USER MOD reduce.3.24.130724 H: found=0, std=0, add=927, rem=0, adj=13 USER MOD reduce.3.24.130724 removed 925 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 27 LYS NZ :NH3+ 177:sc= 1.28 (180deg=0.69) USER MOD Set 1.2: A 94 SER OG : rot 180:sc= 0.359 USER MOD Set 2.1: A 40 GLN : amide:sc= -0.817! C(o=-0.17!,f=-4.3!) USER MOD Set 2.2: A 50 TYR OH : rot -144:sc= 0.647 USER MOD Single : A 1 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 1 MET N :NH3+ 180:sc= -0.232 (180deg=-0.232) USER MOD Single : A 4 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 5 SER OG : rot 86:sc= 0.262 USER MOD Single : A 7 MET CE :methyl -127:sc= -0.532 (180deg=-1.19) USER MOD Single : A 10 SER OG : rot 73:sc= 0.839 USER MOD Single : A 28 LYS NZ :NH3+ 167:sc= 0.674 (180deg=0.546) USER MOD Single : A 48 ASN : amide:sc= -3.01! C(o=-3!,f=-4!) USER MOD Single : A 55 GLN : amide:sc= -2.01 K(o=-2,f=-3!) USER MOD Single : A 56 SER OG : rot 48:sc= 0.071 USER MOD Single : A 64 MET CE :methyl 155:sc= 0 (180deg=-0.789) USER MOD Single : A 72 THR OG1 : rot -123:sc= -2.36 USER MOD Single : A 103 THR OG1 : rot -109:sc= 0.704 USER MOD Single : A 108 THR OG1 : rot 180:sc= 0 USER MOD Single : A 111 THR OG1 : rot 180:sc= 0 USER MOD Single : A 115 GLN : amide:sc= 0.132 X(o=0.13,f=-0.036) USER MOD Single : A 117 GLN : amide:sc= -1.09 K(o=-1.1,f=-4!) USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 1.220 0.145 -0.710 1.00 0.00 N ATOM 2 CA MET A 1 2.485 0.661 -1.279 1.00 0.00 C ATOM 3 C MET A 1 3.098 -0.360 -2.262 1.00 0.00 C ATOM 4 O MET A 1 4.264 -0.217 -2.656 1.00 0.00 O ATOM 5 CB MET A 1 3.480 1.013 -0.136 1.00 0.00 C ATOM 6 CG MET A 1 2.870 1.863 0.990 1.00 0.00 C ATOM 7 SD MET A 1 1.954 3.297 0.376 1.00 0.00 S ATOM 8 CE MET A 1 1.201 3.929 1.883 1.00 0.00 C ATOM 0 H1 MET A 1 0.824 0.846 -0.052 1.00 0.00 H new ATOM 0 H2 MET A 1 0.541 -0.032 -1.477 1.00 0.00 H new ATOM 0 H3 MET A 1 1.405 -0.742 -0.200 1.00 0.00 H new ATOM 0 HA MET A 1 2.274 1.572 -1.840 1.00 0.00 H new ATOM 0 HB2 MET A 1 3.867 0.088 0.291 1.00 0.00 H new ATOM 0 HB3 MET A 1 4.329 1.548 -0.561 1.00 0.00 H new ATOM 0 HG2 MET A 1 2.203 1.241 1.587 1.00 0.00 H new ATOM 0 HG3 MET A 1 3.666 2.204 1.653 1.00 0.00 H new ATOM 0 HE1 MET A 1 0.608 4.813 1.650 1.00 0.00 H new ATOM 0 HE2 MET A 1 0.557 3.164 2.317 1.00 0.00 H new ATOM 0 HE3 MET A 1 1.981 4.193 2.596 1.00 0.00 H new ATOM 18 N ARG A 2 2.268 -1.354 -2.679 1.00 0.00 N ATOM 19 CA ARG A 2 2.668 -2.500 -3.527 1.00 0.00 C ATOM 20 C ARG A 2 3.911 -3.213 -2.964 1.00 0.00 C ATOM 21 O ARG A 2 5.025 -3.083 -3.482 1.00 0.00 O ATOM 22 CB ARG A 2 2.842 -2.098 -5.016 1.00 0.00 C ATOM 23 CG ARG A 2 1.533 -1.685 -5.722 1.00 0.00 C ATOM 24 CD ARG A 2 1.702 -1.532 -7.245 1.00 0.00 C ATOM 25 NE ARG A 2 2.619 -0.440 -7.626 1.00 0.00 N ATOM 26 CZ ARG A 2 2.825 -0.021 -8.889 1.00 0.00 C ATOM 27 NH1 ARG A 2 2.222 -0.619 -9.913 1.00 0.00 N ATOM 28 NH2 ARG A 2 3.641 0.990 -9.116 1.00 0.00 N ATOM 0 H ARG A 2 1.280 -1.377 -2.426 1.00 0.00 H new ATOM 0 HA ARG A 2 1.849 -3.219 -3.501 1.00 0.00 H new ATOM 0 HB2 ARG A 2 3.550 -1.271 -5.076 1.00 0.00 H new ATOM 0 HB3 ARG A 2 3.284 -2.935 -5.557 1.00 0.00 H new ATOM 0 HG2 ARG A 2 0.765 -2.431 -5.519 1.00 0.00 H new ATOM 0 HG3 ARG A 2 1.181 -0.742 -5.303 1.00 0.00 H new ATOM 0 HD2 ARG A 2 2.074 -2.470 -7.658 1.00 0.00 H new ATOM 0 HD3 ARG A 2 0.726 -1.351 -7.695 1.00 0.00 H new ATOM 0 HE ARG A 2 3.133 0.030 -6.881 1.00 0.00 H new ATOM 0 HH11 ARG A 2 1.594 -1.406 -9.747 1.00 0.00 H new ATOM 0 HH12 ARG A 2 2.387 -0.291 -10.865 1.00 0.00 H new ATOM 0 HH21 ARG A 2 4.112 1.450 -8.337 1.00 0.00 H new ATOM 0 HH22 ARG A 2 3.801 1.312 -10.071 1.00 0.00 H new ATOM 42 N LEU A 3 3.694 -3.918 -1.855 1.00 0.00 N ATOM 43 CA LEU A 3 4.752 -4.629 -1.120 1.00 0.00 C ATOM 44 C LEU A 3 4.629 -6.137 -1.345 1.00 0.00 C ATOM 45 O LEU A 3 3.612 -6.623 -1.863 1.00 0.00 O ATOM 46 CB LEU A 3 4.623 -4.302 0.391 1.00 0.00 C ATOM 47 CG LEU A 3 4.447 -2.774 0.724 1.00 0.00 C ATOM 48 CD1 LEU A 3 4.002 -2.529 2.181 1.00 0.00 C ATOM 49 CD2 LEU A 3 5.745 -2.003 0.418 1.00 0.00 C ATOM 0 H LEU A 3 2.771 -4.016 -1.433 1.00 0.00 H new ATOM 0 HA LEU A 3 5.728 -4.306 -1.482 1.00 0.00 H new ATOM 0 HB2 LEU A 3 3.770 -4.848 0.795 1.00 0.00 H new ATOM 0 HB3 LEU A 3 5.510 -4.671 0.905 1.00 0.00 H new ATOM 0 HG LEU A 3 3.648 -2.400 0.084 1.00 0.00 H new ATOM 0 HD11 LEU A 3 3.897 -1.458 2.354 1.00 0.00 H new ATOM 0 HD12 LEU A 3 3.045 -3.021 2.357 1.00 0.00 H new ATOM 0 HD13 LEU A 3 4.749 -2.935 2.863 1.00 0.00 H new ATOM 0 HD21 LEU A 3 5.606 -0.948 0.654 1.00 0.00 H new ATOM 0 HD22 LEU A 3 6.558 -2.406 1.022 1.00 0.00 H new ATOM 0 HD23 LEU A 3 5.991 -2.109 -0.639 1.00 0.00 H new ATOM 61 N LYS A 4 5.681 -6.873 -0.969 1.00 0.00 N ATOM 62 CA LYS A 4 5.630 -8.339 -0.873 1.00 0.00 C ATOM 63 C LYS A 4 5.181 -8.731 0.549 1.00 0.00 C ATOM 64 O LYS A 4 4.993 -7.850 1.390 1.00 0.00 O ATOM 65 CB LYS A 4 7.011 -8.951 -1.223 1.00 0.00 C ATOM 66 CG LYS A 4 8.139 -8.692 -0.192 1.00 0.00 C ATOM 67 CD LYS A 4 9.453 -9.456 -0.494 1.00 0.00 C ATOM 68 CE LYS A 4 10.058 -9.147 -1.872 1.00 0.00 C ATOM 69 NZ LYS A 4 11.368 -9.814 -2.057 1.00 0.00 N ATOM 0 H LYS A 4 6.587 -6.474 -0.724 1.00 0.00 H new ATOM 0 HA LYS A 4 4.910 -8.734 -1.590 1.00 0.00 H new ATOM 0 HB2 LYS A 4 6.892 -10.028 -1.341 1.00 0.00 H new ATOM 0 HB3 LYS A 4 7.329 -8.558 -2.189 1.00 0.00 H new ATOM 0 HG2 LYS A 4 8.351 -7.623 -0.160 1.00 0.00 H new ATOM 0 HG3 LYS A 4 7.785 -8.976 0.799 1.00 0.00 H new ATOM 0 HD2 LYS A 4 10.186 -9.213 0.275 1.00 0.00 H new ATOM 0 HD3 LYS A 4 9.262 -10.527 -0.425 1.00 0.00 H new ATOM 0 HE2 LYS A 4 9.370 -9.472 -2.653 1.00 0.00 H new ATOM 0 HE3 LYS A 4 10.179 -8.069 -1.983 1.00 0.00 H new ATOM 0 HZ1 LYS A 4 11.746 -9.583 -2.998 1.00 0.00 H new ATOM 0 HZ2 LYS A 4 12.031 -9.485 -1.327 1.00 0.00 H new ATOM 0 HZ3 LYS A 4 11.248 -10.844 -1.976 1.00 0.00 H new ATOM 83 N SER A 5 5.047 -10.040 0.814 1.00 0.00 N ATOM 84 CA SER A 5 4.601 -10.569 2.127 1.00 0.00 C ATOM 85 C SER A 5 5.506 -10.067 3.288 1.00 0.00 C ATOM 86 O SER A 5 5.020 -9.567 4.299 1.00 0.00 O ATOM 87 CB SER A 5 4.596 -12.111 2.078 1.00 0.00 C ATOM 88 OG SER A 5 3.894 -12.571 0.937 1.00 0.00 O ATOM 0 H SER A 5 5.243 -10.768 0.127 1.00 0.00 H new ATOM 0 HA SER A 5 3.593 -10.202 2.322 1.00 0.00 H new ATOM 0 HB2 SER A 5 5.620 -12.483 2.056 1.00 0.00 H new ATOM 0 HB3 SER A 5 4.132 -12.507 2.981 1.00 0.00 H new ATOM 0 HG SER A 5 4.503 -12.607 0.170 1.00 0.00 H new ATOM 94 N GLU A 6 6.824 -10.174 3.073 1.00 0.00 N ATOM 95 CA GLU A 6 7.871 -9.715 4.007 1.00 0.00 C ATOM 96 C GLU A 6 7.768 -8.204 4.253 1.00 0.00 C ATOM 97 O GLU A 6 7.653 -7.754 5.397 1.00 0.00 O ATOM 98 CB GLU A 6 9.264 -10.090 3.416 1.00 0.00 C ATOM 99 CG GLU A 6 10.511 -9.444 4.079 1.00 0.00 C ATOM 100 CD GLU A 6 10.766 -9.868 5.539 1.00 0.00 C ATOM 101 OE1 GLU A 6 11.413 -10.912 5.750 1.00 0.00 O ATOM 102 OE2 GLU A 6 10.319 -9.162 6.473 1.00 0.00 O ATOM 0 H GLU A 6 7.205 -10.592 2.224 1.00 0.00 H new ATOM 0 HA GLU A 6 7.738 -10.206 4.971 1.00 0.00 H new ATOM 0 HB2 GLU A 6 9.374 -11.173 3.471 1.00 0.00 H new ATOM 0 HB3 GLU A 6 9.266 -9.823 2.359 1.00 0.00 H new ATOM 0 HG2 GLU A 6 11.390 -9.694 3.485 1.00 0.00 H new ATOM 0 HG3 GLU A 6 10.401 -8.360 4.045 1.00 0.00 H new ATOM 109 N MET A 7 7.722 -7.452 3.150 1.00 0.00 N ATOM 110 CA MET A 7 7.840 -5.988 3.154 1.00 0.00 C ATOM 111 C MET A 7 6.551 -5.335 3.701 1.00 0.00 C ATOM 112 O MET A 7 6.592 -4.232 4.270 1.00 0.00 O ATOM 113 CB MET A 7 8.150 -5.509 1.713 1.00 0.00 C ATOM 114 CG MET A 7 8.542 -4.033 1.561 1.00 0.00 C ATOM 115 SD MET A 7 10.112 -3.611 2.361 1.00 0.00 S ATOM 116 CE MET A 7 9.581 -2.892 3.916 1.00 0.00 C ATOM 0 H MET A 7 7.600 -7.846 2.217 1.00 0.00 H new ATOM 0 HA MET A 7 8.654 -5.686 3.813 1.00 0.00 H new ATOM 0 HB2 MET A 7 8.959 -6.121 1.315 1.00 0.00 H new ATOM 0 HB3 MET A 7 7.273 -5.697 1.093 1.00 0.00 H new ATOM 0 HG2 MET A 7 8.608 -3.791 0.500 1.00 0.00 H new ATOM 0 HG3 MET A 7 7.752 -3.411 1.981 1.00 0.00 H new ATOM 0 HE1 MET A 7 10.043 -1.912 4.040 1.00 0.00 H new ATOM 0 HE2 MET A 7 8.496 -2.785 3.916 1.00 0.00 H new ATOM 0 HE3 MET A 7 9.881 -3.541 4.738 1.00 0.00 H new ATOM 126 N PHE A 8 5.415 -6.047 3.554 1.00 0.00 N ATOM 127 CA PHE A 8 4.106 -5.578 4.035 1.00 0.00 C ATOM 128 C PHE A 8 4.038 -5.695 5.556 1.00 0.00 C ATOM 129 O PHE A 8 3.541 -4.788 6.226 1.00 0.00 O ATOM 130 CB PHE A 8 2.932 -6.355 3.364 1.00 0.00 C ATOM 131 CG PHE A 8 1.556 -5.707 3.594 1.00 0.00 C ATOM 132 CD1 PHE A 8 1.072 -4.722 2.726 1.00 0.00 C ATOM 133 CD2 PHE A 8 0.762 -6.055 4.689 1.00 0.00 C ATOM 134 CE1 PHE A 8 -0.150 -4.109 2.947 1.00 0.00 C ATOM 135 CE2 PHE A 8 -0.459 -5.444 4.903 1.00 0.00 C ATOM 136 CZ PHE A 8 -0.916 -4.471 4.034 1.00 0.00 C ATOM 0 H PHE A 8 5.382 -6.960 3.100 1.00 0.00 H new ATOM 0 HA PHE A 8 3.998 -4.530 3.755 1.00 0.00 H new ATOM 0 HB2 PHE A 8 3.118 -6.423 2.292 1.00 0.00 H new ATOM 0 HB3 PHE A 8 2.914 -7.374 3.750 1.00 0.00 H new ATOM 0 HD1 PHE A 8 1.662 -4.435 1.868 1.00 0.00 H new ATOM 0 HD2 PHE A 8 1.107 -6.812 5.378 1.00 0.00 H new ATOM 0 HE1 PHE A 8 -0.503 -3.347 2.268 1.00 0.00 H new ATOM 0 HE2 PHE A 8 -1.060 -5.728 5.754 1.00 0.00 H new ATOM 0 HZ PHE A 8 -1.870 -3.996 4.206 1.00 0.00 H new ATOM 146 N VAL A 9 4.571 -6.808 6.086 1.00 0.00 N ATOM 147 CA VAL A 9 4.558 -7.070 7.543 1.00 0.00 C ATOM 148 C VAL A 9 5.585 -6.180 8.264 1.00 0.00 C ATOM 149 O VAL A 9 5.305 -5.658 9.347 1.00 0.00 O ATOM 150 CB VAL A 9 4.795 -8.582 7.895 1.00 0.00 C ATOM 151 CG1 VAL A 9 4.775 -8.818 9.414 1.00 0.00 C ATOM 152 CG2 VAL A 9 3.750 -9.469 7.206 1.00 0.00 C ATOM 0 H VAL A 9 5.016 -7.541 5.534 1.00 0.00 H new ATOM 0 HA VAL A 9 3.557 -6.819 7.895 1.00 0.00 H new ATOM 0 HB VAL A 9 5.784 -8.853 7.526 1.00 0.00 H new ATOM 0 HG11 VAL A 9 4.942 -9.875 9.620 1.00 0.00 H new ATOM 0 HG12 VAL A 9 5.561 -8.228 9.884 1.00 0.00 H new ATOM 0 HG13 VAL A 9 3.807 -8.519 9.816 1.00 0.00 H new ATOM 0 HG21 VAL A 9 3.932 -10.512 7.463 1.00 0.00 H new ATOM 0 HG22 VAL A 9 2.753 -9.182 7.539 1.00 0.00 H new ATOM 0 HG23 VAL A 9 3.822 -9.344 6.126 1.00 0.00 H new ATOM 162 N SER A 10 6.750 -5.976 7.620 1.00 0.00 N ATOM 163 CA SER A 10 7.802 -5.056 8.111 1.00 0.00 C ATOM 164 C SER A 10 7.228 -3.641 8.320 1.00 0.00 C ATOM 165 O SER A 10 7.546 -2.966 9.296 1.00 0.00 O ATOM 166 CB SER A 10 8.976 -5.011 7.112 1.00 0.00 C ATOM 167 OG SER A 10 9.570 -6.286 6.941 1.00 0.00 O ATOM 0 H SER A 10 6.991 -6.442 6.745 1.00 0.00 H new ATOM 0 HA SER A 10 8.167 -5.426 9.069 1.00 0.00 H new ATOM 0 HB2 SER A 10 8.620 -4.644 6.149 1.00 0.00 H new ATOM 0 HB3 SER A 10 9.727 -4.304 7.465 1.00 0.00 H new ATOM 0 HG SER A 10 8.971 -6.858 6.418 1.00 0.00 H new ATOM 173 N ALA A 11 6.354 -3.237 7.389 1.00 0.00 N ATOM 174 CA ALA A 11 5.615 -1.970 7.463 1.00 0.00 C ATOM 175 C ALA A 11 4.497 -2.034 8.526 1.00 0.00 C ATOM 176 O ALA A 11 4.319 -1.091 9.299 1.00 0.00 O ATOM 177 CB ALA A 11 5.032 -1.639 6.080 1.00 0.00 C ATOM 0 H ALA A 11 6.138 -3.785 6.556 1.00 0.00 H new ATOM 0 HA ALA A 11 6.303 -1.180 7.763 1.00 0.00 H new ATOM 0 HB1 ALA A 11 4.483 -0.699 6.132 1.00 0.00 H new ATOM 0 HB2 ALA A 11 5.842 -1.547 5.356 1.00 0.00 H new ATOM 0 HB3 ALA A 11 4.357 -2.437 5.769 1.00 0.00 H new ATOM 183 N LEU A 12 3.793 -3.189 8.569 1.00 0.00 N ATOM 184 CA LEU A 12 2.562 -3.403 9.375 1.00 0.00 C ATOM 185 C LEU A 12 2.832 -3.197 10.877 1.00 0.00 C ATOM 186 O LEU A 12 2.022 -2.573 11.578 1.00 0.00 O ATOM 187 CB LEU A 12 1.996 -4.834 9.097 1.00 0.00 C ATOM 188 CG LEU A 12 0.444 -5.043 9.212 1.00 0.00 C ATOM 189 CD1 LEU A 12 0.043 -6.415 8.625 1.00 0.00 C ATOM 190 CD2 LEU A 12 -0.083 -4.891 10.663 1.00 0.00 C ATOM 0 H LEU A 12 4.067 -4.015 8.036 1.00 0.00 H new ATOM 0 HA LEU A 12 1.818 -2.664 9.079 1.00 0.00 H new ATOM 0 HB2 LEU A 12 2.299 -5.124 8.091 1.00 0.00 H new ATOM 0 HB3 LEU A 12 2.479 -5.525 9.788 1.00 0.00 H new ATOM 0 HG LEU A 12 -0.026 -4.250 8.630 1.00 0.00 H new ATOM 0 HD11 LEU A 12 -1.036 -6.547 8.711 1.00 0.00 H new ATOM 0 HD12 LEU A 12 0.331 -6.460 7.575 1.00 0.00 H new ATOM 0 HD13 LEU A 12 0.550 -7.208 9.174 1.00 0.00 H new ATOM 0 HD21 LEU A 12 -1.162 -5.047 10.676 1.00 0.00 H new ATOM 0 HD22 LEU A 12 0.398 -5.630 11.304 1.00 0.00 H new ATOM 0 HD23 LEU A 12 0.144 -3.890 11.029 1.00 0.00 H new ATOM 202 N ILE A 13 3.981 -3.724 11.347 1.00 0.00 N ATOM 203 CA ILE A 13 4.442 -3.550 12.738 1.00 0.00 C ATOM 204 C ILE A 13 4.491 -2.039 13.090 1.00 0.00 C ATOM 205 O ILE A 13 3.851 -1.598 14.042 1.00 0.00 O ATOM 206 CB ILE A 13 5.847 -4.285 13.000 1.00 0.00 C ATOM 207 CG1 ILE A 13 5.670 -5.815 13.321 1.00 0.00 C ATOM 208 CG2 ILE A 13 6.671 -3.633 14.141 1.00 0.00 C ATOM 209 CD1 ILE A 13 4.906 -6.628 12.309 1.00 0.00 C ATOM 0 H ILE A 13 4.614 -4.281 10.773 1.00 0.00 H new ATOM 0 HA ILE A 13 3.726 -4.030 13.405 1.00 0.00 H new ATOM 0 HB ILE A 13 6.395 -4.171 12.065 1.00 0.00 H new ATOM 0 HG12 ILE A 13 6.660 -6.256 13.437 1.00 0.00 H new ATOM 0 HG13 ILE A 13 5.166 -5.906 14.283 1.00 0.00 H new ATOM 0 HG21 ILE A 13 7.608 -4.175 14.269 1.00 0.00 H new ATOM 0 HG22 ILE A 13 6.884 -2.594 13.888 1.00 0.00 H new ATOM 0 HG23 ILE A 13 6.101 -3.671 15.069 1.00 0.00 H new ATOM 0 HD11 ILE A 13 4.851 -7.665 12.642 1.00 0.00 H new ATOM 0 HD12 ILE A 13 3.898 -6.226 12.206 1.00 0.00 H new ATOM 0 HD13 ILE A 13 5.415 -6.582 11.346 1.00 0.00 H new ATOM 221 N ARG A 14 5.150 -1.244 12.231 1.00 0.00 N ATOM 222 CA ARG A 14 5.352 0.208 12.471 1.00 0.00 C ATOM 223 C ARG A 14 4.035 0.996 12.286 1.00 0.00 C ATOM 224 O ARG A 14 3.893 2.087 12.848 1.00 0.00 O ATOM 225 CB ARG A 14 6.478 0.800 11.569 1.00 0.00 C ATOM 226 CG ARG A 14 7.929 0.391 11.952 1.00 0.00 C ATOM 227 CD ARG A 14 8.239 -1.086 11.686 1.00 0.00 C ATOM 228 NE ARG A 14 9.648 -1.423 11.964 1.00 0.00 N ATOM 229 CZ ARG A 14 10.558 -1.822 11.051 1.00 0.00 C ATOM 230 NH1 ARG A 14 10.224 -1.966 9.773 1.00 0.00 N ATOM 231 NH2 ARG A 14 11.794 -2.090 11.436 1.00 0.00 N ATOM 0 H ARG A 14 5.557 -1.578 11.357 1.00 0.00 H new ATOM 0 HA ARG A 14 5.673 0.314 13.507 1.00 0.00 H new ATOM 0 HB2 ARG A 14 6.293 0.494 10.539 1.00 0.00 H new ATOM 0 HB3 ARG A 14 6.407 1.887 11.596 1.00 0.00 H new ATOM 0 HG2 ARG A 14 8.632 1.008 11.392 1.00 0.00 H new ATOM 0 HG3 ARG A 14 8.091 0.603 13.009 1.00 0.00 H new ATOM 0 HD2 ARG A 14 7.591 -1.708 12.304 1.00 0.00 H new ATOM 0 HD3 ARG A 14 8.010 -1.321 10.647 1.00 0.00 H new ATOM 0 HE ARG A 14 9.962 -1.348 12.932 1.00 0.00 H new ATOM 0 HH11 ARG A 14 9.269 -1.774 9.471 1.00 0.00 H new ATOM 0 HH12 ARG A 14 10.923 -2.268 9.094 1.00 0.00 H new ATOM 0 HH21 ARG A 14 12.054 -1.995 12.418 1.00 0.00 H new ATOM 0 HH22 ARG A 14 12.487 -2.392 10.751 1.00 0.00 H new ATOM 245 N ARG A 15 3.092 0.445 11.481 1.00 0.00 N ATOM 246 CA ARG A 15 1.747 1.029 11.294 1.00 0.00 C ATOM 247 C ARG A 15 0.978 1.082 12.625 1.00 0.00 C ATOM 248 O ARG A 15 0.349 2.098 12.952 1.00 0.00 O ATOM 249 CB ARG A 15 0.917 0.222 10.252 1.00 0.00 C ATOM 250 CG ARG A 15 1.405 0.323 8.792 1.00 0.00 C ATOM 251 CD ARG A 15 0.487 -0.435 7.808 1.00 0.00 C ATOM 252 NE ARG A 15 0.883 -0.241 6.402 1.00 0.00 N ATOM 253 CZ ARG A 15 0.190 -0.694 5.343 1.00 0.00 C ATOM 254 NH1 ARG A 15 -0.933 -1.388 5.506 1.00 0.00 N ATOM 255 NH2 ARG A 15 0.614 -0.428 4.120 1.00 0.00 N ATOM 0 H ARG A 15 3.245 -0.411 10.948 1.00 0.00 H new ATOM 0 HA ARG A 15 1.889 2.043 10.921 1.00 0.00 H new ATOM 0 HB2 ARG A 15 0.920 -0.828 10.546 1.00 0.00 H new ATOM 0 HB3 ARG A 15 -0.118 0.562 10.295 1.00 0.00 H new ATOM 0 HG2 ARG A 15 1.456 1.372 8.501 1.00 0.00 H new ATOM 0 HG3 ARG A 15 2.417 -0.077 8.722 1.00 0.00 H new ATOM 0 HD2 ARG A 15 0.507 -1.499 8.044 1.00 0.00 H new ATOM 0 HD3 ARG A 15 -0.541 -0.098 7.942 1.00 0.00 H new ATOM 0 HE ARG A 15 1.744 0.274 6.219 1.00 0.00 H new ATOM 0 HH11 ARG A 15 -1.280 -1.583 6.445 1.00 0.00 H new ATOM 0 HH12 ARG A 15 -1.447 -1.725 4.692 1.00 0.00 H new ATOM 0 HH21 ARG A 15 1.464 0.119 3.983 1.00 0.00 H new ATOM 0 HH22 ARG A 15 0.091 -0.770 3.313 1.00 0.00 H new ATOM 269 N VAL A 16 1.028 -0.026 13.391 1.00 0.00 N ATOM 270 CA VAL A 16 0.290 -0.127 14.663 1.00 0.00 C ATOM 271 C VAL A 16 0.983 0.706 15.761 1.00 0.00 C ATOM 272 O VAL A 16 0.315 1.291 16.601 1.00 0.00 O ATOM 273 CB VAL A 16 0.076 -1.618 15.136 1.00 0.00 C ATOM 274 CG1 VAL A 16 -0.366 -2.528 13.963 1.00 0.00 C ATOM 275 CG2 VAL A 16 1.310 -2.193 15.840 1.00 0.00 C ATOM 0 H VAL A 16 1.568 -0.858 13.152 1.00 0.00 H new ATOM 0 HA VAL A 16 -0.704 0.283 14.482 1.00 0.00 H new ATOM 0 HB VAL A 16 -0.729 -1.596 15.870 1.00 0.00 H new ATOM 0 HG11 VAL A 16 -0.504 -3.547 14.325 1.00 0.00 H new ATOM 0 HG12 VAL A 16 -1.305 -2.159 13.550 1.00 0.00 H new ATOM 0 HG13 VAL A 16 0.400 -2.519 13.187 1.00 0.00 H new ATOM 0 HG21 VAL A 16 1.109 -3.220 16.145 1.00 0.00 H new ATOM 0 HG22 VAL A 16 2.159 -2.176 15.157 1.00 0.00 H new ATOM 0 HG23 VAL A 16 1.540 -1.592 16.720 1.00 0.00 H new ATOM 285 N PHE A 17 2.332 0.758 15.725 1.00 0.00 N ATOM 286 CA PHE A 17 3.138 1.579 16.655 1.00 0.00 C ATOM 287 C PHE A 17 2.924 3.083 16.377 1.00 0.00 C ATOM 288 O PHE A 17 3.031 3.910 17.288 1.00 0.00 O ATOM 289 CB PHE A 17 4.642 1.176 16.594 1.00 0.00 C ATOM 290 CG PHE A 17 4.974 -0.114 17.360 1.00 0.00 C ATOM 291 CD1 PHE A 17 5.019 -0.114 18.754 1.00 0.00 C ATOM 292 CD2 PHE A 17 5.208 -1.322 16.705 1.00 0.00 C ATOM 293 CE1 PHE A 17 5.308 -1.269 19.455 1.00 0.00 C ATOM 294 CE2 PHE A 17 5.494 -2.478 17.411 1.00 0.00 C ATOM 295 CZ PHE A 17 5.535 -2.452 18.785 1.00 0.00 C ATOM 0 H PHE A 17 2.892 0.234 15.053 1.00 0.00 H new ATOM 0 HA PHE A 17 2.800 1.387 17.673 1.00 0.00 H new ATOM 0 HB2 PHE A 17 4.932 1.052 15.551 1.00 0.00 H new ATOM 0 HB3 PHE A 17 5.243 1.991 16.998 1.00 0.00 H new ATOM 0 HD1 PHE A 17 4.825 0.802 19.293 1.00 0.00 H new ATOM 0 HD2 PHE A 17 5.165 -1.357 15.626 1.00 0.00 H new ATOM 0 HE1 PHE A 17 5.356 -1.245 20.534 1.00 0.00 H new ATOM 0 HE2 PHE A 17 5.685 -3.400 16.882 1.00 0.00 H new ATOM 0 HZ PHE A 17 5.744 -3.356 19.338 1.00 0.00 H new ATOM 305 N ALA A 18 2.602 3.421 15.111 1.00 0.00 N ATOM 306 CA ALA A 18 2.186 4.789 14.721 1.00 0.00 C ATOM 307 C ALA A 18 0.830 5.159 15.377 1.00 0.00 C ATOM 308 O ALA A 18 0.561 6.335 15.649 1.00 0.00 O ATOM 309 CB ALA A 18 2.105 4.914 13.188 1.00 0.00 C ATOM 0 H ALA A 18 2.622 2.761 14.334 1.00 0.00 H new ATOM 0 HA ALA A 18 2.938 5.491 15.081 1.00 0.00 H new ATOM 0 HB1 ALA A 18 1.798 5.925 12.921 1.00 0.00 H new ATOM 0 HB2 ALA A 18 3.083 4.705 12.754 1.00 0.00 H new ATOM 0 HB3 ALA A 18 1.377 4.200 12.803 1.00 0.00 H new ATOM 315 N ALA A 19 -0.012 4.131 15.610 1.00 0.00 N ATOM 316 CA ALA A 19 -1.314 4.273 16.303 1.00 0.00 C ATOM 317 C ALA A 19 -1.154 4.174 17.840 1.00 0.00 C ATOM 318 O ALA A 19 -2.037 4.603 18.588 1.00 0.00 O ATOM 319 CB ALA A 19 -2.298 3.211 15.788 1.00 0.00 C ATOM 0 H ALA A 19 0.191 3.174 15.322 1.00 0.00 H new ATOM 0 HA ALA A 19 -1.712 5.264 16.082 1.00 0.00 H new ATOM 0 HB1 ALA A 19 -3.253 3.321 16.301 1.00 0.00 H new ATOM 0 HB2 ALA A 19 -2.445 3.341 14.716 1.00 0.00 H new ATOM 0 HB3 ALA A 19 -1.894 2.217 15.981 1.00 0.00 H new ATOM 325 N GLY A 20 -0.025 3.599 18.296 1.00 0.00 N ATOM 326 CA GLY A 20 0.272 3.447 19.730 1.00 0.00 C ATOM 327 C GLY A 20 0.045 2.032 20.255 1.00 0.00 C ATOM 328 O GLY A 20 0.167 1.790 21.462 1.00 0.00 O ATOM 0 H GLY A 20 0.702 3.229 17.683 1.00 0.00 H new ATOM 0 HA2 GLY A 20 1.309 3.730 19.910 1.00 0.00 H new ATOM 0 HA3 GLY A 20 -0.350 4.140 20.297 1.00 0.00 H new ATOM 332 N GLY A 21 -0.304 1.102 19.351 1.00 0.00 N ATOM 333 CA GLY A 21 -0.458 -0.317 19.680 1.00 0.00 C ATOM 334 C GLY A 21 0.871 -1.079 19.716 1.00 0.00 C ATOM 335 O GLY A 21 1.945 -0.478 19.826 1.00 0.00 O ATOM 0 H GLY A 21 -0.487 1.318 18.371 1.00 0.00 H new ATOM 0 HA2 GLY A 21 -0.947 -0.407 20.650 1.00 0.00 H new ATOM 0 HA3 GLY A 21 -1.116 -0.783 18.947 1.00 0.00 H new ATOM 339 N PHE A 22 0.785 -2.410 19.603 1.00 0.00 N ATOM 340 CA PHE A 22 1.943 -3.335 19.656 1.00 0.00 C ATOM 341 C PHE A 22 1.836 -4.325 18.491 1.00 0.00 C ATOM 342 O PHE A 22 0.741 -4.545 17.982 1.00 0.00 O ATOM 343 CB PHE A 22 1.971 -4.080 21.024 1.00 0.00 C ATOM 344 CG PHE A 22 3.064 -5.148 21.151 1.00 0.00 C ATOM 345 CD1 PHE A 22 4.398 -4.785 21.343 1.00 0.00 C ATOM 346 CD2 PHE A 22 2.761 -6.512 21.057 1.00 0.00 C ATOM 347 CE1 PHE A 22 5.390 -5.745 21.429 1.00 0.00 C ATOM 348 CE2 PHE A 22 3.754 -7.470 21.148 1.00 0.00 C ATOM 349 CZ PHE A 22 5.068 -7.086 21.337 1.00 0.00 C ATOM 0 H PHE A 22 -0.104 -2.891 19.469 1.00 0.00 H new ATOM 0 HA PHE A 22 2.874 -2.776 19.564 1.00 0.00 H new ATOM 0 HB2 PHE A 22 2.105 -3.346 21.819 1.00 0.00 H new ATOM 0 HB3 PHE A 22 1.001 -4.551 21.185 1.00 0.00 H new ATOM 0 HD1 PHE A 22 4.659 -3.740 21.426 1.00 0.00 H new ATOM 0 HD2 PHE A 22 1.736 -6.820 20.911 1.00 0.00 H new ATOM 0 HE1 PHE A 22 6.418 -5.446 21.568 1.00 0.00 H new ATOM 0 HE2 PHE A 22 3.503 -8.518 21.071 1.00 0.00 H new ATOM 0 HZ PHE A 22 5.843 -7.834 21.413 1.00 0.00 H new ATOM 359 N ALA A 23 2.975 -4.891 18.051 1.00 0.00 N ATOM 360 CA ALA A 23 3.001 -5.917 16.993 1.00 0.00 C ATOM 361 C ALA A 23 4.264 -6.763 17.076 1.00 0.00 C ATOM 362 O ALA A 23 5.281 -6.321 17.630 1.00 0.00 O ATOM 363 CB ALA A 23 2.892 -5.287 15.603 1.00 0.00 C ATOM 0 H ALA A 23 3.897 -4.652 18.416 1.00 0.00 H new ATOM 0 HA ALA A 23 2.136 -6.561 17.152 1.00 0.00 H new ATOM 0 HB1 ALA A 23 2.914 -6.071 14.846 1.00 0.00 H new ATOM 0 HB2 ALA A 23 1.955 -4.735 15.526 1.00 0.00 H new ATOM 0 HB3 ALA A 23 3.729 -4.606 15.445 1.00 0.00 H new ATOM 369 N ALA A 24 4.187 -7.971 16.484 1.00 0.00 N ATOM 370 CA ALA A 24 5.299 -8.928 16.442 1.00 0.00 C ATOM 371 C ALA A 24 4.967 -10.070 15.471 1.00 0.00 C ATOM 372 O ALA A 24 3.886 -10.673 15.556 1.00 0.00 O ATOM 373 CB ALA A 24 5.615 -9.476 17.850 1.00 0.00 C ATOM 0 H ALA A 24 3.344 -8.308 16.020 1.00 0.00 H new ATOM 0 HA ALA A 24 6.190 -8.411 16.085 1.00 0.00 H new ATOM 0 HB1 ALA A 24 6.443 -10.182 17.788 1.00 0.00 H new ATOM 0 HB2 ALA A 24 5.890 -8.652 18.508 1.00 0.00 H new ATOM 0 HB3 ALA A 24 4.736 -9.981 18.249 1.00 0.00 H new ATOM 379 N VAL A 25 5.901 -10.344 14.543 1.00 0.00 N ATOM 380 CA VAL A 25 5.769 -11.435 13.560 1.00 0.00 C ATOM 381 C VAL A 25 5.998 -12.790 14.272 1.00 0.00 C ATOM 382 O VAL A 25 7.146 -13.159 14.558 1.00 0.00 O ATOM 383 CB VAL A 25 6.790 -11.281 12.353 1.00 0.00 C ATOM 384 CG1 VAL A 25 6.383 -12.175 11.158 1.00 0.00 C ATOM 385 CG2 VAL A 25 6.963 -9.801 11.932 1.00 0.00 C ATOM 0 H VAL A 25 6.769 -9.816 14.453 1.00 0.00 H new ATOM 0 HA VAL A 25 4.764 -11.391 13.141 1.00 0.00 H new ATOM 0 HB VAL A 25 7.764 -11.625 12.702 1.00 0.00 H new ATOM 0 HG11 VAL A 25 7.101 -12.048 10.347 1.00 0.00 H new ATOM 0 HG12 VAL A 25 6.371 -13.219 11.472 1.00 0.00 H new ATOM 0 HG13 VAL A 25 5.390 -11.889 10.811 1.00 0.00 H new ATOM 0 HG21 VAL A 25 7.669 -9.738 11.104 1.00 0.00 H new ATOM 0 HG22 VAL A 25 6.000 -9.397 11.619 1.00 0.00 H new ATOM 0 HG23 VAL A 25 7.342 -9.225 12.776 1.00 0.00 H new ATOM 395 N GLU A 26 4.898 -13.482 14.608 1.00 0.00 N ATOM 396 CA GLU A 26 4.931 -14.787 15.298 1.00 0.00 C ATOM 397 C GLU A 26 5.497 -15.888 14.386 1.00 0.00 C ATOM 398 O GLU A 26 6.426 -16.604 14.774 1.00 0.00 O ATOM 399 CB GLU A 26 3.510 -15.178 15.770 1.00 0.00 C ATOM 400 CG GLU A 26 2.878 -14.182 16.754 1.00 0.00 C ATOM 401 CD GLU A 26 1.468 -14.608 17.179 1.00 0.00 C ATOM 402 OE1 GLU A 26 1.338 -15.454 18.093 1.00 0.00 O ATOM 403 OE2 GLU A 26 0.491 -14.117 16.598 1.00 0.00 O ATOM 0 H GLU A 26 3.954 -13.152 14.409 1.00 0.00 H new ATOM 0 HA GLU A 26 5.587 -14.690 16.163 1.00 0.00 H new ATOM 0 HB2 GLU A 26 2.862 -15.271 14.898 1.00 0.00 H new ATOM 0 HB3 GLU A 26 3.553 -16.160 16.241 1.00 0.00 H new ATOM 0 HG2 GLU A 26 3.511 -14.094 17.637 1.00 0.00 H new ATOM 0 HG3 GLU A 26 2.835 -13.195 16.293 1.00 0.00 H new ATOM 410 N LYS A 27 4.925 -16.006 13.177 1.00 0.00 N ATOM 411 CA LYS A 27 5.332 -17.014 12.182 1.00 0.00 C ATOM 412 C LYS A 27 5.852 -16.309 10.924 1.00 0.00 C ATOM 413 O LYS A 27 5.354 -15.239 10.556 1.00 0.00 O ATOM 414 CB LYS A 27 4.133 -17.929 11.826 1.00 0.00 C ATOM 415 CG LYS A 27 4.482 -19.135 10.931 1.00 0.00 C ATOM 416 CD LYS A 27 3.245 -19.976 10.528 1.00 0.00 C ATOM 417 CE LYS A 27 3.631 -21.361 9.975 1.00 0.00 C ATOM 418 NZ LYS A 27 4.688 -21.269 8.937 1.00 0.00 N ATOM 0 H LYS A 27 4.165 -15.404 12.860 1.00 0.00 H new ATOM 0 HA LYS A 27 6.126 -17.632 12.601 1.00 0.00 H new ATOM 0 HB2 LYS A 27 3.688 -18.297 12.751 1.00 0.00 H new ATOM 0 HB3 LYS A 27 3.374 -17.330 11.324 1.00 0.00 H new ATOM 0 HG2 LYS A 27 4.979 -18.778 10.029 1.00 0.00 H new ATOM 0 HG3 LYS A 27 5.192 -19.774 11.455 1.00 0.00 H new ATOM 0 HD2 LYS A 27 2.597 -20.102 11.395 1.00 0.00 H new ATOM 0 HD3 LYS A 27 2.670 -19.435 9.776 1.00 0.00 H new ATOM 0 HE2 LYS A 27 3.979 -21.994 10.792 1.00 0.00 H new ATOM 0 HE3 LYS A 27 2.749 -21.842 9.553 1.00 0.00 H new ATOM 0 HZ1 LYS A 27 4.955 -22.225 8.627 1.00 0.00 H new ATOM 0 HZ2 LYS A 27 4.330 -20.729 8.124 1.00 0.00 H new ATOM 0 HZ3 LYS A 27 5.521 -20.788 9.332 1.00 0.00 H new ATOM 432 N LYS A 28 6.827 -16.938 10.256 1.00 0.00 N ATOM 433 CA LYS A 28 7.501 -16.377 9.075 1.00 0.00 C ATOM 434 C LYS A 28 7.537 -17.450 7.971 1.00 0.00 C ATOM 435 O LYS A 28 8.099 -18.535 8.179 1.00 0.00 O ATOM 436 CB LYS A 28 8.939 -15.925 9.468 1.00 0.00 C ATOM 437 CG LYS A 28 9.641 -15.026 8.429 1.00 0.00 C ATOM 438 CD LYS A 28 11.078 -14.615 8.854 1.00 0.00 C ATOM 439 CE LYS A 28 11.628 -13.419 8.048 1.00 0.00 C ATOM 440 NZ LYS A 28 11.648 -13.661 6.586 1.00 0.00 N ATOM 0 H LYS A 28 7.175 -17.859 10.521 1.00 0.00 H new ATOM 0 HA LYS A 28 6.962 -15.507 8.701 1.00 0.00 H new ATOM 0 HB2 LYS A 28 8.890 -15.390 10.417 1.00 0.00 H new ATOM 0 HB3 LYS A 28 9.551 -16.812 9.633 1.00 0.00 H new ATOM 0 HG2 LYS A 28 9.686 -15.550 7.475 1.00 0.00 H new ATOM 0 HG3 LYS A 28 9.044 -14.128 8.271 1.00 0.00 H new ATOM 0 HD2 LYS A 28 11.079 -14.362 9.914 1.00 0.00 H new ATOM 0 HD3 LYS A 28 11.745 -15.468 8.729 1.00 0.00 H new ATOM 0 HE2 LYS A 28 11.020 -12.539 8.256 1.00 0.00 H new ATOM 0 HE3 LYS A 28 12.640 -13.195 8.387 1.00 0.00 H new ATOM 0 HZ1 LYS A 28 11.814 -12.763 6.088 1.00 0.00 H new ATOM 0 HZ2 LYS A 28 12.410 -14.331 6.355 1.00 0.00 H new ATOM 0 HZ3 LYS A 28 10.735 -14.059 6.288 1.00 0.00 H new ATOM 454 N GLY A 29 6.913 -17.151 6.818 1.00 0.00 N ATOM 455 CA GLY A 29 6.837 -18.083 5.688 1.00 0.00 C ATOM 456 C GLY A 29 7.638 -17.607 4.483 1.00 0.00 C ATOM 457 O GLY A 29 8.839 -17.368 4.602 1.00 0.00 O ATOM 0 H GLY A 29 6.450 -16.258 6.647 1.00 0.00 H new ATOM 0 HA2 GLY A 29 7.205 -19.060 6.002 1.00 0.00 H new ATOM 0 HA3 GLY A 29 5.794 -18.213 5.398 1.00 0.00 H new ATOM 461 N ALA A 30 6.970 -17.459 3.319 1.00 0.00 N ATOM 462 CA ALA A 30 7.613 -17.030 2.061 1.00 0.00 C ATOM 463 C ALA A 30 7.584 -15.496 1.938 1.00 0.00 C ATOM 464 O ALA A 30 6.516 -14.887 2.038 1.00 0.00 O ATOM 465 CB ALA A 30 6.919 -17.687 0.854 1.00 0.00 C ATOM 0 H ALA A 30 5.969 -17.634 3.226 1.00 0.00 H new ATOM 0 HA ALA A 30 8.654 -17.351 2.075 1.00 0.00 H new ATOM 0 HB1 ALA A 30 7.404 -17.361 -0.066 1.00 0.00 H new ATOM 0 HB2 ALA A 30 6.992 -18.771 0.938 1.00 0.00 H new ATOM 0 HB3 ALA A 30 5.869 -17.394 0.834 1.00 0.00 H new ATOM 471 N GLU A 31 8.766 -14.895 1.717 1.00 0.00 N ATOM 472 CA GLU A 31 8.956 -13.433 1.663 1.00 0.00 C ATOM 473 C GLU A 31 8.128 -12.773 0.545 1.00 0.00 C ATOM 474 O GLU A 31 7.437 -11.797 0.775 1.00 0.00 O ATOM 475 CB GLU A 31 10.461 -13.111 1.477 1.00 0.00 C ATOM 476 CG GLU A 31 11.351 -13.542 2.666 1.00 0.00 C ATOM 477 CD GLU A 31 12.852 -13.488 2.345 1.00 0.00 C ATOM 478 OE1 GLU A 31 13.426 -12.380 2.313 1.00 0.00 O ATOM 479 OE2 GLU A 31 13.461 -14.552 2.099 1.00 0.00 O ATOM 0 H GLU A 31 9.629 -15.418 1.569 1.00 0.00 H new ATOM 0 HA GLU A 31 8.601 -13.019 2.607 1.00 0.00 H new ATOM 0 HB2 GLU A 31 10.818 -13.604 0.573 1.00 0.00 H new ATOM 0 HB3 GLU A 31 10.575 -12.038 1.322 1.00 0.00 H new ATOM 0 HG2 GLU A 31 11.145 -12.896 3.520 1.00 0.00 H new ATOM 0 HG3 GLU A 31 11.085 -14.557 2.962 1.00 0.00 H new ATOM 486 N ALA A 32 8.228 -13.300 -0.667 1.00 0.00 N ATOM 487 CA ALA A 32 7.527 -12.756 -1.844 1.00 0.00 C ATOM 488 C ALA A 32 6.125 -13.375 -1.996 1.00 0.00 C ATOM 489 O ALA A 32 5.107 -12.681 -1.862 1.00 0.00 O ATOM 490 CB ALA A 32 8.379 -12.978 -3.104 1.00 0.00 C ATOM 0 H ALA A 32 8.798 -14.121 -0.873 1.00 0.00 H new ATOM 0 HA ALA A 32 7.387 -11.684 -1.704 1.00 0.00 H new ATOM 0 HB1 ALA A 32 7.857 -12.574 -3.972 1.00 0.00 H new ATOM 0 HB2 ALA A 32 9.337 -12.472 -2.989 1.00 0.00 H new ATOM 0 HB3 ALA A 32 8.547 -14.046 -3.246 1.00 0.00 H new ATOM 496 N ALA A 33 6.091 -14.702 -2.203 1.00 0.00 N ATOM 497 CA ALA A 33 4.882 -15.428 -2.659 1.00 0.00 C ATOM 498 C ALA A 33 3.975 -15.912 -1.501 1.00 0.00 C ATOM 499 O ALA A 33 2.969 -16.586 -1.760 1.00 0.00 O ATOM 500 CB ALA A 33 5.317 -16.611 -3.549 1.00 0.00 C ATOM 0 H ALA A 33 6.900 -15.307 -2.060 1.00 0.00 H new ATOM 0 HA ALA A 33 4.273 -14.726 -3.229 1.00 0.00 H new ATOM 0 HB1 ALA A 33 4.435 -17.153 -3.891 1.00 0.00 H new ATOM 0 HB2 ALA A 33 5.868 -16.235 -4.411 1.00 0.00 H new ATOM 0 HB3 ALA A 33 5.956 -17.282 -2.975 1.00 0.00 H new ATOM 506 N GLY A 34 4.320 -15.559 -0.243 1.00 0.00 N ATOM 507 CA GLY A 34 3.586 -16.044 0.943 1.00 0.00 C ATOM 508 C GLY A 34 2.219 -15.393 1.154 1.00 0.00 C ATOM 509 O GLY A 34 1.822 -14.484 0.413 1.00 0.00 O ATOM 0 H GLY A 34 5.101 -14.941 -0.025 1.00 0.00 H new ATOM 0 HA2 GLY A 34 3.451 -17.122 0.855 1.00 0.00 H new ATOM 0 HA3 GLY A 34 4.197 -15.871 1.829 1.00 0.00 H new ATOM 513 N ALA A 35 1.485 -15.899 2.159 1.00 0.00 N ATOM 514 CA ALA A 35 0.215 -15.309 2.629 1.00 0.00 C ATOM 515 C ALA A 35 0.462 -14.586 3.959 1.00 0.00 C ATOM 516 O ALA A 35 1.482 -14.824 4.608 1.00 0.00 O ATOM 517 CB ALA A 35 -0.858 -16.403 2.786 1.00 0.00 C ATOM 0 H ALA A 35 1.757 -16.736 2.674 1.00 0.00 H new ATOM 0 HA ALA A 35 -0.150 -14.590 1.896 1.00 0.00 H new ATOM 0 HB1 ALA A 35 -1.788 -15.953 3.133 1.00 0.00 H new ATOM 0 HB2 ALA A 35 -1.026 -16.888 1.825 1.00 0.00 H new ATOM 0 HB3 ALA A 35 -0.520 -17.143 3.512 1.00 0.00 H new ATOM 523 N ILE A 36 -0.461 -13.690 4.359 1.00 0.00 N ATOM 524 CA ILE A 36 -0.337 -12.913 5.611 1.00 0.00 C ATOM 525 C ILE A 36 -1.640 -13.026 6.409 1.00 0.00 C ATOM 526 O ILE A 36 -2.685 -12.538 5.966 1.00 0.00 O ATOM 527 CB ILE A 36 -0.035 -11.386 5.348 1.00 0.00 C ATOM 528 CG1 ILE A 36 1.191 -11.185 4.405 1.00 0.00 C ATOM 529 CG2 ILE A 36 0.172 -10.619 6.685 1.00 0.00 C ATOM 530 CD1 ILE A 36 2.484 -11.774 4.933 1.00 0.00 C ATOM 0 H ILE A 36 -1.308 -13.484 3.829 1.00 0.00 H new ATOM 0 HA ILE A 36 0.503 -13.329 6.168 1.00 0.00 H new ATOM 0 HB ILE A 36 -0.908 -10.972 4.842 1.00 0.00 H new ATOM 0 HG12 ILE A 36 0.968 -11.635 3.437 1.00 0.00 H new ATOM 0 HG13 ILE A 36 1.334 -10.118 4.235 1.00 0.00 H new ATOM 0 HG21 ILE A 36 0.378 -9.570 6.474 1.00 0.00 H new ATOM 0 HG22 ILE A 36 -0.730 -10.697 7.292 1.00 0.00 H new ATOM 0 HG23 ILE A 36 1.013 -11.052 7.227 1.00 0.00 H new ATOM 0 HD11 ILE A 36 3.286 -11.591 4.218 1.00 0.00 H new ATOM 0 HD12 ILE A 36 2.734 -11.307 5.886 1.00 0.00 H new ATOM 0 HD13 ILE A 36 2.363 -12.848 5.075 1.00 0.00 H new ATOM 542 N PHE A 37 -1.575 -13.700 7.565 1.00 0.00 N ATOM 543 CA PHE A 37 -2.688 -13.794 8.512 1.00 0.00 C ATOM 544 C PHE A 37 -2.323 -13.064 9.808 1.00 0.00 C ATOM 545 O PHE A 37 -1.421 -13.471 10.544 1.00 0.00 O ATOM 546 CB PHE A 37 -3.074 -15.273 8.762 1.00 0.00 C ATOM 547 CG PHE A 37 -3.760 -15.897 7.552 1.00 0.00 C ATOM 548 CD1 PHE A 37 -3.013 -16.387 6.485 1.00 0.00 C ATOM 549 CD2 PHE A 37 -5.151 -15.943 7.462 1.00 0.00 C ATOM 550 CE1 PHE A 37 -3.632 -16.896 5.368 1.00 0.00 C ATOM 551 CE2 PHE A 37 -5.768 -16.464 6.345 1.00 0.00 C ATOM 552 CZ PHE A 37 -5.006 -16.939 5.299 1.00 0.00 C ATOM 0 H PHE A 37 -0.739 -14.199 7.870 1.00 0.00 H new ATOM 0 HA PHE A 37 -3.567 -13.308 8.089 1.00 0.00 H new ATOM 0 HB2 PHE A 37 -2.179 -15.845 9.006 1.00 0.00 H new ATOM 0 HB3 PHE A 37 -3.736 -15.334 9.626 1.00 0.00 H new ATOM 0 HD1 PHE A 37 -1.934 -16.367 6.535 1.00 0.00 H new ATOM 0 HD2 PHE A 37 -5.751 -15.566 8.277 1.00 0.00 H new ATOM 0 HE1 PHE A 37 -3.039 -17.263 4.543 1.00 0.00 H new ATOM 0 HE2 PHE A 37 -6.846 -16.500 6.289 1.00 0.00 H new ATOM 0 HZ PHE A 37 -5.489 -17.346 4.423 1.00 0.00 H new ATOM 562 N VAL A 38 -3.053 -11.975 10.059 1.00 0.00 N ATOM 563 CA VAL A 38 -2.830 -11.069 11.192 1.00 0.00 C ATOM 564 C VAL A 38 -3.963 -11.265 12.201 1.00 0.00 C ATOM 565 O VAL A 38 -5.112 -11.435 11.819 1.00 0.00 O ATOM 566 CB VAL A 38 -2.800 -9.564 10.717 1.00 0.00 C ATOM 567 CG1 VAL A 38 -2.467 -8.603 11.881 1.00 0.00 C ATOM 568 CG2 VAL A 38 -1.812 -9.368 9.550 1.00 0.00 C ATOM 0 H VAL A 38 -3.834 -11.691 9.468 1.00 0.00 H new ATOM 0 HA VAL A 38 -1.867 -11.298 11.648 1.00 0.00 H new ATOM 0 HB VAL A 38 -3.801 -9.319 10.362 1.00 0.00 H new ATOM 0 HG11 VAL A 38 -2.456 -7.577 11.514 1.00 0.00 H new ATOM 0 HG12 VAL A 38 -3.222 -8.701 12.661 1.00 0.00 H new ATOM 0 HG13 VAL A 38 -1.488 -8.853 12.290 1.00 0.00 H new ATOM 0 HG21 VAL A 38 -1.813 -8.322 9.244 1.00 0.00 H new ATOM 0 HG22 VAL A 38 -0.809 -9.651 9.871 1.00 0.00 H new ATOM 0 HG23 VAL A 38 -2.114 -9.992 8.709 1.00 0.00 H new ATOM 578 N ARG A 39 -3.631 -11.241 13.485 1.00 0.00 N ATOM 579 CA ARG A 39 -4.596 -11.391 14.573 1.00 0.00 C ATOM 580 C ARG A 39 -4.512 -10.170 15.502 1.00 0.00 C ATOM 581 O ARG A 39 -3.492 -9.942 16.162 1.00 0.00 O ATOM 582 CB ARG A 39 -4.361 -12.735 15.322 1.00 0.00 C ATOM 583 CG ARG A 39 -2.886 -13.065 15.652 1.00 0.00 C ATOM 584 CD ARG A 39 -2.710 -14.466 16.264 1.00 0.00 C ATOM 585 NE ARG A 39 -3.379 -14.585 17.570 1.00 0.00 N ATOM 586 CZ ARG A 39 -2.761 -14.793 18.741 1.00 0.00 C ATOM 587 NH1 ARG A 39 -1.445 -14.860 18.813 1.00 0.00 N ATOM 588 NH2 ARG A 39 -3.465 -14.878 19.850 1.00 0.00 N ATOM 0 H ARG A 39 -2.672 -11.115 13.807 1.00 0.00 H new ATOM 0 HA ARG A 39 -5.609 -11.430 14.173 1.00 0.00 H new ATOM 0 HB2 ARG A 39 -4.928 -12.716 16.253 1.00 0.00 H new ATOM 0 HB3 ARG A 39 -4.769 -13.544 14.717 1.00 0.00 H new ATOM 0 HG2 ARG A 39 -2.290 -12.994 14.742 1.00 0.00 H new ATOM 0 HG3 ARG A 39 -2.498 -12.319 16.346 1.00 0.00 H new ATOM 0 HD2 ARG A 39 -3.113 -15.213 15.581 1.00 0.00 H new ATOM 0 HD3 ARG A 39 -1.648 -14.680 16.380 1.00 0.00 H new ATOM 0 HE ARG A 39 -4.396 -14.502 17.585 1.00 0.00 H new ATOM 0 HH11 ARG A 39 -0.882 -14.753 17.969 1.00 0.00 H new ATOM 0 HH12 ARG A 39 -0.991 -15.019 19.712 1.00 0.00 H new ATOM 0 HH21 ARG A 39 -4.480 -14.786 19.818 1.00 0.00 H new ATOM 0 HH22 ARG A 39 -2.995 -15.036 20.741 1.00 0.00 H new ATOM 602 N GLN A 40 -5.590 -9.364 15.495 1.00 0.00 N ATOM 603 CA GLN