 H new ATOM 0 HD2 PRO A 88 -20.472 -27.550 8.748 1.00 0.00 H new ATOM 0 HD3 PRO A 88 -20.101 -26.577 7.339 1.00 0.00 H new ATOM 1285 N GLU A 89 -25.268 -28.372 6.773 1.00 0.00 N ATOM 1286 CA GLU A 89 -26.363 -29.189 7.282 1.00 0.00 C ATOM 1287 C GLU A 89 -26.017 -30.673 7.202 1.00 0.00 C ATOM 1288 O GLU A 89 -26.401 -31.459 8.068 1.00 0.00 O ATOM 1289 CB GLU A 89 -27.646 -28.910 6.496 1.00 0.00 C ATOM 1290 CG GLU A 89 -27.643 -29.501 5.097 1.00 0.00 C ATOM 1291 CD GLU A 89 -26.789 -28.706 4.129 1.00 0.00 C ATOM 1292 OE1 GLU A 89 -26.949 -27.469 4.073 1.00 0.00 O ATOM 1293 OE2 GLU A 89 -25.959 -29.322 3.427 1.00 0.00 O ATOM 0 H GLU A 89 -25.493 -27.841 5.932 1.00 0.00 H new ATOM 0 HA GLU A 89 -26.522 -28.926 8.328 1.00 0.00 H new ATOM 0 HB2 GLU A 89 -28.495 -29.311 7.049 1.00 0.00 H new ATOM 0 HB3 GLU A 89 -27.792 -27.832 6.426 1.00 0.00 H new ATOM 0 HG2 GLU A 89 -27.277 -30.527 5.141 1.00 0.00 H new ATOM 0 HG3 GLU A 89 -28.666 -29.544 4.723 1.00 0.00 H new ATOM 1300 N ALA A 90 -25.290 -31.050 6.155 1.00 0.00 N ATOM 1301 CA ALA A 90 -24.891 -32.438 5.961 1.00 0.00 C ATOM 1302 C ALA A 90 -24.634 -33.127 7.297 1.00 0.00 C ATOM 1303 O ALA A 90 -24.960 -34.300 7.474 1.00 0.00 O ATOM 1304 CB ALA A 90 -23.654 -32.513 5.079 1.00 0.00 C ATOM 0 H ALA A 90 -24.965 -30.413 5.428 1.00 0.00 H new ATOM 0 HA ALA A 90 -25.709 -32.960 5.465 1.00 0.00 H new ATOM 0 HB1 ALA A 90 -23.367 -33.556 4.943 1.00 0.00 H new ATOM 0 HB2 ALA A 90 -23.871 -32.066 4.109 1.00 0.00 H new ATOM 0 HB3 ALA A 90 -22.836 -31.971 5.553 1.00 0.00 H new ATOM 1310 N ALA A 91 -24.048 -32.390 8.234 1.00 0.00 N ATOM 1311 CA ALA A 91 -23.748 -32.930 9.555 1.00 0.00 C ATOM 1312 C ALA A 91 -25.024 -33.141 10.363 1.00 0.00 C ATOM 1313 O ALA A 91 -25.827 -32.223 10.525 1.00 0.00 O ATOM 1314 CB ALA A 91 -22.796 -32.006 10.299 1.00 0.00 C ATOM 0 H ALA A 91 -23.771 -31.417 8.103 1.00 0.00 H new ATOM 0 HA ALA A 91 -23.267 -33.899 9.424 1.00 0.00 H new ATOM 0 HB1 ALA A 91 -22.581 -32.421 11.283 1.00 0.00 H new ATOM 0 HB2 ALA A 91 -21.868 -31.909 9.735 1.00 0.00 H new ATOM 0 HB3 ALA A 91 -23.256 -31.024 10.412 1.00 0.00 H new ATOM 1320 N SER A 92 -25.203 -34.357 10.869 1.00 0.00 N ATOM 1321 CA SER A 92 -26.384 -34.690 11.658 1.00 0.00 C ATOM 1322 