A 40 -5.727 -8.182 16.364 1.00 0.00 C ATOM 604 C GLN A 40 -6.169 -8.624 17.760 1.00 0.00 C ATOM 605 O GLN A 40 -6.915 -9.576 17.879 1.00 0.00 O ATOM 606 CB GLN A 40 -6.753 -7.174 15.777 1.00 0.00 C ATOM 607 CG GLN A 40 -7.007 -5.937 16.669 1.00 0.00 C ATOM 608 CD GLN A 40 -8.101 -5.000 16.169 1.00 0.00 C ATOM 609 OE1 GLN A 40 -8.315 -4.851 14.985 1.00 0.00 O ATOM 610 NE2 GLN A 40 -8.808 -4.373 17.082 1.00 0.00 N ATOM 0 H GLN A 40 -6.393 -9.515 14.884 1.00 0.00 H new ATOM 0 HA GLN A 40 -4.760 -7.683 16.426 1.00 0.00 H new ATOM 0 HB2 GLN A 40 -6.399 -6.839 14.802 1.00 0.00 H new ATOM 0 HB3 GLN A 40 -7.699 -7.690 15.612 1.00 0.00 H new ATOM 0 HG2 GLN A 40 -7.270 -6.277 17.671 1.00 0.00 H new ATOM 0 HG3 GLN A 40 -6.078 -5.373 16.757 1.00 0.00 H new ATOM 0 HE21 GLN A 40 -8.606 -4.517 18.071 1.00 0.00 H new ATOM 0 HE22 GLN A 40 -9.559 -3.742 16.801 1.00 0.00 H new ATOM 619 N ARG A 41 -5.707 -7.916 18.802 1.00 0.00 N ATOM 620 CA ARG A 41 -6.036 -8.216 20.196 1.00 0.00 C ATOM 621 C ARG A 41 -6.671 -6.983 20.849 1.00 0.00 C ATOM 622 O ARG A 41 -6.127 -5.881 20.755 1.00 0.00 O ATOM 623 CB ARG A 41 -4.761 -8.661 20.938 1.00 0.00 C ATOM 624 CG ARG A 41 -4.999 -9.221 22.364 1.00 0.00 C ATOM 625 CD ARG A 41 -3.792 -10.033 22.861 1.00 0.00 C ATOM 626 NE ARG A 41 -3.470 -11.105 21.893 1.00 0.00 N ATOM 627 CZ ARG A 41 -2.286 -11.290 21.290 1.00 0.00 C ATOM 628 NH1 ARG A 41 -1.209 -10.611 21.671 1.00 0.00 N ATOM 629 NH2 ARG A 41 -2.199 -12.158 20.304 1.00 0.00 N ATOM 0 H ARG A 41 -5.089 -7.112 18.695 1.00 0.00 H new ATOM 0 HA ARG A 41 -6.758 -9.031 20.247 1.00 0.00 H new ATOM 0 HB2 ARG A 41 -4.259 -9.424 20.343 1.00 0.00 H new ATOM 0 HB3 ARG A 41 -4.082 -7.811 21.006 1.00 0.00 H new ATOM 0 HG2 ARG A 41 -5.192 -8.398 23.051 1.00 0.00 H new ATOM 0 HG3 ARG A 41 -5.888 -9.852 22.364 1.00 0.00 H new ATOM 0 HD2 ARG A 41 -2.931 -9.378 22.990 1.00 0.00 H new ATOM 0 HD3 ARG A 41 -4.012 -10.467 23.837 1.00 0.00 H new ATOM 0 HE ARG A 41 -4.215 -11.762 21.664 1.00 0.00 H new ATOM 0 HH11 ARG A 41 -1.275 -9.936 22.433 1.00 0.00 H new ATOM 0 HH12 ARG A 41 -0.317 -10.764 21.201 1.00 0.00 H new ATOM 0 HH21 ARG A 41 -3.025 -12.679 20.009 1.00 0.00 H new ATOM 0 HH22 ARG A 41 -1.306 -12.310 19.836 1.00 0.00 H new ATOM 643 N LEU A 42 -7.827 -7.190 21.495 1.00 0.00 N ATOM 644 CA LEU A 42 -8.651 -6.123 22.079 1.00 0.00 C ATOM 645 C LEU A 42 -8.383 -5.983 23.585 1.00 0.00 C ATOM 646 O LEU A 42 -8.119 -6.963 24.289 1.00 0.00 O ATOM 647 CB LEU A 42 -10.175 -6.391 21.849 1.00 0.00 C ATOM 648 CG LEU A 42 -10.732 -6.124 20.416 1.00 0.00 C ATOM 649 CD1 LEU A 42 -10.530 -4.649 20.010 1.00 0.00 C ATOM 650 CD2 LEU A 42 -10.136 -7.090 19.373 1.00 0.00 C ATOM 0 H LEU A 42 -8.223 -8.121 21.629 1.00 0.00 H new ATOM 0 HA LEU A 42 -8.376 -5.195 21.577 1.00 0.00 H new ATOM 0 HB2 LEU A 42 -10.378 -7.431 22.103 1.00 0.00 H new ATOM 0 HB3 LEU A 42 -10.737 -5.775 22.551 1.00 0.00 H new ATOM 0 HG LEU A 42 -11.804 -6.318 20.442 1.00 0.00 H new ATOM 0 HD11 LEU A 42 -10.927 -4.490 19.007 1.00 0.00 H new ATOM 0 HD12 LEU A 42 -11.054 -4.003 20.714 1.00 0.00 H new ATOM 0 HD13 LEU A 42 -9.466 -4.411 20.021 1.00 0.00 H new ATOM 0 HD21 LEU A 42 -10.552 -6.867 18.391 1.00 0.00 H new ATOM 0 HD22 LEU A 42 -9.053 -6.971 19.344 1.00 0.00 H new ATOM 0 HD23 LEU A 42 -10.381 -8.116 19.646 1.00 0.00 H new ATOM 662 N ARG A 43 -8.508 -4.737 24.044 1.00 0.00 N ATOM 663 CA ARG A 43 -8.525 -4.353 25.465 1.00 0.00 C ATOM 664 C ARG A 43 -9.831 -4.833 26.144 1.00 0.00 C ATOM 665 O ARG A 43 -9.910 -4.925 27.372 1.00 0.00 O ATOM 666 CB ARG A 43 -8.361 -2.805 25.549 1.00 0.00 C ATOM 667 CG ARG A 43 -9.410 -2.002 24.727 1.00 0.00 C ATOM 668 CD ARG A 43 -8.971 -0.557 24.408 1.00 0.00 C ATOM 669 NE ARG A 43 -8.927 0.318 25.593 1.00 0.00 N ATOM 670 CZ ARG A 43 -8.798 1.654 25.548 1.00 0.00 C ATOM 671 NH1 ARG A 43 -8.639 2.290 24.390 1.00 0.00 N ATOM 672 NH2 ARG A 43 -8.809 2.352 26.667 1.00 0.00 N ATOM 0 H ARG A 43 -8.604 -3.937 23.419 1.00 0.00 H new ATOM 0 HA ARG A 43 -7.704 -4.830 25.999 1.00 0.00 H new ATOM 0 HB2 ARG A 43 -8.426 -2.501 26.594 1.00 0.00 H new ATOM 0 HB3 ARG A 43 -7.363 -2.538 25.201 1.00 0.00 H new ATOM 0 HG2 ARG A 43 -9.607 -2.528 23.793 1.00 0.00 H new ATOM 0 HG3 ARG A 43 -10.349 -1.974 25.280 1.00 0.00 H new ATOM 0 HD2 ARG A 43 -7.984 -0.579 23.945 1.00 0.00 H new ATOM 0 HD3 ARG A 43 -9.657 -0.130 23.676 1.00 0.00 H new ATOM 0 HE ARG A 43 -9.000 -0.121 26.511 1.00 0.00 H new ATOM 0 HH11 ARG A 43 -8.614 1.762 23.518 1.00 0.00 H new ATOM 0 HH12 ARG A 43 -8.543 3.305 24.375 1.00 0.00 H new ATOM 0 HH21 ARG A 43 -8.915 1.877 27.563 1.00 0.00 H new ATOM 0 HH22 ARG A 43 -8.711 3.367 26.636 1.00 0.00 H new ATOM 686 N ASP A 44 -10.853 -5.125 25.309 1.00 0.00 N ATOM 687 CA ASP A 44 -12.135 -5.720 25.745 1.00 0.00 C ATOM 688 C ASP A 44 -11.958 -7.209 26.129 1.00 0.00 C ATOM 689 O ASP A 44 -12.755 -7.769 26.889 1.00 0.00 O ATOM 690 CB ASP A 44 -13.188 -5.561 24.618 1.00 0.00 C ATOM 691 CG ASP A 44 -14.589 -6.094 25.000 1.00 0.00 C ATOM 692 OD1 ASP A 44 -15.246 -5.486 25.875 1.00 0.00 O ATOM 693 OD2 ASP A 44 -15.050 -7.093 24.413 1.00 0.00 O ATOM 0 H ASP A 44 -10.810 -4.953 24.305 1.00 0.00 H new ATOM 0 HA ASP A 44 -12.482 -5.194 26.634 1.00 0.00 H new ATOM 0 HB2 ASP A 44 -13.269 -4.507 24.354 1.00 0.00 H new ATOM 0 HB3 ASP A 44 -12.839 -6.086 23.729 1.00 0.00 H new ATOM 698 N GLY A 45 -10.890 -7.829 25.605 1.00 0.00 N ATOM 699 CA GLY A 45 -10.593 -9.244 25.847 1.00 0.00 C ATOM 700 C GLY A 45 -11.012 -10.140 24.697 1.00 0.00 C ATOM 701 O GLY A 45 -11.227 -11.337 24.881 1.00 0.00 O ATOM 0 H GLY A 45 -10.211 -7.363 25.003 1.00 0.00 H new ATOM 0 HA2 GLY A 45 -9.523 -9.361 26.021 1.00 0.00 H new ATOM 0 HA3 GLY A 45 -11.101 -9.566 26.756 1.00 0.00 H new ATOM 705 N ARG A 46 -11.128 -9.550 23.501 1.00 0.00 N ATOM 706 CA ARG A 46 -11.460 -10.278 22.261 1.00 0.00 C ATOM 707 C ARG A 46 -10.247 -10.290 21.322 1.00 0.00 C ATOM 708 O ARG A 46 -9.190 -9.757 21.663 1.00 0.00 O ATOM 709 CB ARG A 46 -12.673 -9.607 21.560 1.00 0.00 C ATOM 710 CG ARG A 46 -13.974 -9.575 22.389 1.00 0.00 C ATOM 711 CD ARG A 46 -14.437 -10.976 22.821 1.00 0.00 C ATOM 712 NE ARG A 46 -15.794 -10.956 23.406 1.00 0.00 N ATOM 713 CZ ARG A 46 -16.594 -12.021 23.555 1.00 0.00 C ATOM 714 NH1 ARG A 46 -16.191 -13.240 23.215 1.00 0.00 N ATOM 715 NH2 ARG A 46 -17.813 -11.858 24.036 1.00 0.00 N ATOM 0 H ARG A 46 -10.994 -8.549 23.361 1.00 0.00 H new ATOM 0 HA ARG A 46 -11.723 -11.306 22.511 1.00 0.00 H new ATOM 0 HB2 ARG A 46 -12.402 -8.584 21.299 1.00 0.00 H new ATOM 0 HB3 ARG A 46 -12.869 -10.133 20.626 1.00 0.00 H new ATOM 0 HG2 ARG A 46 -13.821 -8.958 23.275 1.00 0.00 H new ATOM 0 HG3 ARG A 46 -14.762 -9.101 21.803 1.00 0.00 H new ATOM 0 HD2 ARG A 46 -14.424 -11.644 21.959 1.00 0.00 H new ATOM 0 HD3 ARG A 46 -13.734 -11.381 23.549 1.00 0.00 H new ATOM 0 HE ARG A 46 -16.152 -10.055 23.723 1.00 0.00 H new ATOM 0 HH11 ARG A 46 -15.256 -13.380 22.832 1.00 0.00 H new ATOM 0 HH12 ARG A 46 -16.816 -14.036 23.337 1.00 0.00 H new ATOM 0 HH21 ARG A 46 -18.140 -10.926 24.291 1.00 0.00 H new ATOM 0 HH22 ARG A 46 -18.427 -12.664 24.152 1.00 0.00 H new ATOM 729 N GLU A 47 -10.429 -10.895 20.140 1.00 0.00 N ATOM 730 CA GLU A 47 -9.453 -10.906 19.041 1.00 0.00 C ATOM 731 C GLU A 47 -10.183 -10.973 17.689 1.00 0.00 C ATOM 732 O GLU A 47 -11.355 -11.363 17.608 1.00 0.00 O ATOM 733 CB GLU A 47 -8.403 -12.069 19.141 1.00 0.00 C ATOM 734 CG GLU A 47 -7.339 -11.897 20.253 1.00 0.00 C ATOM 735 CD GLU A 47 -6.115 -12.816 20.097 1.00 0.00 C ATOM 736 OE1 GLU A 47 -5.216 -12.502 19.281 1.00 0.00 O ATOM 737 OE2 GLU A 47 -6.039 -13.848 20.786 1.00 0.00 O ATOM 0 H GLU A 47 -11.284 -11.405 19.916 1.00 0.00 H new ATOM 0 HA GLU A 47 -8.890 -9.976 19.122 1.00 0.00 H new ATOM 0 HB2 GLU A 47 -8.935 -13.005 19.310 1.00 0.00 H new ATOM 0 HB3 GLU A 47 -7.893 -12.161 18.182 1.00 0.00 H new ATOM 0 HG2 GLU A 47 -7.003 -10.860 20.262 1.00 0.00 H new ATOM 0 HG3 GLU A 47 -7.804 -12.090 21.220 1.00 0.00 H new ATOM 744 N ASN A 48 -9.467 -10.554 16.636 1.00 0.00 N ATOM 745 CA ASN A 48 -9.912 -10.657 15.232 1.00 0.00 C ATOM 746 C ASN A 48 -8.837 -11.409 14.433 1.00 0.00 C ATOM 747 O ASN A 48 -7.739 -11.654 14.938 1.00 0.00 O ATOM 748 CB ASN A 48 -10.139 -9.259 14.599 1.00 0.00 C ATOM 749 CG ASN A 48 -11.105 -8.345 15.360 1.00 0.00 C ATOM 750 OD1 ASN A 48 -12.303 -8.329 15.126 1.00 0.00 O ATOM 751 ND2 ASN A 48 -10.584 -7.579 16.288 1.00 0.00 N ATOM 0 H ASN A 48 -8.546 -10.126 16.734 1.00 0.00 H new ATOM 0 HA ASN A 48 -10.862 -11.192 15.207 1.00 0.00 H new ATOM 0 HB2 ASN A 48 -9.176 -8.755 14.517 1.00 0.00 H new ATOM 0 HB3 ASN A 48 -10.515 -9.394 13.585 1.00 0.00 H new ATOM 0 HD21 ASN A 48 -11.182 -6.955 16.830 1.00 0.00 H new ATOM 0 HD22 ASN A 48 -9.580 -7.607 16.468 1.00 0.00 H new ATOM 758 N LEU A 49 -9.160 -11.761 13.188 1.00 0.00 N ATOM 759 CA LEU A 49 -8.249 -12.468 12.277 1.00 0.00 C ATOM 760 C LEU A 49 -8.418 -11.853 10.890 1.00 0.00 C ATOM 761 O LEU A 49 -9.529 -11.494 10.510 1.00 0.00 O ATOM 762 CB LEU A 49 -8.546 -13.999 12.246 1.00 0.00 C ATOM 763 CG LEU A 49 -7.309 -14.959 12.193 1.00 0.00 C ATOM 764 CD1 LEU A 49 -7.767 -16.421 12.185 1.00 0.00 C ATOM 765 CD2 LEU A 49 -6.356 -14.669 11.007 1.00 0.00 C ATOM 0 H LEU A 49 -10.072 -11.562 12.776 1.00 0.00 H new ATOM 0 HA LEU A 49 -7.221 -12.359 12.621 1.00 0.00 H new ATOM 0 HB2 LEU A 49 -9.132 -14.249 13.130 1.00 0.00 H new ATOM 0 HB3 LEU A 49 -9.173 -14.206 11.379 1.00 0.00 H new ATOM 0 HG LEU A 49 -6.729 -14.770 13.096 1.00 0.00 H new ATOM 0 HD11 LEU A 49 -6.896 -17.075 12.148 1.00 0.00 H new ATOM 0 HD12 LEU A 49 -8.338 -16.628 13.090 1.00 0.00 H new ATOM 0 HD13 LEU A 49 -8.393 -16.601 11.311 1.00 0.00 H new ATOM 0 HD21 LEU A 49 -5.522 -15.370 11.031 1.00 0.00 H new ATOM 0 HD22 LEU A 49 -6.898 -14.782 10.068 1.00 0.00 H new ATOM 0 HD23 LEU A 49 -5.976 -13.650 11.086 1.00 0.00 H new ATOM 777 N TYR A 50 -7.307 -11.714 10.160 1.00 0.00 N ATOM 778 CA TYR A 50 -7.255 -11.066 8.847 1.00 0.00 C ATOM 779 C TYR A 50 -6.484 -11.954 7.877 1.00 0.00 C ATOM 780 O TYR A 50 -5.498 -12.568 8.261 1.00 0.00 O ATOM 781 CB TYR A 50 -6.583 -9.673 8.977 1.00 0.00 C ATOM 782 CG TYR A 50 -7.229 -8.835 10.082 1.00 0.00 C ATOM 783 CD1 TYR A 50 -8.528 -8.364 9.935 1.00 0.00 C ATOM 784 CD2 TYR A 50 -6.574 -8.579 11.290 1.00 0.00 C ATOM 785 CE1 TYR A 50 -9.145 -7.661 10.928 1.00 0.00 C ATOM 786 CE2 TYR A 50 -7.198 -7.867 12.283 1.00 0.00 C ATOM 787 CZ TYR A 50 -8.487 -7.417 12.092 1.00 0.00 C ATOM 788 OH TYR A 50 -9.120 -6.701 13.071 1.00 0.00 O ATOM 0 H TYR A 50 -6.399 -12.057 10.473 1.00 0.00 H new ATOM 0 HA TYR A 50 -8.265 -10.924 8.463 1.00 0.00 H new ATOM 0 HB2 TYR A 50 -5.521 -9.799 9.189 1.00 0.00 H new ATOM 0 HB3 TYR A 50 -6.657 -9.143 8.027 1.00 0.00 H new ATOM 0 HD1 TYR A 50 -9.060 -8.559 9.016 1.00 0.00 H new ATOM 0 HD2 TYR A 50 -5.569 -8.944 11.443 1.00 0.00 H new ATOM 0 HE1 TYR A 50 -10.153 -7.299 10.790 1.00 0.00 H new ATOM 0 HE2 TYR A 50 -6.682 -7.660 13.209 1.00 0.00 H new ATOM 0 HH TYR A 50 -8.469 -6.133 13.534 1.00 0.00 H new ATOM 798 N GLY A 51 -6.967 -12.030 6.635 1.00 0.00 N ATOM 799 CA GLY A 51 -6.313 -12.784 5.569 1.00 0.00 C ATOM 800 C GLY A 51 -6.289 -11.980 4.281 1.00 0.00 C ATOM 801 O GLY A 51 -7.074 -11.036 4.151 1.00 0.00 O ATOM 0 H GLY A 51 -7.827 -11.567 6.341 1.00 0.00 H new ATOM 0 HA2 GLY A 51 -5.295 -13.035 5.866 1.00 0.00 H new ATOM 0 HA3 GLY A 51 -6.839 -13.725 5.407 1.00 0.00 H new ATOM 805 N PRO A 52 -5.399 -12.317 3.304 1.00 0.00 N ATOM 806 CA PRO A 52 -5.306 -11.572 2.033 1.00 0.00 C ATOM 807 C PRO A 52 -6.548 -11.844 1.148 1.00 0.00 C ATOM 808 O PRO A 52 -6.739 -12.960 0.644 1.00 0.00 O ATOM 809 CB PRO A 52 -3.985 -12.099 1.415 1.00 0.00 C ATOM 810 CG PRO A 52 -3.836 -13.488 1.964 1.00 0.00 C ATOM 811 CD PRO A 52 -4.433 -13.452 3.356 1.00 0.00 C ATOM 0 HA PRO A 52 -5.292 -10.488 2.149 1.00 0.00 H new ATOM 0 HB2 PRO A 52 -4.032 -12.106 0.326 1.00 0.00 H new ATOM 0 HB3 PRO A 52 -3.139 -11.470 1.693 1.00 0.00 H new ATOM 0 HG2 PRO A 52 -4.353 -14.213 1.336 1.00 0.00 H new ATOM 0 HG3 PRO A 52 -2.788 -13.785 1.996 1.00 0.00 H new ATOM 0 HD2 PRO A 52 -4.932 -14.390 3.601 1.00 0.00 H new ATOM 0 HD3 PRO A 52 -3.667 -13.290 4.115 1.00 0.00 H new ATOM 819 N ALA A 53 -7.412 -10.819 1.025 1.00 0.00 N ATOM 820 CA ALA A 53 -8.675 -10.901 0.267 1.00 0.00 C ATOM 821 C ALA A 53 -8.401 -11.059 -1.246 1.00 0.00 C ATOM 822 O ALA A 53 -7.355 -10.588 -1.733 1.00 0.00 O ATOM 823 CB ALA A 53 -9.539 -9.650 0.532 1.00 0.00 C ATOM 0 H ALA A 53 -7.253 -9.906 1.451 1.00 0.00 H new ATOM 0 HA ALA A 53 -9.221 -11.782 0.605 1.00 0.00 H new ATOM 0 HB1 ALA A 53 -10.468 -9.723 -0.033 1.00 0.00 H new ATOM 0 HB2 ALA A 53 -9.766 -9.583 1.596 1.00 0.00 H new ATOM 0 HB3 ALA A 53 -8.994 -8.759 0.221 1.00 0.00 H new ATOM 829 N PRO A 54 -9.329 -11.730 -2.014 1.00 0.00 N ATOM 830 CA PRO A 54 -9.198 -11.872 -3.481 1.00 0.00 C ATOM 831 C PRO A 54 -9.261 -10.495 -4.189 1.00 0.00 C ATOM 832 O PRO A 54 -10.345 -9.912 -4.359 1.00 0.00 O ATOM 833 CB PRO A 54 -10.390 -12.800 -3.868 1.00 0.00 C ATOM 834 CG PRO A 54 -11.385 -12.631 -2.760 1.00 0.00 C ATOM 835 CD PRO A 54 -10.564 -12.412 -1.510 1.00 0.00 C ATOM 0 HA PRO A 54 -8.239 -12.290 -3.788 1.00 0.00 H new ATOM 0 HB2 PRO A 54 -10.817 -12.515 -4.829 1.00 0.00 H new ATOM 0 HB3 PRO A 54 -10.070 -13.838 -3.957 1.00 0.00 H new ATOM 0 HG2 PRO A 54 -12.044 -11.784 -2.950 1.00 0.00 H new ATOM 0 HG3 PRO A 54 -12.019 -13.513 -2.664 1.00 0.00 H new ATOM 0 HD2 PRO A 54 -11.095 -11.795 -0.785 1.00 0.00 H new ATOM 0 HD3 PRO A 54 -10.328 -13.354 -1.015 1.00 0.00 H new ATOM 843 N GLN A 55 -8.073 -9.959 -4.526 1.00 0.00 N ATOM 844 CA GLN A 55 -7.937 -8.668 -5.226 1.00 0.00 C ATOM 845 C GLN A 55 -8.477 -8.782 -6.665 1.00 0.00 C ATOM 846 O GLN A 55 -8.424 -9.860 -7.276 1.00 0.00 O ATOM 847 CB GLN A 55 -6.453 -8.200 -5.234 1.00 0.00 C ATOM 848 CG GLN A 55 -5.476 -9.155 -5.960 1.00 0.00 C ATOM 849 CD GLN A 55 -4.008 -8.713 -5.913 1.00 0.00 C ATOM 850 OE1 GLN A 55 -3.098 -9.545 -5.835 1.00 0.00 O ATOM 851 NE2 GLN A 55 -3.751 -7.410 -6.003 1.00 0.00 N ATOM 0 H GLN A 55 -7.181 -10.409 -4.321 1.00 0.00 H new ATOM 0 HA GLN A 55 -8.525 -7.922 -4.692 1.00 0.00 H new ATOM 0 HB2 GLN A 55 -6.398 -7.219 -5.706 1.00 0.00 H new ATOM 0 HB3 GLN A 55 -6.120 -8.077 -4.203 1.00 0.00 H new ATOM 0 HG2 GLN A 55 -5.559 -10.147 -5.516 1.00 0.00 H new ATOM 0 HG3 GLN A 55 -5.783 -9.246 -7.002 1.00 0.00 H new ATOM 0 HE21 GLN A 55 -4.519 -6.742 -6.066 1.00 0.00 H new ATOM 0 HE22 GLN A 55 -2.786 -7.080 -6.009 1.00 0.00 H new ATOM 860 N SER A 56 -9.017 -7.669 -7.178 1.00 0.00 N ATOM 861 CA SER A 56 -9.536 -7.586 -8.546 1.00 0.00 C ATOM 862 C SER A 56 -8.373 -7.555 -9.560 1.00 0.00 C ATOM 863 O SER A 56 -7.828 -6.488 -9.868 1.00 0.00 O ATOM 864 CB SER A 56 -10.456 -6.350 -8.683 1.00 0.00 C ATOM 865 OG SER A 56 -9.860 -5.191 -8.119 1.00 0.00 O ATOM 0 H SER A 56 -9.106 -6.799 -6.653 1.00 0.00 H new ATOM 0 HA SER A 56 -10.132 -8.472 -8.764 1.00 0.00 H new ATOM 0 HB2 SER A 56 -10.674 -6.172 -9.736 1.00 0.00 H new ATOM 0 HB3 SER A 56 -11.408 -6.547 -8.190 1.00 0.00 H new ATOM 0 HG SER A 56 -8.938 -5.108 -8.441 1.00 0.00 H new ATOM 871 N PHE A 57 -7.952 -8.753 -10.005 1.00 0.00 N ATOM 872 CA PHE A 57 -6.896 -8.913 -11.015 1.00 0.00 C ATOM 873 C PHE A 57 -7.505 -9.101 -12.409 1.00 0.00 C ATOM 874 O PHE A 57 -8.550 -9.748 -12.564 1.00 0.00 O ATOM 875 CB PHE A 57 -5.920 -10.078 -10.666 1.00 0.00 C ATOM 876 CG PHE A 57 -6.551 -11.467 -10.511 1.00 0.00 C ATOM 877 CD1 PHE A 57 -6.702 -12.327 -11.605 1.00 0.00 C ATOM 878 CD2 PHE A 57 -6.958 -11.924 -9.260 1.00 0.00 C ATOM 879 CE1 PHE A 57 -7.253 -13.583 -11.449 1.00 0.00 C ATOM 880 CE2 PHE A 57 -7.508 -13.179 -9.104 1.00 0.00 C ATOM 881 CZ PHE A 57 -7.652 -14.011 -10.196 1.00 0.00 C ATOM 0 H PHE A 57 -8.337 -9.637 -9.672 1.00 0.00 H new ATOM 0 HA PHE A 57 -6.306 -7.996 -11.017 1.00 0.00 H new ATOM 0 HB2 PHE A 57 -5.159 -10.132 -11.445 1.00 0.00 H new ATOM 0 HB3 PHE A 57 -5.408 -9.829 -9.737 1.00 0.00 H new ATOM 0 HD1 PHE A 57 -6.383 -12.003 -12.585 1.00 0.00 H new ATOM 0 HD2 PHE A 57 -6.841 -11.285 -8.397 1.00 0.00 H new ATOM 0 HE1 PHE A 57 -7.372 -14.231 -12.305 1.00 0.00 H new ATOM 0 HE2 PHE A 57 -7.826 -13.511 -8.127 1.00 0.00 H new ATOM 0 HZ PHE A 57 -8.076 -14.996 -10.072 1.00 0.00 H new ATOM 891 N ALA A 58 -6.858 -8.491 -13.407 1.00 0.00 N ATOM 892 CA ALA A 58 -7.153 -8.705 -14.827 1.00 0.00 C ATOM 893 C ALA A 58 -5.985 -9.480 -15.437 1.00 0.00 C ATOM 894 O ALA A 58 -4.865 -8.982 -15.431 1.00 0.00 O ATOM 895 CB ALA A 58 -7.366 -7.362 -15.540 1.00 0.00 C ATOM 0 H ALA A 58 -6.103 -7.824 -13.248 1.00 0.00 H new ATOM 0 HA ALA A 58 -8.073 -9.277 -14.944 1.00 0.00 H new ATOM 0 HB1 ALA A 58 -7.584 -7.540 -16.593 1.00 0.00 H new ATOM 0 HB2 ALA A 58 -8.202 -6.835 -15.080 1.00 0.00 H new ATOM 0 HB3 ALA A 58 -6.464 -6.757 -15.453 1.00 0.00 H new ATOM 901 N ASP A 59 -6.258 -10.711 -15.905 1.00 0.00 N ATOM 902 CA ASP A 59 -5.256 -11.618 -16.519 1.00 0.00 C ATOM 903 C ASP A 59 -4.046 -11.864 -15.569 1.00 0.00 C ATOM 904 O ASP A 59 -2.902 -12.016 -16.010 1.00 0.00 O ATOM 905 CB ASP A 59 -4.820 -11.080 -17.928 1.00 0.00 C ATOM 906 CG ASP A 59 -4.071 -12.123 -18.784 1.00 0.00 C ATOM 907 OD1 ASP A 59 -4.685 -13.152 -19.137 1.00 0.00 O ATOM 908 OD2 ASP A 59 -2.870 -11.933 -19.092 1.00 0.00 O ATOM 0 H ASP A 59 -7.194 -11.115 -15.869 1.00 0.00 H new ATOM 0 HA ASP A 59 -5.720 -12.592 -16.673 1.00 0.00 H new ATOM 0 HB2 ASP A 59 -5.705 -10.746 -18.470 1.00 0.00 H new ATOM 0 HB3 ASP A 59 -4.181 -10.207 -17.792 1.00 0.00 H new ATOM 913 N ASP A 60 -4.337 -11.894 -14.245 1.00 0.00 N ATOM 914 CA ASP A 60 -3.350 -12.178 -13.167 1.00 0.00 C ATOM 915 C ASP A 60 -2.239 -11.113 -13.057 1.00 0.00 C ATOM 916 O ASP A 60 -1.236 -11.337 -12.369 1.00 0.00 O ATOM 917 CB ASP A 60 -2.740 -13.606 -13.318 1.00 0.00 C ATOM 918 CG ASP A 60 -3.769 -14.721 -13.088 1.00 0.00 C ATOM 919 OD1 ASP A 60 -4.460 -15.119 -14.051 1.00 0.00 O ATOM 920 OD2 ASP A 60 -3.896 -15.195 -11.936 1.00 0.00 O ATOM 0 H ASP A 60 -5.277 -11.719 -13.888 1.00 0.00 H new ATOM 0 HA ASP A 60 -3.909 -12.135 -12.232 1.00 0.00 H new ATOM 0 HB2 ASP A 60 -2.315 -13.711 -14.316 1.00 0.00 H new ATOM 0 HB3 ASP A 60 -1.920 -13.723 -12.609 1.00 0.00 H new ATOM 925 N GLU A 61 -2.444 -9.942 -13.683 1.00 0.00 N ATOM 926 CA GLU A 61 -1.470 -8.837 -13.657 1.00 0.00 C ATOM 927 C GLU A 61 -1.332 -8.268 -12.234 1.00 0.00 C ATOM 928 O GLU A 61 -0.233 -8.219 -11.674 1.00 0.00 O ATOM 929 CB GLU A 61 -1.905 -7.725 -14.637 1.00 0.00 C ATOM 930 CG GLU A 61 -1.905 -8.162 -16.119 1.00 0.00 C ATOM 931 CD GLU A 61 -2.384 -7.070 -17.089 1.00 0.00 C ATOM 932 OE1 GLU A 61 -1.630 -6.097 -17.328 1.00 0.00 O ATOM 933 OE2 GLU A 61 -3.496 -7.183 -17.641 1.00 0.00 O ATOM 0 H GLU A 61 -3.286 -9.735 -14.220 1.00 0.00 H new ATOM 0 HA GLU A 61 -0.499 -9.223 -13.967 1.00 0.00 H new ATOM 0 HB2 GLU A 61 -2.906 -7.388 -14.368 1.00 0.00 H new ATOM 0 HB3 GLU A 61 -1.239 -6.870 -14.520 1.00 0.00 H new ATOM 0 HG2 GLU A 61 -0.896 -8.466 -16.398 1.00 0.00 H new ATOM 0 HG3 GLU A 61 -2.544 -9.038 -16.229 1.00 0.00 H new ATOM 940 N ASP A 62 -2.487 -7.905 -11.646 1.00 0.00 N ATOM 941 CA ASP A 62 -2.576 -7.209 -10.336 1.00 0.00 C ATOM 942 C ASP A 62 -2.023 -8.048 -9.169 1.00 0.00 C ATOM 943 O ASP A 62 -1.767 -7.507 -8.096 1.00 0.00 O ATOM 944 CB ASP A 62 -4.041 -6.806 -10.037 1.00 0.00 C ATOM 945 CG ASP A 62 -4.644 -5.895 -11.120 1.00 0.00 C ATOM 946 OD1 ASP A 62 -4.886 -6.389 -12.246 1.00 0.00 O ATOM 947 OD2 ASP A 62 -4.867 -4.695 -10.861 1.00 0.00 O ATOM 0 H ASP A 62 -3.398 -8.086 -12.067 1.00 0.00 H new ATOM 0 HA ASP A 62 -1.953 -6.319 -10.418 1.00 0.00 H new ATOM 0 HB2 ASP A 62 -4.649 -7.706 -9.947 1.00 0.00 H new ATOM 0 HB3 ASP A 62 -4.083 -6.295 -9.075 1.00 0.00 H new ATOM 952 N ILE A 63 -1.850 -9.364 -9.397 1.00 0.00 N ATOM 953 CA ILE A 63 -1.260 -10.300 -8.407 1.00 0.00 C ATOM 954 C ILE A 63 0.162 -9.839 -7.986 1.00 0.00 C ATOM 955 O ILE A 63 0.547 -9.911 -6.813 1.00 0.00 O ATOM 956 CB ILE A 63 -1.185 -11.770 -9.002 1.00 0.00 C ATOM 957 CG1 ILE A 63 -2.600 -12.266 -9.436 1.00 0.00 C ATOM 958 CG2 ILE A 63 -0.536 -12.775 -8.007 1.00 0.00 C ATOM 959 CD1 ILE A 63 -3.619 -12.304 -8.319 1.00 0.00 C ATOM 0 H ILE A 63 -2.114 -9.814 -10.273 1.00 0.00 H new ATOM 0 HA ILE A 63 -1.905 -10.302 -7.528 1.00 0.00 H new ATOM 0 HB ILE A 63 -0.543 -11.725 -9.882 1.00 0.00 H new ATOM 0 HG12 ILE A 63 -2.972 -11.617 -10.229 1.00 0.00 H new ATOM 0 HG13 ILE A 63 -2.507 -13.266 -9.860 1.00 0.00 H new ATOM 0 HG21 ILE A 63 -0.507 -13.767 -8.459 1.00 0.00 H new ATOM 0 HG22 ILE A 63 0.479 -12.452 -7.774 1.00 0.00 H new ATOM 0 HG23 ILE A 63 -1.125 -12.811 -7.090 1.00 0.00 H new ATOM 0 HD11 ILE A 63 -4.573 -12.660 -8.709 1.00 0.00 H new ATOM 0 HD12 ILE A 63 -3.274 -12.977 -7.534 1.00 0.00 H new ATOM 0 HD13 ILE A 63 -3.746 -11.302 -7.908 1.00 0.00 H new ATOM 971 N MET A 64 0.896 -9.327 -8.978 1.00 0.00 N ATOM 972 CA MET A 64 2.340 -9.025 -8.892 1.00 0.00 C ATOM 973 C MET A 64 2.645 -7.585 -9.358 1.00 0.00 C ATOM 974 O MET A 64 3.797 -7.138 -9.280 1.00 0.00 O ATOM 975 CB MET A 64 3.094 -10.082 -9.758 1.00 0.00 C ATOM 976 CG MET A 64 2.494 -10.274 -11.161 1.00 0.00 C ATOM 977 SD MET A 64 3.096 -11.752 -12.002 1.00 0.00 S ATOM 978 CE MET A 64 1.835 -11.969 -13.264 1.00 0.00 C ATOM 0 H MET A 64 0.498 -9.103 -9.890 1.00 0.00 H new ATOM 0 HA MET A 64 2.676 -9.083 -7.857 1.00 0.00 H new ATOM 0 HB2 MET A 64 4.137 -9.781 -9.857 1.00 0.00 H new ATOM 0 HB3 MET A 64 3.087 -11.039 -9.235 1.00 0.00 H new ATOM 0 HG2 MET A 64 1.408 -10.328 -11.079 1.00 0.00 H new ATOM 0 HG3 MET A 64 2.725 -9.400 -11.769 1.00 0.00 H new ATOM 0 HE1 MET A 64 2.254 -12.520 -14.106 1.00 0.00 H new ATOM 0 HE2 MET A 64 0.996 -12.526 -12.848 1.00 0.00 H new ATOM 0 HE3 MET A 64 1.490 -10.993 -13.605 1.00 0.00 H new ATOM 988 N ARG A 65 1.610 -6.857 -9.840 1.00 0.00 N ATOM 989 CA ARG A 65 1.754 -5.469 -10.348 1.00 0.00 C ATOM 990 C ARG A 65 0.857 -4.494 -9.560 1.00 0.00 C ATOM 991 O ARG A 65 0.887 -3.287 -9.816 1.00 0.00 O ATOM 992 CB ARG A 65 1.424 -5.384 -11.871 1.00 0.00 C ATOM 993 CG ARG A 65 2.234 -6.328 -12.796 1.00 0.00 C ATOM 994 CD ARG A 65 3.761 -6.259 -12.577 1.00 0.00 C ATOM 995 NE ARG A 65 4.288 -4.882 -12.600 1.00 0.00 N ATOM 996 CZ ARG A 65 5.128 -4.359 -11.688 1.00 0.00 C ATOM 997 NH1 ARG A 65 5.510 -5.069 -10.628 1.00 0.00 N ATOM 998 NH2 ARG A 65 5.560 -3.122 -11.832 1.00 0.00 N ATOM 0 H ARG A 65 0.655 -7.212 -9.888 1.00 0.00 H new ATOM 0 HA ARG A 65 2.795 -5.179 -10.205 1.00 0.00 H new ATOM 0 HB2 ARG A 65 0.364 -5.598 -12.005 1.00 0.00 H new ATOM 0 HB3 ARG A 65 1.586 -4.358 -12.201 1.00 0.00 H new ATOM 0 HG2 ARG A 65 1.900 -7.353 -12.635 1.00 0.00 H new ATOM 0 HG3 ARG A 65 2.014 -6.080 -13.834 1.00 0.00 H new ATOM 0 HD2 ARG A 65 4.006 -6.719 -11.620 1.00 0.00 H new ATOM 0 HD3 ARG A 65 4.259 -6.845 -13.349 1.00 0.00 H new ATOM 0 HE ARG A 65 3.993 -4.279 -13.367 1.00 0.00 H new ATOM 0 HH11 ARG A 65 5.165 -6.021 -10.500 1.00 0.00 H new