C SER A 92 -26.061 -34.684 13.149 1.00 0.00 C ATOM 1323 O SER A 92 -26.914 -34.370 13.979 1.00 0.00 O ATOM 1324 CB SER A 92 -26.927 -36.061 11.248 1.00 0.00 C ATOM 1325 OG SER A 92 -28.294 -36.192 11.594 1.00 0.00 O ATOM 0 H SER A 92 -24.546 -35.128 10.747 1.00 0.00 H new ATOM 0 HA SER A 92 -27.144 -33.933 11.466 1.00 0.00 H new ATOM 0 HB2 SER A 92 -26.806 -36.197 10.173 1.00 0.00 H new ATOM 0 HB3 SER A 92 -26.348 -36.846 11.736 1.00 0.00 H new ATOM 0 HG SER A 92 -28.618 -37.076 11.320 1.00 0.00 H new ATOM 1331 N ASP A 93 -24.823 -35.033 13.481 1.00 0.00 N ATOM 1332 CA ASP A 93 -24.385 -35.066 14.871 1.00 0.00 C ATOM 1333 C ASP A 93 -23.809 -33.718 15.293 1.00 0.00 C ATOM 1334 O ASP A 93 -22.812 -33.258 14.737 1.00 0.00 O ATOM 1335 CB ASP A 93 -23.341 -36.166 15.073 1.00 0.00 C ATOM 1336 CG ASP A 93 -22.539 -35.976 16.345 1.00 0.00 C ATOM 1337 OD1 ASP A 93 -23.135 -35.583 17.370 1.00 0.00 O ATOM 1338 OD2 ASP A 93 -21.314 -36.220 16.317 1.00 0.00 O ATOM 0 H ASP A 93 -24.105 -35.297 12.806 1.00 0.00 H new ATOM 0 HA ASP A 93 -25.253 -35.280 15.494 1.00 0.00 H new ATOM 0 HB2 ASP A 93 -23.839 -37.135 15.102 1.00 0.00 H new ATOM 0 HB3 ASP A 93 -22.664 -36.182 14.219 1.00 0.00 H new ATOM 1343 N GLU A 94 -24.444 -33.090 16.277 1.00 0.00 N ATOM 1344 CA GLU A 94 -23.995 -31.793 16.770 1.00 0.00 C ATOM 1345 C GLU A 94 -22.538 -31.857 17.218 1.00 0.00 C ATOM 1346 O GLU A 94 -21.837 -30.844 17.238 1.00 0.00 O ATOM 1347 CB GLU A 94 -24.878 -31.331 17.932 1.00 0.00 C ATOM 1348 CG GLU A 94 -24.957 -32.333 19.072 1.00 0.00 C ATOM 1349 CD GLU A 94 -25.369 -31.693 20.383 1.00 0.00 C ATOM 1350 OE1 GLU A 94 -25.111 -30.485 20.561 1.00 0.00 O ATOM 1351 OE2 GLU A 94 -25.952 -32.401 21.231 1.00 0.00 O ATOM 0 H GLU A 94 -25.270 -33.458 16.748 1.00 0.00 H new ATOM 0 HA GLU A 94 -24.075 -31.074 15.954 1.00 0.00 H new ATOM 0 HB2 GLU A 94 -24.494 -30.386 18.316 1.00 0.00 H new ATOM 0 HB3 GLU A 94 -25.884 -31.138 17.559 1.00 0.00 H new ATOM 0 HG2 GLU A 94 -25.670 -33.116 18.814 1.00 0.00 H new ATOM 0 HG3 GLU A 94 -23.987 -32.814 19.196 1.00 0.00 H new ATOM 1358 N THR A 95 -22.087 -33.054 17.578 1.00 0.00 N ATOM 1359 CA THR A 95 -20.715 -33.251 18.028 1.00 0.00 C ATOM 1360 C THR A 95 -19.762 -33.379 16.845 1.00 0.00 