ATOM 0 HH12 ARG A 65 6.147 -4.661 -9.944 1.00 0.00 H new ATOM 0 HH21 ARG A 65 5.257 -2.566 -12.632 1.00 0.00 H new ATOM 0 HH22 ARG A 65 6.197 -2.721 -11.144 1.00 0.00 H new ATOM 1012 N ALA A 66 0.058 -5.026 -8.610 1.00 0.00 N ATOM 1013 CA ALA A 66 -0.789 -4.222 -7.700 1.00 0.00 C ATOM 1014 C ALA A 66 -0.794 -4.864 -6.307 1.00 0.00 C ATOM 1015 O ALA A 66 -0.364 -6.014 -6.143 1.00 0.00 O ATOM 1016 CB ALA A 66 -2.218 -4.067 -8.256 1.00 0.00 C ATOM 0 H ALA A 66 -0.018 -6.031 -8.451 1.00 0.00 H new ATOM 0 HA ALA A 66 -0.371 -3.218 -7.622 1.00 0.00 H new ATOM 0 HB1 ALA A 66 -2.815 -3.472 -7.565 1.00 0.00 H new ATOM 0 HB2 ALA A 66 -2.179 -3.568 -9.224 1.00 0.00 H new ATOM 0 HB3 ALA A 66 -2.672 -5.051 -8.373 1.00 0.00 H new ATOM 1022 N GLU A 67 -1.261 -4.107 -5.300 1.00 0.00 N ATOM 1023 CA GLU A 67 -1.287 -4.566 -3.904 1.00 0.00 C ATOM 1024 C GLU A 67 -2.655 -5.188 -3.573 1.00 0.00 C ATOM 1025 O GLU A 67 -3.702 -4.664 -3.977 1.00 0.00 O ATOM 1026 CB GLU A 67 -0.962 -3.392 -2.943 1.00 0.00 C ATOM 1027 CG GLU A 67 -0.869 -3.789 -1.450 1.00 0.00 C ATOM 1028 CD GLU A 67 -0.206 -2.707 -0.581 1.00 0.00 C ATOM 1029 OE1 GLU A 67 -0.899 -1.765 -0.149 1.00 0.00 O ATOM 1030 OE2 GLU A 67 1.031 -2.770 -0.365 1.00 0.00 O ATOM 0 H GLU A 67 -1.629 -3.165 -5.431 1.00 0.00 H new ATOM 0 HA GLU A 67 -0.524 -5.333 -3.771 1.00 0.00 H new ATOM 0 HB2 GLU A 67 -0.016 -2.943 -3.246 1.00 0.00 H new ATOM 0 HB3 GLU A 67 -1.729 -2.625 -3.055 1.00 0.00 H new ATOM 0 HG2 GLU A 67 -1.871 -3.989 -1.070 1.00 0.00 H new ATOM 0 HG3 GLU A 67 -0.303 -4.716 -1.361 1.00 0.00 H new ATOM 1037 N ARG A 68 -2.624 -6.318 -2.852 1.00 0.00 N ATOM 1038 CA ARG A 68 -3.828 -7.029 -2.407 1.00 0.00 C ATOM 1039 C ARG A 68 -4.308 -6.470 -1.060 1.00 0.00 C ATOM 1040 O ARG A 68 -3.518 -6.268 -0.128 1.00 0.00 O ATOM 1041 CB ARG A 68 -3.557 -8.563 -2.337 1.00 0.00 C ATOM 1042 CG ARG A 68 -2.358 -8.990 -1.452 1.00 0.00 C ATOM 1043 CD ARG A 68 -1.946 -10.458 -1.683 1.00 0.00 C ATOM 1044 NE ARG A 68 -1.555 -10.695 -3.094 1.00 0.00 N ATOM 1045 CZ ARG A 68 -0.734 -11.664 -3.528 1.00 0.00 C ATOM 1046 NH1 ARG A 68 -0.190 -12.525 -2.686 1.00 0.00 N ATOM 1047 NH2 ARG A 68 -0.460 -11.758 -4.816 1.00 0.00 N ATOM 0 H ARG A 68 -1.756 -6.766 -2.560 1.00 0.00 H new ATOM 0 HA ARG A 68 -4.626 -6.871 -3.132 1.00 0.00 H new ATOM 0 HB2 ARG A 68 -4.455 -9.056 -1.964 1.00 0.00 H new ATOM 0 HB3 ARG A 68 -3.388 -8.931 -3.349 1.00 0.00 H new ATOM 0 HG2 ARG A 68 -1.508 -8.340 -1.660 1.00 0.00 H new ATOM 0 HG3 ARG A 68 -2.617 -8.850 -0.403 1.00 0.00 H new ATOM 0 HD2 ARG A 68 -1.114 -10.712 -1.026 1.00 0.00 H new ATOM 0 HD3 ARG A 68 -2.774 -11.116 -1.418 1.00 0.00 H new ATOM 0 HE ARG A 68 -1.944 -10.066 -3.796 1.00 0.00 H new ATOM 0 HH11 ARG A 68 -0.392 -12.460 -1.688 1.00 0.00 H new ATOM 0 HH12 ARG A 68 0.432 -13.255 -3.034 1.00 0.00 H new ATOM 0 HH21 ARG A 68 -0.871 -11.097 -5.475 1.00 0.00 H new ATOM 0 HH22 ARG A 68 0.163 -12.492 -5.153 1.00 0.00 H new ATOM 1061 N ARG A 69 -5.612 -6.191 -0.998 1.00 0.00 N ATOM 1062 CA ARG A 69 -6.286 -5.709 0.203 1.00 0.00 C ATOM 1063 C ARG A 69 -6.671 -6.929 1.053 1.00 0.00 C ATOM 1064 O ARG A 69 -6.772 -8.043 0.527 1.00 0.00 O ATOM 1065 CB ARG A 69 -7.513 -4.875 -0.243 1.00 0.00 C ATOM 1066 CG ARG A 69 -8.226 -4.076 0.868 1.00 0.00 C ATOM 1067 CD ARG A 69 -9.264 -3.099 0.280 1.00 0.00 C ATOM 1068 NE ARG A 69 -10.020 -2.375 1.313 1.00 0.00 N ATOM 1069 CZ ARG A 69 -10.839 -1.343 1.080 1.00 0.00 C ATOM 1070 NH1 ARG A 69 -10.984 -0.838 -0.138 1.00 0.00 N ATOM 1071 NH2 ARG A 69 -11.494 -0.806 2.080 1.00 0.00 N ATOM 0 H ARG A 69 -6.237 -6.297 -1.797 1.00 0.00 H new ATOM 0 HA ARG A 69 -5.650 -5.067 0.813 1.00 0.00 H new ATOM 0 HB2 ARG A 69 -7.192 -4.177 -1.016 1.00 0.00 H new ATOM 0 HB3 ARG A 69 -8.238 -5.548 -0.702 1.00 0.00 H new ATOM 0 HG2 ARG A 69 -8.720 -4.764 1.554 1.00 0.00 H new ATOM 0 HG3 ARG A 69 -7.490 -3.521 1.449 1.00 0.00 H new ATOM 0 HD2 ARG A 69 -8.755 -2.380 -0.362 1.00 0.00 H new ATOM 0 HD3 ARG A 69 -9.960 -3.653 -0.351 1.00 0.00 H new ATOM 0 HE ARG A 69 -9.912 -2.683 2.279 1.00 0.00 H new ATOM 0 HH11 ARG A 69 -10.465 -1.237 -0.921 1.00 0.00 H new ATOM 0 HH12 ARG A 69 -11.614 -0.051 -0.292 1.00 0.00 H new ATOM 0 HH21 ARG A 69 -11.377 -1.175 3.024 1.00 0.00 H new ATOM 0 HH22 ARG A 69 -12.121 -0.019 1.915 1.00 0.00 H new ATOM 1085 N PHE A 70 -6.856 -6.729 2.357 1.00 0.00 N ATOM 1086 CA PHE A 70 -7.149 -7.823 3.299 1.00 0.00 C ATOM 1087 C PHE A 70 -8.643 -7.882 3.608 1.00 0.00 C ATOM 1088 O PHE A 70 -9.414 -7.060 3.130 1.00 0.00 O ATOM 1089 CB PHE A 70 -6.313 -7.645 4.596 1.00 0.00 C ATOM 1090 CG PHE A 70 -4.838 -8.018 4.454 1.00 0.00 C ATOM 1091 CD1 PHE A 70 -4.042 -7.450 3.455 1.00 0.00 C ATOM 1092 CD2 PHE A 70 -4.247 -8.932 5.323 1.00 0.00 C ATOM 1093 CE1 PHE A 70 -2.713 -7.794 3.325 1.00 0.00 C ATOM 1094 CE2 PHE A 70 -2.921 -9.270 5.192 1.00 0.00 C ATOM 1095 CZ PHE A 70 -2.152 -8.699 4.197 1.00 0.00 C ATOM 0 H PHE A 70 -6.808 -5.809 2.795 1.00 0.00 H new ATOM 0 HA PHE A 70 -6.870 -8.771 2.838 1.00 0.00 H new ATOM 0 HB2 PHE A 70 -6.383 -6.606 4.919 1.00 0.00 H new ATOM 0 HB3 PHE A 70 -6.755 -8.254 5.385 1.00 0.00 H new ATOM 0 HD1 PHE A 70 -4.474 -6.731 2.775 1.00 0.00 H new ATOM 0 HD2 PHE A 70 -4.837 -9.380 6.109 1.00 0.00 H new ATOM 0 HE1 PHE A 70 -2.114 -7.354 2.541 1.00 0.00 H new ATOM 0 HE2 PHE A 70 -2.479 -9.985 5.870 1.00 0.00 H new ATOM 0 HZ PHE A 70 -1.109 -8.963 4.103 1.00 0.00 H new ATOM 1105 N GLU A 71 -9.029 -8.905 4.369 1.00 0.00 N ATOM 1106 CA GLU A 71 -10.403 -9.134 4.827 1.00 0.00 C ATOM 1107 C GLU A 71 -10.362 -9.624 6.272 1.00 0.00 C ATOM 1108 O GLU A 71 -9.379 -10.245 6.694 1.00 0.00 O ATOM 1109 CB GLU A 71 -11.121 -10.187 3.944 1.00 0.00 C ATOM 1110 CG GLU A 71 -10.454 -11.581 3.924 1.00 0.00 C ATOM 1111 CD GLU A 71 -11.289 -12.612 3.167 1.00 0.00 C ATOM 1112 OE1 GLU A 71 -12.334 -13.043 3.705 1.00 0.00 O ATOM 1113 OE2 GLU A 71 -10.929 -12.983 2.031 1.00 0.00 O ATOM 0 H GLU A 71 -8.378 -9.619 4.695 1.00 0.00 H new ATOM 0 HA GLU A 71 -10.958 -8.199 4.755 1.00 0.00 H new ATOM 0 HB2 GLU A 71 -12.147 -10.296 4.295 1.00 0.00 H new ATOM 0 HB3 GLU A 71 -11.172 -9.810 2.923 1.00 0.00 H new ATOM 0 HG2 GLU A 71 -9.470 -11.504 3.462 1.00 0.00 H new ATOM 0 HG3 GLU A 71 -10.300 -11.922 4.948 1.00 0.00 H new ATOM 1120 N THR A 72 -11.421 -9.342 7.023 1.00 0.00 N ATOM 1121 CA THR A 72 -11.565 -9.816 8.394 1.00 0.00 C ATOM 1122 C THR A 72 -12.163 -11.235 8.366 1.00 0.00 C ATOM 1123 O THR A 72 -13.344 -11.397 8.058 1.00 0.00 O ATOM 1124 CB THR A 72 -12.467 -8.843 9.213 1.00 0.00 C ATOM 1125 OG1 THR A 72 -12.002 -7.501 9.005 1.00 0.00 O ATOM 1126 CG2 THR A 72 -12.466 -9.158 10.720 1.00 0.00 C ATOM 0 H THR A 72 -12.205 -8.777 6.697 1.00 0.00 H new ATOM 0 HA THR A 72 -10.590 -9.847 8.881 1.00 0.00 H new ATOM 0 HB THR A 72 -13.492 -8.964 8.863 1.00 0.00 H new ATOM 0 HG1 THR A 72 -11.784 -7.093 9.869 1.00 0.00 H new ATOM 0 HG21 THR A 72 -13.110 -8.449 11.240 1.00 0.00 H new ATOM 0 HG22 THR A 72 -12.836 -10.171 10.880 1.00 0.00 H new ATOM 0 HG23 THR A 72 -11.451 -9.077 11.108 1.00 0.00 H new ATOM 1134 N ARG A 73 -11.313 -12.250 8.607 1.00 0.00 N ATOM 1135 CA ARG A 73 -11.720 -13.669 8.661 1.00 0.00 C ATOM 1136 C ARG A 73 -12.667 -13.895 9.858 1.00 0.00 C ATOM 1137 O ARG A 73 -13.844 -14.223 9.690 1.00 0.00 O ATOM 1138 CB ARG A 73 -10.460 -14.589 8.776 1.00 0.00 C ATOM 1139 CG ARG A 73 -9.413 -14.404 7.652 1.00 0.00 C ATOM 1140 CD ARG A 73 -9.994 -14.647 6.244 1.00 0.00 C ATOM 1141 NE ARG A 73 -10.479 -16.025 6.063 1.00 0.00 N ATOM 1142 CZ ARG A 73 -11.007 -16.525 4.933 1.00 0.00 C ATOM 1143 NH1 ARG A 73 -11.169 -15.778 3.850 1.00 0.00 N ATOM 1144 NH2 ARG A 73 -11.388 -17.786 4.899 1.00 0.00 N ATOM 0 H ARG A 73 -10.316 -12.109 8.771 1.00 0.00 H new ATOM 0 HA ARG A 73 -12.248 -13.924 7.742 1.00 0.00 H new ATOM 0 HB2 ARG A 73 -9.978 -14.402 9.736 1.00 0.00 H new ATOM 0 HB3 ARG A 73 -10.787 -15.629 8.781 1.00 0.00 H new ATOM 0 HG2 ARG A 73 -9.008 -13.393 7.703 1.00 0.00 H new ATOM 0 HG3 ARG A 73 -8.582 -15.089 7.820 1.00 0.00 H new ATOM 0 HD2 ARG A 73 -10.814 -13.951 6.068 1.00 0.00 H new ATOM 0 HD3 ARG A 73 -9.229 -14.434 5.497 1.00 0.00 H new ATOM 0 HE ARG A 73 -10.408 -16.654 6.863 1.00 0.00 H new ATOM 0 HH11 ARG A 73 -10.890 -14.797 3.861 1.00 0.00 H new ATOM 0 HH12 ARG A 73 -11.573 -16.184 3.006 1.00 0.00 H new ATOM 0 HH21 ARG A 73 -11.281 -18.374 5.726 1.00 0.00 H new ATOM 0 HH22 ARG A 73 -11.790 -18.175 4.046 1.00 0.00 H new ATOM 1158 N LEU A 74 -12.125 -13.682 11.061 1.00 0.00 N ATOM 1159 CA LEU A 74 -12.851 -13.823 12.341 1.00 0.00 C ATOM 1160 C LEU A 74 -12.873 -12.467 13.048 1.00 0.00 C ATOM 1161 O LEU A 74 -12.003 -11.635 12.790 1.00 0.00 O ATOM 1162 CB LEU A 74 -12.144 -14.894 13.208 1.00 0.00 C ATOM 1163 CG LEU A 74 -12.182 -16.347 12.627 1.00 0.00 C ATOM 1164 CD1 LEU A 74 -11.161 -17.267 13.323 1.00 0.00 C ATOM 1165 CD2 LEU A 74 -13.612 -16.936 12.705 1.00 0.00 C ATOM 0 H LEU A 74 -11.152 -13.401 11.182 1.00 0.00 H new ATOM 0 HA LEU A 74 -13.879 -14.143 12.169 1.00 0.00 H new ATOM 0 HB2 LEU A 74 -11.103 -14.600 13.344 1.00 0.00 H new ATOM 0 HB3 LEU A 74 -12.605 -14.902 14.196 1.00 0.00 H new ATOM 0 HG LEU A 74 -11.898 -16.288 11.576 1.00 0.00 H new ATOM 0 HD11 LEU A 74 -11.218 -18.266 12.892 1.00 0.00 H new ATOM 0 HD12 LEU A 74 -10.156 -16.868 13.182 1.00 0.00 H new ATOM 0 HD13 LEU A 74 -11.385 -17.318 14.389 1.00 0.00 H new ATOM 0 HD21 LEU A 74 -13.612 -17.946 12.295 1.00 0.00 H new ATOM 0 HD22 LEU A 74 -13.937 -16.966 13.745 1.00 0.00 H new ATOM 0 HD23 LEU A 74 -14.295 -16.311 12.130 1.00 0.00 H new ATOM 1177 N ALA A 75 -13.859 -12.239 13.931 1.00 0.00 N ATOM 1178 CA ALA A 75 -13.999 -10.955 14.633 1.00 0.00 C ATOM 1179 C ALA A 75 -14.741 -11.106 15.963 1.00 0.00 C ATOM 1180 O ALA A 75 -15.762 -11.798 16.028 1.00 0.00 O ATOM 1181 CB ALA A 75 -14.707 -9.929 13.733 1.00 0.00 C ATOM 0 H ALA A 75 -14.570 -12.928 14.175 1.00 0.00 H new ATOM 0 HA ALA A 75 -12.996 -10.595 14.862 1.00 0.00 H new ATOM 0 HB1 ALA A 75 -14.804 -8.983 14.266 1.00 0.00 H new ATOM 0 HB2 ALA A 75 -14.122 -9.776 12.826 1.00 0.00 H new ATOM 0 HB3 ALA A 75 -15.697 -10.299 13.468 1.00 0.00 H new ATOM 1187 N GLY A 76 -14.209 -10.439 17.017 1.00 0.00 N ATOM 1188 CA GLY A 76 -14.820 -10.433 18.358 1.00 0.00 C ATOM 1189 C GLY A 76 -14.824 -11.805 19.029 1.00 0.00 C ATOM 1190 O GLY A 76 -15.667 -12.092 19.883 1.00 0.00 O ATOM 0 H GLY A 76 -13.349 -9.894 16.956 1.00 0.00 H new ATOM 0 HA2 GLY A 76 -14.281 -9.729 18.992 1.00 0.00 H new ATOM 0 HA3 GLY A 76 -15.845 -10.072 18.280 1.00 0.00 H new ATOM 1194 N VAL A 77 -13.854 -12.643 18.641 1.00 0.00 N ATOM 1195 CA VAL A 77 -13.734 -14.043 19.091 1.00 0.00 C ATOM 1196 C VAL A 77 -12.460 -14.226 19.938 1.00 0.00 C ATOM 1197 O VAL A 77 -11.660 -13.309 20.053 1.00 0.00 O ATOM 1198 CB VAL A 77 -13.716 -15.020 17.856 1.00 0.00 C ATOM 1199 CG1 VAL A 77 -15.067 -14.989 17.096 1.00 0.00 C ATOM 1200 CG2 VAL A 77 -12.533 -14.700 16.900 1.00 0.00 C ATOM 0 H VAL A 77 -13.116 -12.366 17.994 1.00 0.00 H new ATOM 0 HA VAL A 77 -14.600 -14.283 19.708 1.00 0.00 H new ATOM 0 HB VAL A 77 -13.571 -16.030 18.239 1.00 0.00 H new ATOM 0 HG11 VAL A 77 -15.024 -15.674 16.249 1.00 0.00 H new ATOM 0 HG12 VAL A 77 -15.869 -15.293 17.768 1.00 0.00 H new ATOM 0 HG13 VAL A 77 -15.259 -13.978 16.736 1.00 0.00 H new ATOM 0 HG21 VAL A 77 -12.548 -15.392 16.058 1.00 0.00 H new ATOM 0 HG22 VAL A 77 -12.629 -13.678 16.532 1.00 0.00 H new ATOM 0 HG23 VAL A 77 -11.591 -14.805 17.439 1.00 0.00 H