C ATOM 1361 O THR A 95 -18.549 -33.224 16.992 1.00 0.00 O ATOM 1362 CB THR A 95 -20.588 -34.506 18.913 1.00 0.00 C ATOM 1363 OG1 THR A 95 -21.381 -34.354 20.095 1.00 0.00 O ATOM 1364 CG2 THR A 95 -19.137 -34.751 19.298 1.00 0.00 C ATOM 0 H THR A 95 -22.653 -33.903 17.567 1.00 0.00 H new ATOM 0 HA THR A 95 -20.446 -32.373 18.615 1.00 0.00 H new ATOM 0 HB THR A 95 -20.946 -35.363 18.343 1.00 0.00 H new ATOM 0 HG1 THR A 95 -21.296 -35.156 20.651 1.00 0.00 H new ATOM 0 HG21 THR A 95 -19.072 -35.642 19.923 1.00 0.00 H new ATOM 0 HG22 THR A 95 -18.541 -34.895 18.397 1.00 0.00 H new ATOM 0 HG23 THR A 95 -18.757 -33.892 19.851 1.00 0.00 H new ATOM 1372 N LYS A 96 -20.317 -33.662 15.672 1.00 0.00 N ATOM 1373 CA LYS A 96 -19.517 -33.809 14.462 1.00 0.00 C ATOM 1374 C LYS A 96 -18.834 -32.494 14.098 1.00 0.00 C ATOM 1375 O LYS A 96 -17.619 -32.445 13.910 1.00 0.00 O ATOM 1376 CB LYS A 96 -20.395 -34.279 13.299 1.00 0.00 C ATOM 1377 CG LYS A 96 -19.621 -34.987 12.201 1.00 0.00 C ATOM 1378 CD LYS A 96 -19.407 -36.456 12.527 1.00 0.00 C ATOM 1379 CE LYS A 96 -20.620 -37.293 12.152 1.00 0.00 C ATOM 1380 NZ LYS A 96 -20.546 -38.665 12.725 1.00 0.00 N ATOM 0 H LYS A 96 -21.319 -33.794 15.533 1.00 0.00 H new ATOM 0 HA LYS A 96 -18.748 -34.557 14.654 1.00 0.00 H new ATOM 0 HB2 LYS A 96 -21.162 -34.951 13.683 1.00 0.00 H new ATOM 0 HB3 LYS A 96 -20.910 -33.418 12.872 1.00 0.00 H new ATOM 0 HG2 LYS A 96 -20.161 -34.898 11.258 1.00 0.00 H new ATOM 0 HG3 LYS A 96 -18.656 -34.500 12.063 1.00 0.00 H new ATOM 0 HD2 LYS A 96 -18.531 -36.824 11.993 1.00 0.00 H new ATOM 0 HD3 LYS A 96 -19.202 -36.567 13.592 1.00 0.00 H new ATOM 0 HE2 LYS A 96 -21.525 -36.800 12.506 1.00 0.00 H new ATOM 0 HE3 LYS A 96 -20.696 -37.356 11.066 1.00 0.00 H new ATOM 0 HZ1 LYS A 96 -21.391 -39.204 12.447 1.00 0.00 H new ATOM 0 HZ2 LYS A 96 -19.696 -39.145 12.367 1.00 0.00 H new ATOM 0 HZ3 LYS A 96 -20.499 -38.606 13.762 1.00 0.00 H new ATOM 1394 N LYS A 97 -19.624 -31.430 14.001 1.00 0.00 N ATOM 1395 CA LYS A 97 -19.096 -30.114 13.662 1.00 0.00 C ATOM 1396 C LYS A 97 -18.252 -29.556 14.803 1.00 0.00 C ATOM 1397 O LYS A 97 -17.197 -28.964 14.575 1.00 0.00 O ATOM 1398 CB LYS A 97 -20.241 -29.150 13.342 1.00 0.00 C ATOM 1399 CG LYS A 97 -21.509 -29.428 14.130 1.00 0.00 C ATOM 1400 CD LYS A 97 -22.424 -30.391 13.392 1.00 0.00 C ATOM 1401 CE LYS A 97 -23.399 -29.652 12.488 1.00 0.00 C ATOM 1402 NZ LYS A 97 -24.636 -30.443 12.242 1.00 0.00 N ATOM 0 H LYS A 97 -20.632 -31.453 14.152 1.00 0.00 H new ATOM 0 HA LYS A 97 -18.461 -30.220 12.782 1.00 0.00 H new ATOM 0 HB2 LYS A 97 -19.914 -28.130 13.545 1.00 0.00 H new ATOM 0 HB3 LYS A 97 -20.465 -29.207 12.277 1.00 0.00 H new ATOM 0 HG2 LYS A 97 -21.250 -29.845 15.103 1.00 0.00 H new ATOM 0 HG3 LYS A 97 -22.037 -28.492 14.314 1.00 0.00 H new ATOM 0 HD2 LYS A 97 -21.825 -31.080 12.797 1.00 0.00 H new ATOM 0 HD3 LYS A 97 -22.979 -30.992 14.113 1.00 0.00 H new ATOM 0 HE2 LYS A 97 -23.663 -28.697 12.942 1.00 0.00 H new ATOM 0 HE3 LYS A 97 -22.915 -29.430 11.537 1.00 0.00 H new ATOM 0 HZ1 LYS A 97 -24.820 -30.491 11.219 1.00 0.00 H new ATOM 0 HZ2 LYS A 97 -24.513 -31.405 12.618 1.00 0.00 H new ATOM 0 HZ3 LYS A 97 -25.440 -29.986 12.717 1.00 0.00 H new ATOM 1416 N ARG A 98 -18.722 -29.750 16.031 1.00 0.00 N ATOM 1417 CA ARG A 98 -18.010 -29.267 17.207 1.00 0.00 C ATOM 1418 C ARG A 98 -16.595 -29.837 17.259 1.00 0.00 C ATOM 1419 O ARG A 98 -15.648 -29.145 17.635 1.00 0.00 O ATOM 1420 CB ARG A 98 -18.769 -29.644 18.481 1.00 0.00 C ATOM 1421 CG ARG A 98 -20.036 -28.831 18.697 1.00 0.00 C ATOM 1422 CD ARG A 98 -20.775 -29.276 19.949 1.00 0.00 C ATOM 1423 NE ARG A 98 -20.139 -28.780 21.167 1.00 0.00 N ATOM 1424 CZ ARG A 98 -19.141 -29.405 21.782 1.00 0.00 C ATOM 1425 NH1 ARG A 98 -18.669 -30.545 21.296 1.00 0.00 N ATOM 1426 NH2 ARG A 98 -18.614 -28.891 22.885 1.00 0.00 N ATOM 0 H ARG A 98 -19.593 -30.239 16.237 1.00 0.00 H new ATOM 0 HA ARG A 98 -17.944 -28.181 17.139 1.00 0.00 H new ATOM 0 HB2 ARG A 98 -19.029 -30.702 18.440 1.00 0.00 H new ATOM 0 HB3 ARG A 98 -18.111 -29.510 19.339 1.00 0.00 H new ATOM 0 HG2 ARG A 98 -19.782 -27.774 18.779 1.00 0.00 H new ATOM 0 HG3 ARG A 98 -20.689 -28.936 17.831 1.00 0.00 H new ATOM 0 HD2 ARG A 98 -21.805 -28.921 19.907 1.00 0.00 H new ATOM 0 HD3 ARG A 98 -20.815 -30.365 19.979 1.00 0.00 H new ATOM 0 HE ARG A 98 -20.480 -27.906 21.567 1.00 0.00 H new ATOM 0 HH11 ARG A 98 -19.072 -30.944 20.448 1.00 0.00 H new ATOM 0 HH12 ARG A 98 -17.903 -31.023 21.770 1.00 