new ATOM 1210 N GLU A 78 -12.281 -15.422 20.528 1.00 0.00 N ATOM 1211 CA GLU A 78 -11.107 -15.732 21.373 1.00 0.00 C ATOM 1212 C GLU A 78 -9.929 -16.225 20.507 1.00 0.00 C ATOM 1213 O GLU A 78 -10.117 -16.584 19.334 1.00 0.00 O ATOM 1214 CB GLU A 78 -11.479 -16.796 22.443 1.00 0.00 C ATOM 1215 CG GLU A 78 -11.891 -18.162 21.870 1.00 0.00 C ATOM 1216 CD GLU A 78 -12.380 -19.140 22.942 1.00 0.00 C ATOM 1217 OE1 GLU A 78 -11.545 -19.703 23.672 1.00 0.00 O ATOM 1218 OE2 GLU A 78 -13.602 -19.340 23.068 1.00 0.00 O ATOM 0 H GLU A 78 -12.938 -16.196 20.435 1.00 0.00 H new ATOM 0 HA GLU A 78 -10.798 -14.820 21.883 1.00 0.00 H new ATOM 0 HB2 GLU A 78 -10.627 -16.937 23.108 1.00 0.00 H new ATOM 0 HB3 GLU A 78 -12.297 -16.410 23.051 1.00 0.00 H new ATOM 0 HG2 GLU A 78 -12.680 -18.017 21.132 1.00 0.00 H new ATOM 0 HG3 GLU A 78 -11.042 -18.601 21.346 1.00 0.00 H new ATOM 1225 N GLY A 79 -8.730 -16.259 21.119 1.00 0.00 N ATOM 1226 CA GLY A 79 -7.498 -16.717 20.464 1.00 0.00 C ATOM 1227 C GLY A 79 -7.528 -18.177 20.033 1.00 0.00 C ATOM 1228 O GLY A 79 -6.751 -18.584 19.164 1.00 0.00 O ATOM 0 H GLY A 79 -8.592 -15.967 22.087 1.00 0.00 H new ATOM 0 HA2 GLY A 79 -7.312 -16.095 19.589 1.00 0.00 H new ATOM 0 HA3 GLY A 79 -6.660 -16.568 21.145 1.00 0.00 H new ATOM 1232 N GLU A 80 -8.407 -18.964 20.669 1.00 0.00 N ATOM 1233 CA GLU A 80 -8.609 -20.378 20.329 1.00 0.00 C ATOM 1234 C GLU A 80 -9.298 -20.493 18.958 1.00 0.00 C ATOM 1235 O GLU A 80 -8.943 -21.357 18.155 1.00 0.00 O ATOM 1236 CB GLU A 80 -9.442 -21.077 21.429 1.00 0.00 C ATOM 1237 CG GLU A 80 -9.561 -22.611 21.294 1.00 0.00 C ATOM 1238 CD GLU A 80 -10.380 -23.253 22.427 1.00 0.00 C ATOM 1239 OE1 GLU A 80 -9.943 -23.182 23.596 1.00 0.00 O ATOM 1240 OE2 GLU A 80 -11.441 -23.855 22.153 1.00 0.00 O ATOM 0 H GLU A 80 -8.998 -18.637 21.434 1.00 0.00 H new ATOM 0 HA GLU A 80 -7.641 -20.876 20.270 1.00 0.00 H new ATOM 0 HB2 GLU A 80 -8.999 -20.848 22.398 1.00 0.00 H new ATOM 0 HB3 GLU A 80 -10.445 -20.650 21.428 1.00 0.00 H new ATOM 0 HG2 GLU A 80 -10.025 -22.851 20.337 1.00 0.00 H new ATOM 0 HG3 GLU A 80 -8.562 -23.048 21.283 1.00 0.00 H new ATOM 1247 N GLU A 81 -10.283 -19.595 18.707 1.00 0.00 N ATOM 1248 CA GLU A 81 -10.973 -19.484 17.401 1.00 0.00 C ATOM 1249 C GLU A 81 -9.977 -19.057 16.314 1.00 0.00 C ATOM 1250 O GLU A 81 -10.004 -19.566 15.186 1.00 0.00 O ATOM 1251 CB GLU A 81 -12.129 -18.448 17.473 1.00 0.00 C ATOM 1252 CG GLU A 81 -13.236 -18.776 18.487 1.00 0.00 C ATOM 1253 CD GLU A 81 -14.022 -20.048 18.145 1.00 0.00 C ATOM 1254 OE1 GLU A 81 -14.798 -20.031 17.165 1.00 0.00 O ATOM 1255 OE2 GLU A 81 -13.879 -21.063 18.859 1.00 0.00 O ATOM 0 H GLU A 81 -10.619 -18.930 19.403 1.00 0.00 H new ATOM 0 HA GLU A 81 -11.389 -20.461 17.154 1.00 0.00 H new ATOM 0 HB2 GLU A 81 -11.708 -17.474 17.721 1.00 0.00 H new ATOM 0 HB3 GLU A 81 -12.578 -18.359 16.484 1.00 0.00 H new ATOM 0 HG2 GLU A 81 -12.791 -18.888 19.475 1.00 0.00 H new ATOM 0 HG3 GLU A 81 -13.927 -17.935 18.543 1.00 0.00 H new ATOM 1262 N ILE A 82 -9.099 -18.114 16.692 1.00 0.00 N ATOM 1263 CA ILE A 82 -8.063 -17.570 15.810 1.00 0.00 C ATOM 1264 C ILE A 82 -7.122 -18.700 15.332 1.00 0.00 C ATOM 1265 O ILE A 82 -7.046 -18.988 14.134 1.00 0.00 O ATOM 1266 CB ILE A 82 -7.245 -16.436 16.546 1.00 0.00 C ATOM 1267 CG1 ILE A 82 -8.186 -15.274 17.016 1.00 0.00 C ATOM 1268 CG2 ILE A 82 -6.091 -15.901 15.673 1.00 0.00 C ATOM 1269 CD1 ILE A 82 -9.000 -14.621 15.917 1.00 0.00 C ATOM 0 H ILE A 82 -9.091 -17.707 17.627 1.00 0.00 H new ATOM 0 HA ILE A 82 -8.545 -17.128 14.938 1.00 0.00 H new ATOM 0 HB ILE A 82 -6.797 -16.885 17.432 1.00 0.00 H new ATOM 0 HG12 ILE A 82 -8.870 -15.664 17.770 1.00 0.00 H new ATOM 0 HG13 ILE A 82 -7.579 -14.509 17.500 1.00 0.00 H new ATOM 0 HG21 ILE A 82 -5.554 -15.123 16.216 1.00 0.00 H new ATOM 0 HG22 ILE A 82 -5.407 -16.716 15.435 1.00 0.00 H new ATOM 0 HG23 ILE A 82 -6.495 -15.486 14.750 1.00 0.00 H new ATOM 0 HD11 ILE A 82 -9.618 -13.830 16.343 1.00 0.00 H new ATOM 0 HD12 ILE A 82 -8.329 -14.195 15.171 1.00 0.00 H new ATOM 0 HD13 ILE A 82 -9.639 -15.367 15.445 1.00 0.00 H new ATOM 1281 N ALA A 83 -6.497 -19.397 16.296 1.00 0.00 N ATOM 1282 CA ALA A 83 -5.517 -20.470 16.021 1.00 0.00 C ATOM 1283 C ALA A 83 -6.188 -21.707 15.379 1.00 0.00 C ATOM 1284 O ALA A 83 -5.512 -22.527 14.742 1.00 0.00 O ATOM 1285 CB ALA A 83 -4.773 -20.845 17.310 1.00 0.00 C ATOM 0 H ALA A 83 -6.655 -19.235 17.291 1.00 0.00 H new ATOM 0 HA ALA A 83 -4.793 -20.093 15.298 1.00 0.00 H new ATOM 0 HB1 ALA A 83 -4.053 -21.636 17.098 1.00 0.00 H new ATOM 0 HB2 ALA A 83 -4.248 -19.971 17.695 1.00 0.00 H new ATOM 0 HB3 ALA A 83 -5.488 -21.195 18.054 1.00 0.00 H new ATOM 1291 N ALA A 84 -7.528 -21.816 15.550 1.00 0.00 N ATOM 1292 CA ALA A 84 -8.349 -22.865 14.909 1.00 0.00 C ATOM 1293 C ALA A 84 -8.335 -22.731 13.375 1.00 0.00 C ATOM 1294 O ALA A 84 -8.519 -23.723 12.668 1.00 0.00 O ATOM 1295 CB ALA A 84 -9.792 -22.829 15.432 1.00 0.00 C ATOM 0 H ALA A 84 -8.067 -21.178 16.136 1.00 0.00 H new ATOM 0 HA ALA A 84 -7.908 -23.827 15.169 1.00 0.00 H new ATOM 0 HB1 ALA A 84 -10.375 -23.610 14.945 1.00 0.00 H new ATOM 0 HB2 ALA A 84 -9.793 -22.994 16.509 1.00 0.00 H new ATOM 0 HB3 ALA A 84 -10.234 -21.857 15.214 1.00 0.00 H new ATOM 1301 N LEU A 85 -8.169 -21.489 12.867 1.00 0.00 N ATOM 1302 CA LEU A 85 -7.937 -21.249 11.433 1.00 0.00 C ATOM 1303 C LEU A 85 -6.450 -21.431 11.061 1.00 0.00 C ATOM 1304 O LEU A 85 -6.149 -22.037 10.040 1.00 0.00 O ATOM 1305 CB LEU A 85 -8.373 -19.837 10.984 1.00 0.00 C ATOM 1306 CG LEU A 85 -8.172 -19.572 9.442 1.00 0.00 C ATOM 1307 CD1 LEU A 85 -9.473 -19.663 8.642 1.00 0.00 C ATOM 1308 CD2 LEU A 85 -7.379 -18.282 9.175 1.00 0.00 C ATOM 0 H LEU A 85 -8.192 -20.640 13.432 1.00 0.00 H new ATOM 0 HA LEU A 85 -8.548 -21.989 10.916 1.00 0.00 H new ATOM 0 HB2 LEU A 85 -9.424 -19.694 11.234 1.00 0.00 H new ATOM 0 HB3 LEU A 85 -7.807 -19.095 11.548 1.00 0.00 H new ATOM 0 HG LEU A 85 -7.555 -20.389 9.067 1.00 0.00 H new ATOM 0 HD11 LEU A 85 -9.267 -19.471 7.589 1.00 0.00 H new ATOM 0 HD12 LEU A 85 -9.899 -20.660 8.752 1.00 0.00 H new ATOM 0 HD13 LEU A 85 -10.181 -18.923 9.014 1.00 0.00 H new ATOM 0 HD21 LEU A 85 -7.265 -18.141 8.100 1.00 0.00 H new ATOM 0 HD22 LEU A 85 -7.914 -17.432 9.598 1.00 0.00 H new ATOM 0 HD23 LEU A 85 -6.395 -18.358 9.637 1.00 0.00 H new ATOM 1320 N LEU A 86 -5.528 -20.857 11.876 1.00 0.00 N ATOM 1321 CA LEU A 86 -4.070 -20.855 11.563 1.00 0.00 C ATOM 1322 C LEU A 86 -3.517 -22.284 11.373 1.00 0.00 C ATOM 1323 O LEU A 86 -2.571 -22.479 10.605 1.00 0.00 O ATOM 1324 CB LEU A 86 -3.216 -20.077 12.626 1.00 0.00 C ATOM 1325 CG LEU A 86 -3.169 -18.513 12.491 1.00 0.00 C ATOM 1326 CD1 LEU A 86 -2.862 -18.085 11.045 1.00 0.00 C ATOM 1327 CD2 LEU A 86 -4.448 -17.842 13.001 1.00 0.00 C ATOM 0 H LEU A 86 -5.764 -20.391 12.752 1.00 0.00 H new ATOM 0 HA LEU A 86 -3.976 -20.321 10.617 1.00 0.00 H new ATOM 0 HB2 LEU A 86 -3.602 -20.321 13.616 1.00 0.00 H new ATOM 0 HB3 LEU A 86 -2.194 -20.453 12.581 1.00 0.00 H new ATOM 0 HG LEU A 86 -2.354 -18.170 13.129 1.00 0.00 H new ATOM 0 HD11 LEU A 86 -2.836 -16.997 10.985 1.00 0.00 H new ATOM 0 HD12 LEU A 86 -1.895 -18.488 10.744 1.00 0.00 H new ATOM 0 HD13 LEU A 86 -3.637 -18.467 10.380 1.00 0.00 H new ATOM 0 HD21 LEU A 86 -4.363 -16.762 12.885 1.00 0.00 H new ATOM 0 HD22 LEU A 86 -5.302 -18.203 12.427 1.00 0.00 H new ATOM 0 HD23 LEU A 86 -4.590 -18.084 14.054 1.00 0.00 H new ATOM 1339 N GLU A 87 -4.134 -23.269 12.055 1.00 0.00 N ATOM 1340 CA GLU A 87 -3.771 -24.692 11.904 1.00 0.00 C ATOM 1341 C GLU A 87 -4.190 -25.228 10.510 1.00 0.00 C ATOM 1342 O GLU A 87 -3.489 -26.060 9.919 1.00 0.00 O ATOM 1343 CB GLU A 87 -4.399 -25.563 13.029 1.00 0.00 C ATOM 1344 CG GLU A 87 -5.939 -25.591 13.028 1.00 0.00 C ATOM 1345 CD GLU A 87 -6.535 -26.627 13.986 1.00 0.00 C ATOM 1346 OE1 GLU A 87 -6.397 -27.839 13.711 1.00 0.00 O ATOM 1347 OE2 GLU A 87 -7.151 -26.249 14.999 1.00 0.00 O ATOM 0 H GLU A 87 -4.890 -23.104 12.719 1.00 0.00 H new ATOM 0 HA GLU A 87 -2.687 -24.761 11.990 1.00 0.00 H new ATOM 0 HB2 GLU A 87 -4.029 -26.584 12.931 1.00 0.00 H new ATOM 0 HB3 GLU A 87 -4.055 -25.191 13.994 1.00 0.00 H new ATOM 0 HG2 GLU A 87 -6.312 -24.603 13.297 1.00 0.00 H new ATOM 0 HG3 GLU A 87 -6.289 -25.799 12.017 1.00 0.00 H new ATOM 1354 N ARG A 88 -5.335 -24.730 9.999 1.00 0.00 N ATOM 1355 CA ARG A 88 -5.899 -25.138 8.697 1.00 0.00 C ATOM 1356 C ARG A 88 -5.088 -24.528 7.548 1.00 0.00 C ATOM 1357 O ARG A 88 -4.722 -25.222 6.602 1.00 0.00 O ATOM 1358 CB ARG A 88 -7.386 -24.698 8.602 1.00 0.00 C ATOM 1359 CG ARG A 88 -8.281 -25.282 9.713 1.00 0.00 C ATOM 1360 CD ARG A 88 -9.720 -24.736 9.686 1.00 0.00 C ATOM 1361 NE ARG A 88 -10.546 -25.326 10.757 1.00 0.00 N ATOM 1362 CZ ARG A 88 -11.796 -24.960 11.068 1.00 0.00 C ATOM 1363 NH1 ARG A 88 -12.405 -23.976 10.423 1.00 0.00 N ATOM 1364 NH2 ARG A 88 -12.430 -25.587 12.039 1.00 0.00 N ATOM 0 H ARG A 88 -5.897 -24.029 10.482 1.00 0.00 H new ATOM 0 HA ARG A 88 -5.847 -26.224 8.616 1.00 0.00 H new ATOM 0 HB2 ARG A 88 -7.436 -23.610 8.643 1.00 0.00 H new ATOM 0 HB3 ARG A 88 -7.783 -25.000 7.633 1.00 0.00 H new ATOM 0 HG2 ARG A 88 -8.310 -26.367 9.614 1.00 0.00 H new ATOM 0 HG3 ARG A 88 -7.835 -25.062 10.683 1.00 0.00 H new ATOM 0 HD2 ARG A 88 -9.700 -23.652 9.797 1.00 0.00 H new ATOM 0 HD3 ARG A 88 -10.172 -24.949 8.718 1.00 0.00 H new ATOM 0 HE ARG A 88 -10.129 -26.077 11.307 1.00 0.00 H new ATOM 0 HH11 ARG A 88 -11.921 -23.481 9.674 1.00 0.00 H new ATOM 0 HH12 ARG A 88 -13.358 -23.713 10.676 1.00 0.00 H new ATOM 0 HH21 ARG A 88 -11.968 -26.343 12.545 1.00 0.00 H new ATOM 0 HH22 ARG A 88 -13.382 -25.316 12.284 1.00 0.00 H new ATOM 1378 N GLU A 89 -4.799 -23.222 7.664 1.00 0.00 N ATOM 1379 CA GLU A 89 -4.089 -22.459 6.628 1.00 0.00 C ATOM 1380 C GLU A 89 -2.664 -22.985 6.439 1.00 0.00 C ATOM 1381 O GLU A 89 -2.200 -23.124 5.314 1.00 0.00 O ATOM 1382 CB GLU A 89 -4.075 -20.946 6.970 1.00 0.00 C ATOM 1383 CG GLU A 89 -5.458 -20.335 7.178 1.00 0.00 C ATOM 1384 CD GLU A 89 -6.436 -20.587 6.017 1.00 0.00 C ATOM 1385 OE1 GLU A 89 -6.336 -19.897 4.982 1.00 0.00 O ATOM 1386 OE2 GLU A 89 -7.300 -21.486 6.131 1.00 0.00 O ATOM 0 H GLU A 89 -5.052 -22.666 8.481 1.00 0.00 H new ATOM 0 HA GLU A 89 -4.625 -22.591 5.688 1.00 0.00 H new ATOM 0 HB2 GLU A 89 -3.485 -20.795 7.874 1.00 0.00 H new ATOM 0 HB3 GLU A 89 -3.571 -20.409 6.167 1.00 0.00 H new ATOM 0 HG2 GLU A 89 -5.888 -20.738 8.095 1.00 0.00 H new ATOM 0 HG3 GLU A 89 -5.351 -19.260 7.322 1.00 0.00 H new ATOM 1393 N ARG A 90 -1.989 -23.280 7.565 1.00 0.00 N ATOM 1394 CA ARG A 90 -0.609 -23.831 7.553 1.00 0.00 C ATOM 1395 C ARG A 90 -0.583 -25.274 6.994 1.00 0.00 C ATOM 1396 O ARG A 90 0.430 -25.708 6.432 1.00 0.00 O ATOM 1397 CB ARG A 90 0.057 -23.761 8.958 1.00 0.00 C ATOM 1398 CG ARG A 90 -0.467 -24.792 9.972 1.00 0.00 C ATOM 1399 CD ARG A 90 0.102 -24.603 11.385 1.00 0.00 C ATOM 1400 NE ARG A 90 -0.365 -25.671 12.289 1.00 0.00 N ATOM 1401 CZ ARG A 90 -0.609 -25.542 13.600 1.00 0.00 C ATOM 1402 NH1 ARG A 90 -0.418 -24.388 14.218 1.00 0.00 N ATOM 1403 NH2 ARG A 90 -1.069 -26.579 14.282 1.00 0.00 N ATOM 0 H ARG A 90 -2.373 -23.148 8.501 1.00 0.00 H new ATOM 0 HA ARG A 90 -0.020 -23.203 6.885 1.00 0.00 H new ATOM 0 HB2 ARG A 90 1.132 -23.900 8.842 1.00 0.00 H new ATOM 0 HB3 ARG A 90 -0.093 -22.762 9.366 1.00 0.00 H new ATOM 0 HG2 ARG A 90 -1.554 -24.728 10.015 1.00 0.00 H new ATOM 0 HG3 ARG A 90 -0.220 -25.794 9.620 1.00 0.00 