0.00 H new ATOM 0 HH21 ARG A 98 -18.975 -28.015 23.262 1.00 0.00 H new ATOM 0 HH22 ARG A 98 -17.848 -29.372 23.356 1.00 0.00 H new ATOM 1440 N THR A 99 -16.459 -31.103 16.878 1.00 0.00 N ATOM 1441 CA THR A 99 -15.161 -31.767 16.882 1.00 0.00 C ATOM 1442 C THR A 99 -14.680 -32.043 15.463 1.00 0.00 C ATOM 1443 O THR A 99 -13.869 -32.940 15.235 1.00 0.00 O ATOM 1444 CB THR A 99 -15.212 -33.094 17.663 1.00 0.00 C ATOM 1445 OG1 THR A 99 -13.883 -33.545 17.949 1.00 0.00 O ATOM 1446 CG2 THR A 99 -15.955 -34.159 16.871 1.00 0.00 C ATOM 0 H THR A 99 -17.232 -31.689 16.563 1.00 0.00 H new ATOM 0 HA THR A 99 -14.461 -31.091 17.374 1.00 0.00 H new ATOM 0 HB THR A 99 -15.745 -32.920 18.598 1.00 0.00 H new ATOM 0 HG1 THR A 99 -13.924 -34.388 18.447 1.00 0.00 H new ATOM 0 HG21 THR A 99 -15.978 -35.087 17.442 1.00 0.00 H new ATOM 0 HG22 THR A 99 -16.975 -33.825 16.680 1.00 0.00 H new ATOM 0 HG23 THR A 99 -15.445 -34.329 15.923 1.00 0.00 H new ATOM 1454 N ALA A 100 -15.185 -31.266 14.510 1.00 0.00 N ATOM 1455 CA ALA A 100 -14.805 -31.426 13.112 1.00 0.00 C ATOM 1456 C ALA A 100 -13.376 -30.950 12.874 1.00 0.00 C ATOM 1457 O ALA A 100 -12.754 -31.297 11.870 1.00 0.00 O ATOM 1458 CB ALA A 100 -15.771 -30.670 12.212 1.00 0.00 C ATOM 0 H ALA A 100 -15.858 -30.519 14.681 1.00 0.00 H new ATOM 0 HA ALA A 100 -14.853 -32.487 12.868 1.00 0.00 H new ATOM 0 HB1 ALA A 100 -15.475 -30.799 11.171 1.00 0.00 H new ATOM 0 HB2 ALA A 100 -16.780 -31.059 12.353 1.00 0.00 H new ATOM 0 HB3 ALA A 100 -15.752 -29.610 12.466 1.00 0.00 H new ATOM 1464 N PHE A 101 -12.860 -30.153 13.804 1.00 0.00 N ATOM 1465 CA PHE A 101 -11.504 -29.628 13.695 1.00 0.00 C ATOM 1466 C PHE A 101 -10.537 -30.434 14.557 1.00 0.00 C ATOM 1467 O PHE A 101 -9.502 -29.927 14.987 1.00 0.00 O ATOM 1468 CB PHE A 101 -11.469 -28.156 14.110 1.00 0.00 C ATOM 1469 CG PHE A 101 -11.931 -27.218 13.032 1.00 0.00 C ATOM 1470 CD1 PHE A 101 -11.138 -26.971 11.923 1.00 0.00 C ATOM 1471 CD2 PHE A 101 -13.158 -26.582 13.127 1.00 0.00 C ATOM 1472 CE1 PHE A 101 -11.560 -26.109 10.928 1.00 0.00 C ATOM 1473 CE2 PHE A 101 -13.586 -25.719 12.136 1.00 0.00 C ATOM 1474 CZ PHE A 101 -12.786 -25.481 11.036 1.00 0.00 C ATOM 0 H PHE A 101 -13.361 -29.857 14.642 1.00 0.00 H new ATOM 0 HA PHE A 101 -11.192 -29.712 12.654 1.00 0.00 H new ATOM 0 HB2 PHE A 101 -12.096 -28.020 14.992 1.00 0.00 H new ATOM 0 HB3 PHE A 101 -10.451 -27.892 14.398 1.00 0.00 H new ATOM 0 HD1 PHE A 101 -10.178 -27.458 11.835 1.00 0.00 H new ATOM 0 HD2 PHE A 101 -13.788 -26.763 13.986 1.00 0.00 H new ATOM 0 HE1 PHE A 101 -10.933 -25.927 10.068 1.00 0.00 H new ATOM 0 HE2 PHE A 101 -14.546 -25.231 12.222 1.00 0.00 H new ATOM 0 HZ PHE A 101 -13.118 -24.805 10.262 1.00 0.00 H new ATOM 1484 N ALA A 102 -10.884 -31.693 14.806 1.00 0.00 N ATOM 1485 CA ALA A 102 -10.048 -32.570 15.615 1.00 0.00 C ATOM 1486 C ALA A 102 -8.707 -32.830 14.937 1.00 0.00 C ATOM 1487 O ALA A 102 -8.656 -33.335 13.816 1.00 0.00 O ATOM 1488 CB ALA A 102 -10.768 -33.883 15.887 1.00 0.00 C ATOM 0 H ALA A 102 -11.739 -32.128 14.459 1.00 0.00 H new ATOM 0 HA ALA A 102 -9.854 -32.071 16.565 1.00 0.00 H new ATOM 0 HB1 ALA A 102 -10.132 -34.528 16.492 1.00 0.00 H new ATOM 0 HB2 ALA A 102 -11.697 -33.685 16.422 1.00 0.00 H new ATOM 0 HB3 ALA A 102 -10.992 -34.378 14.942 1.00 0.00 H new ATOM 1494 N GLY A 103 -7.624 -32.481 15.623 1.00 0.00 N ATOM 1495 CA GLY A 103 -6.298 -32.684 15.070 1.00 0.00 C ATOM 1496 C GLY A 103 -5.586 -31.379 14.775 1.00 0.00 C ATOM 1497 O GLY A 103 -4.356 -31.316 14.787 1.00 0.00 O ATOM 0 H GLY A 103 -7.641 -32.061 16.552 1.00 0.00 H new ATOM 0 HA2 GLY A 103 -5.702 -33.269 15.770 1.00 0.00 H new ATOM 0 HA3 GLY A 103 -6.376 -33.267 14.152 1.00 0.00 H new ATOM 1501 N THR A 104 -6.361 -30.332 14.508 1.00 0.00 N ATOM 1502 CA THR A 104 -5.798 -29.022 14.205 1.00 0.00 C ATOM 1503 C THR A 104 -5.686 -28.168 15.463 1.00 0.00 C ATOM 1504 O THR A 104 -6.172 -28.548 16.528 1.00 0.00 O ATOM 1505 CB THR A 104 -6.648 -28.272 13.163 1.00 0.00 C ATOM 1506 OG1 THR A 104 -7.972 -28.067 13.667 1.00 0.00 O ATOM 1507 CG2 THR A 104 -6.712 -29.049 11.857 1.00 0.00 C ATOM 0 H THR A 104 -7.380 -30.366 14.496 1.00 0.00 H new ATOM 0 HA THR A 104 -4.803 -29.193 13.795 1.00 0.00 H new ATOM 0 HB THR A 104 -6.179 -27.307 12.971 1.00 0.00 H new ATOM 0 HG1 THR A 104 -8.345 -28.923 13.963 1.00 0.00 H new ATOM 0 HG21 THR A 104 -7.318 -28.500 11.136 1.00 0.00 H new ATOM 0 HG22 THR A 104 -5.705 -29.178 11.461 1.00 0.00 H new ATOM 0 HG23 THR A 104 -7.159 -30.027 12.037 1.00 0.00 H new ATOM 1515 N ALA A 105 -5.044 -27.012 15.332 1.00 0.00 N ATOM 1516 CA ALA A 105 -4.872 -26.102 16.458 1.00 0.00 C ATOM 1517 C ALA A 105 -6.021 -25.102 16.537 1.00 0.00 C ATOM 1518 O ALA A 105 -5.910 -24.066 17.193 1.00 0.00 O ATOM 1519 CB ALA A 105 -3.542 -25.372 16.349 1.00 0.00 C ATOM 0 H ALA A 105 -4.634 -26.683 14.458 1.00 0.00 H new ATOM 0 HA ALA A 105 -4.876 -26.693 17.374 1.00 0.00 H new ATOM 0 HB1 ALA A 105 -3.427 -24.696 17.196 1.00 0.00 H new ATOM 0 HB2 ALA A 105 -2.728 -26.097 16.350 1.00 0.00 H new ATOM 0 HB3 ALA A 105 -3.516 -24.799 15.422 1.00 0.00 H new ATOM 1525 N ILE A 106 -7.122 -25.419 15.865 1.00 0.00 N ATOM 1526 CA ILE A 106 -8.291 -24.549 15.861 1.00 0.00 C ATOM 1527 C ILE A 106 -9.235 -24.889 17.009 1.00 0.00 C ATOM 1528 O ILE A 106 -9.573 -26.053 17.224 1.00 0.00 O ATOM 1529 CB ILE A 106 -9.062 -24.648 14.531 1.00 0.00 C ATOM 1530 CG1 ILE A 106 -8.278 -23.962 13.410 1.00 0.00 C ATOM 1531 CG2 ILE A 106 -10.444 -24.029 14.672 1.00 0.00 C ATOM 1532 CD1 ILE A 106 -8.719 -24.375 12.023 1.00 0.00 C ATOM 0 H ILE A 106 -7.229 -26.272 15.316 1.00 0.00 H new ATOM 0 HA ILE A 106 -7.925 -23.530 15.985 1.00 0.00 H new ATOM 0 HB ILE A 106 -9.181 -25.701 14.275 1.00 0.00 H new ATOM 0 HG12 ILE A 106 -8.386 -22.882 13.510 1.00 0.00 H new ATOM 0 HG13 ILE A 106 -7.218 -24.188 13.528 1.00 0.00 H new ATOM 0 HG21 ILE A 106 -10.976 -24.107 13.724 1.00 0.00 H new ATOM 0 HG22 ILE A 106 -11.002 -24.557 15.446 1.00 0.00 H new ATOM 0 HG23 ILE A 106 -10.346 -22.979 14.948 1.00 0.00 H new ATOM 0 HD11 ILE A 106 -8.120 -23.849 11.279 1.00 0.00 H new ATOM 0 HD12 ILE A 106 -8.584 -25.450 11.903 1.00 0.00 H new ATOM 0 HD13 ILE A 106 -9.771 -24.123 11.886 1.00 0.00 H new ATOM 1544 N SER A 107 -9.659 -23.865 17.742 1.00 0.00 N ATOM 1545 CA SER A 107 -10.564 -24.056 18.870 1.00 0.00 C ATOM 1546 C SER A 107 -11.897 -23.356 18.623 1.00 0.00 C ATOM 1547 O SER A 107 -11.934 -22.179 18.263 1.00 0.00 O ATOM 1548 CB SER A 107 -9.928 -23.525 20.157 1.00 0.00 C ATOM 1549 OG SER A 107 -8.642 -24.086 20.359 1.00 0.00 O ATOM 0 H SER A 107 -9.391 -22.895 17.576 1.00 0.00 H new ATOM 0 HA SER A 107 -10.749 -25.125 18.978 1.00 0.00 H new ATOM 0 HB2 SER A 107 -9.851 -22.439 20.107 1.00 0.00 H new ATOM 0 HB3 SER A 107 -10.569 -23.760 21.007 1.00 0.00 H new ATOM 0 HG SER A 107 -8.256 -23.730 21.186 1.00 0.00 H new ATOM 1555 N ILE A 108 -12.988 -24.089 18.817 1.00 0.00 N ATOM 1556 CA ILE A 108 -14.322 -23.539 18.616 1.00 0.00 C ATOM 1557 C ILE A 108 -15.094 -23.475 19.930 1.00 0.00 C ATOM 1558 O ILE A 108 -15.140 -24.447 20.684 1.00 0.00 O ATOM 1559 CB ILE A 108 -15.127 -24.372 17.601 1.00 0.00 C ATOM 1560 CG1 ILE A 108 -16.380 -23.611 17.163 1.00 0.00 C ATOM 1561 CG2 ILE A 108 -15.502 -25.719 18.200 1.00 0.00 C ATOM 1562 CD1 ILE A 108 -16.145 -22.686 15.989 1.00 0.00 C ATOM 0 H ILE A 108 -12.974 -25.065 19.113 1.00 0.00 H new ATOM 0 HA ILE A 108 -14.192 -22.530 18.224 1.00 0.00 H new ATOM 0 HB ILE A 108 -14.505 -24.547 16.723 1.00 0.00 H new ATOM 0 HG12 ILE A 108 -17.158 -24.328 16.900 1.00 0.00 H new ATOM 0 HG13 ILE A 108 -16.755 -23.029 18.005 1.00 0.00 H new ATOM 0 HG21 ILE A 108 -16.071 -26.296 17.471 1.00 0.00 H new ATOM 0 HG22 ILE A 108 -14.596 -26.263 18.467 1.00 0.00 H new ATOM 0 HG23 ILE A 108 -16.108 -25.564 19.092 1.00 0.00 H new ATOM 0 HD11 ILE A 108 -17.076 -22.180 15.733 1.00 0.00 H new ATOM 0 HD12 ILE A 108 -15.390 -21.946 16.254 1.00 0.00 H new ATOM 0 HD13 ILE A 108 -15.800 -23.265 15.133 1.00 0.00 H new ATOM 1574 N VAL A 109 -15.701 -22.323 20.197 1.00 0.00 N ATOM 1575 CA VAL A 109 -16.475 -22.132 21.418 1.00 0.00 C ATOM 1576 C VAL A 109 -17.969 -22.259 21.148 1.00 0.00 C ATOM 1577 O VAL A 109 -18.625 -21.292 20.759 1.00 0.00 O ATOM 1578 CB VAL A 109 -16.193 -20.756 22.051 1.00 0.00 C ATOM 1579 CG1 VAL A 109 -17.108 -20.519 23.243 1.00 0.00 C ATOM 1580 CG2 VAL A 109 -14.732 -20.647 22.460 1.00 0.00 C ATOM 0 H VAL A 109 -15.672 -21.508 19.584 1.00 0.00 H new ATOM 0 HA VAL A 109 -16.168 -22.913 22.113 1.00 0.00 H new ATOM 0 HB VAL A 109 -16.397 -19.985 21.308 1.00 0.00 H new ATOM 0 HG11 VAL A 109 -16.894 -19.542 23.677 1.00 0.00 H new ATOM 0 HG12 VAL A 109 -18.147 -20.551 22.916 1.00 0.00 H new ATOM 0 HG13 VAL A 109 -16.939 -21.293 23.991 1.00 0.00 H new ATOM 0 HG21 VAL A 109 -14.551 -19.669 22.905 1.00 0.00 H new ATOM 0 HG22 VAL A 109 -14.499 -21.425 23.187 1.00 0.00 H new ATOM 0 HG23 VAL A 109 -14.098 -20.769 21.582 1.00 0.00 H new TER 1590 VAL A 109