H new ATOM 0 HD2 ARG A 90 1.191 -24.605 11.346 1.00 0.00 H new ATOM 0 HD3 ARG A 90 -0.201 -23.632 11.776 1.00 0.00 H new ATOM 0 HE ARG A 90 -0.516 -26.592 11.878 1.00 0.00 H new ATOM 0 HH11 ARG A 90 -0.080 -23.580 13.696 1.00 0.00 H new ATOM 0 HH12 ARG A 90 -0.609 -24.307 15.217 1.00 0.00 H new ATOM 0 HH21 ARG A 90 -1.235 -27.467 13.809 1.00 0.00 H new ATOM 0 HH22 ARG A 90 -1.258 -26.490 15.280 1.00 0.00 H new ATOM 1417 N ARG A 91 -1.705 -26.004 7.171 1.00 0.00 N ATOM 1418 CA ARG A 91 -1.870 -27.389 6.675 1.00 0.00 C ATOM 1419 C ARG A 91 -1.786 -27.404 5.131 1.00 0.00 C ATOM 1420 O ARG A 91 -1.091 -28.244 4.546 1.00 0.00 O ATOM 1421 CB ARG A 91 -3.231 -27.975 7.192 1.00 0.00 C ATOM 1422 CG ARG A 91 -3.402 -29.522 7.135 1.00 0.00 C ATOM 1423 CD ARG A 91 -3.676 -30.091 5.727 1.00 0.00 C ATOM 1424 NE ARG A 91 -3.839 -31.560 5.754 1.00 0.00 N ATOM 1425 CZ ARG A 91 -3.918 -32.359 4.676 1.00 0.00 C ATOM 1426 NH1 ARG A 91 -3.796 -31.876 3.447 1.00 0.00 N ATOM 1427 NH2 ARG A 91 -4.119 -33.655 4.843 1.00 0.00 N ATOM 0 H ARG A 91 -2.525 -25.649 7.663 1.00 0.00 H new ATOM 0 HA ARG A 91 -1.068 -28.021 7.057 1.00 0.00 H new ATOM 0 HB2 ARG A 91 -3.366 -27.657 8.226 1.00 0.00 H new ATOM 0 HB3 ARG A 91 -4.036 -27.524 6.612 1.00 0.00 H new ATOM 0 HG2 ARG A 91 -2.500 -29.988 7.531 1.00 0.00 H new ATOM 0 HG3 ARG A 91 -4.223 -29.807 7.793 1.00 0.00 H new ATOM 0 HD2 ARG A 91 -4.576 -29.632 5.318 1.00 0.00 H new ATOM 0 HD3 ARG A 91 -2.854 -29.828 5.062 1.00 0.00 H new ATOM 0 HE ARG A 91 -3.896 -32.006 6.670 1.00 0.00 H new ATOM 0 HH11 ARG A 91 -3.639 -30.878 3.304 1.00 0.00 H new ATOM 0 HH12 ARG A 91 -3.860 -32.502 2.644 1.00 0.00 H new ATOM 0 HH21 ARG A 91 -4.213 -34.040 5.783 1.00 0.00 H new ATOM 0 HH22 ARG A 91 -4.181 -34.270 4.032 1.00 0.00 H new ATOM 1441 N PHE A 92 -2.499 -26.463 4.489 1.00 0.00 N ATOM 1442 CA PHE A 92 -2.505 -26.318 3.023 1.00 0.00 C ATOM 1443 C PHE A 92 -1.206 -25.638 2.532 1.00 0.00 C ATOM 1444 O PHE A 92 -0.579 -26.097 1.570 1.00 0.00 O ATOM 1445 CB PHE A 92 -3.756 -25.519 2.564 1.00 0.00 C ATOM 1446 CG PHE A 92 -5.069 -26.300 2.678 1.00 0.00 C ATOM 1447 CD1 PHE A 92 -5.727 -26.429 3.900 1.00 0.00 C ATOM 1448 CD2 PHE A 92 -5.639 -26.914 1.562 1.00 0.00 C ATOM 1449 CE1 PHE A 92 -6.909 -27.135 4.004 1.00 0.00 C ATOM 1450 CE2 PHE A 92 -6.823 -27.623 1.666 1.00 0.00 C ATOM 1451 CZ PHE A 92 -7.456 -27.734 2.885 1.00 0.00 C ATOM 0 H PHE A 92 -3.087 -25.782 4.971 1.00 0.00 H new ATOM 0 HA PHE A 92 -2.550 -27.312 2.579 1.00 0.00 H new ATOM 0 HB2 PHE A 92 -3.833 -24.610 3.160 1.00 0.00 H new ATOM 0 HB3 PHE A 92 -3.617 -25.210 1.528 1.00 0.00 H new ATOM 0 HD1 PHE A 92 -5.305 -25.969 4.781 1.00 0.00 H new ATOM 0 HD2 PHE A 92 -5.149 -26.835 0.603 1.00 0.00 H new ATOM 0 HE1 PHE A 92 -7.406 -27.219 4.959 1.00 0.00 H new ATOM 0 HE2 PHE A 92 -7.251 -28.090 0.791 1.00 0.00 H new ATOM 0 HZ PHE A 92 -8.379 -28.289 2.966 1.00 0.00 H new ATOM 1461 N ASP A 93 -0.803 -24.559 3.219 1.00 0.00 N ATOM 1462 CA ASP A 93 0.399 -23.765 2.881 1.00 0.00 C ATOM 1463 C ASP A 93 0.972 -23.106 4.154 1.00 0.00 C ATOM 1464 O ASP A 93 0.421 -22.140 4.693 1.00 0.00 O ATOM 1465 CB ASP A 93 0.093 -22.716 1.763 1.00 0.00 C ATOM 1466 CG ASP A 93 -1.089 -21.788 2.092 1.00 0.00 C ATOM 1467 OD1 ASP A 93 -2.245 -22.251 2.017 1.00 0.00 O ATOM 1468 OD2 ASP A 93 -0.873 -20.604 2.442 1.00 0.00 O ATOM 0 H ASP A 93 -1.304 -24.205 4.034 1.00 0.00 H new ATOM 0 HA ASP A 93 1.159 -24.435 2.478 1.00 0.00 H new ATOM 0 HB2 ASP A 93 0.983 -22.110 1.593 1.00 0.00 H new ATOM 0 HB3 ASP A 93 -0.118 -23.242 0.832 1.00 0.00 H new ATOM 1473 N SER A 94 2.082 -23.681 4.646 1.00 0.00 N ATOM 1474 CA SER A 94 2.768 -23.221 5.867 1.00 0.00 C ATOM 1475 C SER A 94 3.401 -21.837 5.656 1.00 0.00 C ATOM 1476 O SER A 94 3.530 -21.060 6.596 1.00 0.00 O ATOM 1477 CB SER A 94 3.831 -24.256 6.301 1.00 0.00 C ATOM 1478 OG SER A 94 4.467 -23.891 7.520 1.00 0.00 O ATOM 0 H SER A 94 2.532 -24.483 4.205 1.00 0.00 H new ATOM 0 HA SER A 94 2.030 -23.127 6.664 1.00 0.00 H new ATOM 0 HB2 SER A 94 3.360 -25.232 6.417 1.00 0.00 H new ATOM 0 HB3 SER A 94 4.581 -24.355 5.517 1.00 0.00 H new ATOM 0 HG SER A 94 5.130 -24.572 7.760 1.00 0.00 H new ATOM 1484 N ASP A 95 3.708 -21.516 4.390 1.00 0.00 N ATOM 1485 CA ASP A 95 4.414 -20.273 3.985 1.00 0.00 C ATOM 1486 C ASP A 95 3.589 -18.968 4.195 1.00 0.00 C ATOM 1487 O ASP A 95 3.956 -17.904 3.666 1.00 0.00 O ATOM 1488 CB ASP A 95 4.880 -20.412 2.512 1.00 0.00 C ATOM 1489 CG ASP A 95 3.725 -20.755 1.566 1.00 0.00 C ATOM 1490 OD1 ASP A 95 3.076 -19.832 1.038 1.00 0.00 O ATOM 1491 OD2 ASP A 95 3.453 -21.961 1.369 1.00 0.00 O ATOM 0 H ASP A 95 3.472 -22.117 3.600 1.00 0.00 H new ATOM 0 HA ASP A 95 5.273 -20.165 4.647 1.00 0.00 H new ATOM 0 HB2 ASP A 95 5.345 -19.480 2.191 1.00 0.00 H new ATOM 0 HB3 ASP A 95 5.643 -21.188 2.446 1.00 0.00 H new ATOM 1496 N LEU A 96 2.503 -19.041 4.977 1.00 0.00 N ATOM 1497 CA LEU A 96 1.822 -17.857 5.511 1.00 0.00 C ATOM 1498 C LEU A 96 2.645 -17.262 6.686 1.00 0.00 C ATOM 1499 O LEU A 96 3.533 -17.925 7.249 1.00 0.00 O ATOM 1500 CB LEU A 96 0.385 -18.237 5.979 1.00 0.00 C ATOM 1501 CG LEU A 96 0.273 -18.950 7.390 1.00 0.00 C ATOM 1502 CD1 LEU A 96 -0.250 -17.994 8.476 1.00 0.00 C ATOM 1503 CD2 LEU A 96 -0.577 -20.219 7.338 1.00 0.00 C ATOM 0 H LEU A 96 2.073 -19.923 5.256 1.00 0.00 H new ATOM 0 HA LEU A 96 1.741 -17.102 4.729 1.00 0.00 H new ATOM 0 HB2 LEU A 96 -0.218 -17.329 6.005 1.00 0.00 H new ATOM 0 HB3 LEU A 96 -0.058 -18.892 5.228 1.00 0.00 H new ATOM 0 HG LEU A 96 1.287 -19.246 7.658 1.00 0.00 H new ATOM 0 HD11 LEU A 96 -0.312 -18.523 9.427 1.00 0.00 H new ATOM 0 HD12 LEU A 96 0.430 -17.148 8.574 1.00 0.00 H new ATOM 0 HD13 LEU A 96 -1.240 -17.633 8.197 1.00 0.00 H new ATOM 0 HD21 LEU A 96 -0.621 -20.668 8.330 1.00 0.00 H new ATOM 0 HD22 LEU A 96 -1.585 -19.968 7.008 1.00 0.00 H new ATOM 0 HD23 LEU A 96 -0.132 -20.927 6.639 1.00 0.00 H new ATOM 1515 N TRP A 97 2.327 -16.013 7.045 1.00 0.00 N ATOM 1516 CA TRP A 97 2.970 -15.270 8.141 1.00 0.00 C ATOM 1517 C TRP A 97 1.910 -14.937 9.185 1.00 0.00 C ATOM 1518 O TRP A 97 0.879 -14.371 8.842 1.00 0.00 O ATOM 1519 CB TRP A 97 3.578 -13.947 7.609 1.00 0.00 C ATOM 1520 CG TRP A 97 4.712 -14.093 6.624 1.00 0.00 C ATOM 1521 CD1 TRP A 97 4.749 -14.845 5.482 1.00 0.00 C ATOM 1522 CD2 TRP A 97 5.958 -13.405 6.679 1.00 0.00 C ATOM 1523 NE1 TRP A 97 5.967 -14.717 4.879 1.00 0.00 N ATOM 1524 CE2 TRP A 97 6.721 -13.827 5.581 1.00 0.00 C ATOM 1525 CE3 TRP A 97 6.500 -12.483 7.569 1.00 0.00 C ATOM 1526 CZ2 TRP A 97 8.001 -13.358 5.345 1.00 0.00 C ATOM 1527 CZ3 TRP A 97 7.773 -12.013 7.337 1.00 0.00 C ATOM 1528 CH2 TRP A 97 8.508 -12.451 6.228 1.00 0.00 C ATOM 0 H TRP A 97 1.599 -15.476 6.573 1.00 0.00 H new ATOM 0 HA TRP A 97 3.764 -15.879 8.574 1.00 0.00 H new ATOM 0 HB2 TRP A 97 2.784 -13.369 7.137 1.00 0.00 H new ATOM 0 HB3 TRP A 97 3.933 -13.365 8.459 1.00 0.00 H new ATOM 0 HD1 TRP A 97 3.935 -15.451 5.112 1.00 0.00 H new ATOM 0 HE1 TRP A 97 6.265 -15.210 4.037 1.00 0.00 H new ATOM 0 HE3 TRP A 97 5.934 -12.143 8.424 1.00 0.00 H new ATOM 0 HZ2 TRP A 97 8.576 -13.697 4.496 1.00 0.00 H new ATOM 0 HZ3 TRP A 97 8.210 -11.298 8.018 1.00 0.00 H new ATOM 0 HH2 TRP A 97 9.502 -12.060 6.068 1.00 0.00 H new ATOM 1539 N VAL A 98 2.166 -15.268 10.453 1.00 0.00 N ATOM 1540 CA VAL A 98 1.259 -14.908 11.557 1.00 0.00 C ATOM 1541 C VAL A 98 1.849 -13.706 12.278 1.00 0.00 C ATOM 1542 O VAL A 98 3.036 -13.700 12.598 1.00 0.00 O ATOM 1543 CB VAL A 98 1.010 -16.068 12.585 1.00 0.00 C ATOM 1544 CG1 VAL A 98 -0.031 -15.644 13.655 1.00 0.00 C ATOM 1545 CG2 VAL A 98 0.563 -17.355 11.869 1.00 0.00 C ATOM 0 H VAL A 98 2.995 -15.786 10.746 1.00 0.00 H new ATOM 0 HA VAL A 98 0.286 -14.686 11.120 1.00 0.00 H new ATOM 0 HB VAL A 98 1.953 -16.275 13.091 1.00 0.00 H new ATOM 0 HG11 VAL A 98 -0.187 -16.464 14.356 1.00 0.00 H new ATOM 0 HG12 VAL A 98 0.336 -14.771 14.194 1.00 0.00 H new ATOM 0 HG13 VAL A 98 -0.975 -15.399 13.168 1.00 0.00 H new ATOM 0 HG21 VAL A 98 0.398 -18.142 12.605 1.00 0.00 H new ATOM 0 HG22 VAL A 98 -0.363 -17.166 11.325 1.00 0.00 H new ATOM 0 HG23 VAL A 98 1.337 -17.670 11.169 1.00 0.00 H new ATOM 1555 N VAL A 99 1.025 -12.674 12.486 1.00 0.00 N ATOM 1556 CA VAL A 99 1.441 -11.432 13.156 1.00 0.00 C ATOM 1557 C VAL A 99 0.420 -11.109 14.244 1.00 0.00 C ATOM 1558 O VAL A 99 -0.759 -10.948 13.933 1.00 0.00 O ATOM 1559 CB VAL A 99 1.520 -10.203 12.156 1.00 0.00 C ATOM 1560 CG1 VAL A 99 2.315 -9.024 12.764 1.00 0.00 C ATOM 1561 CG2 VAL A 99 2.083 -10.622 10.773 1.00 0.00 C ATOM 0 H VAL A 99 0.048 -12.674 12.195 1.00 0.00 H new ATOM 0 HA VAL A 99 2.438 -11.589 13.568 1.00 0.00 H new ATOM 0 HB VAL A 99 0.500 -9.855 11.994 1.00 0.00 H new ATOM 0 HG11 VAL A 99 2.348 -8.201 12.050 1.00 0.00 H new ATOM 0 HG12 VAL A 99 1.828 -8.691 13.680 1.00 0.00 H new ATOM 0 HG13 VAL A 99 3.331 -9.348 12.991 1.00 0.00 H new ATOM 0 HG21 VAL A 99 2.121 -9.752 10.117 1.00 0.00 H new ATOM 0 HG22 VAL A 99 3.087 -11.028 10.897 1.00 0.00 H new ATOM 0 HG23 VAL A 99 1.437 -11.381 10.332 1.00 0.00 H new ATOM 1571 N GLU A 100 0.854 -11.011 15.504 1.00 0.00 N ATOM 1572 CA GLU A 100 -0.008 -10.494 16.571 1.00 0.00 C ATOM 1573 C GLU A 100 0.111 -8.969 16.569 1.00 0.00 C ATOM 1574 O GLU A 100 1.216 -8.431 16.444 1.00 0.00 O ATOM 1575 CB GLU A 100 0.380 -11.067 17.964 1.00 0.00 C ATOM 1576 CG GLU A 100 1.809 -10.717 18.444 1.00 0.00 C ATOM 1577 CD GLU A 100 2.076 -11.151 19.889 1.00 0.00 C ATOM 1578 OE1 GLU A 100 1.655 -10.432 20.819 1.00 0.00 O ATOM 1579 OE2 GLU A 100 2.674 -12.225 20.109 1.00 0.00 O ATOM 0 H GLU A 100 1.789 -11.280 15.809 1.00 0.00 H new ATOM 0 HA GLU A 100 -1.036 -10.804 16.384 1.00 0.00 H new ATOM 0 HB2 GLU A 100 -0.334 -10.701 18.702 1.00 0.00 H new ATOM 0 HB3 GLU A 100 0.279 -12.152 17.934 1.00 0.00 H new ATOM 0 HG2 GLU A 100 2.535 -11.195 17.786 1.00 0.00 H new ATOM 0 HG3 GLU A 100 1.962 -9.641 18.359 1.00 0.00 H new ATOM 1586 N ILE A 101 -1.030 -8.281 16.621 1.00 0.00 N ATOM 1587 CA ILE A 101 -1.092 -6.828 16.791 1.00 0.00 C ATOM 1588 C ILE A 101 -2.080 -6.529 17.934 1.00 0.00 C ATOM 1589 O ILE A 101 -3.209 -6.997 17.924 1.00 0.00 O ATOM 1590 CB ILE A 101 -1.485 -6.063 15.458 1.00 0.00 C ATOM 1591 CG1 ILE A 101 -2.887 -6.492 14.922 1.00 0.00 C ATOM 1592 CG2 ILE A 101 -0.407 -6.266 14.353 1.00 0.00 C ATOM 1593 CD1 ILE A 101 -3.406 -5.647 13.778 1.00 0.00 C ATOM 0 H ILE A 101 -1.947 -8.721 16.546 1.00 0.00 H new ATOM 0 HA ILE A 101 -0.098 -6.457 17.042 1.00 0.00 H new ATOM 0 HB ILE A 101 -1.535 -5.004 15.712 1.00 0.00 H new ATOM 0 HG12 ILE A 101 -2.835 -7.531 14.596 1.00 0.00 H new ATOM 0 HG13 ILE A 101 -3.604 -6.451 15.742 1.00 0.00 H new ATOM 0 HG21 ILE A 101 -0.704 -5.730 13.452 1.00 0.00 H new ATOM 0 HG22 ILE A 101 0.551 -5.882 14.704 1.00 0.00 H new ATOM 0 HG23 ILE A 101 -0.312 -7.328 14.128 1.00 0.00 H new ATOM 0 HD11 ILE A 101 -4.384 -6.015 13.469 1.00 0.00 H new ATOM 0 HD12 ILE A 101 -3.494 -4.610 14.102 1.00 0.00 H new ATOM 0 HD13 ILE A 101 -2.714 -5.707 12.938 1.00 0.00 H new ATOM 1605 N GLU A 102 -1.623 -5.800 18.952 1.00 0.00 N ATOM 1606 CA GLU A 102 -2.441 -5.449 20.117 1.00 0.00 C ATOM 1607 C GLU A 102 -2.911 -3.999 19.934 1.00 0.00 C ATOM 1608 O GLU A 102 -2.132 -3.056 20.129 1.00 0.00 O ATOM 1609 CB GLU A 102 -1.618 -5.650 21.430 1.00 0.00 C ATOM 1610 CG GLU A 102 -2.455 -5.828 22.721 1.00 0.00 C ATOM 1611 CD GLU A 102 -3.325 -4.612 23.101 1.00 0.00 C ATOM 1612 OE1 GLU A 102 -2.757 -3.580 23.521 1.00 0.00 O ATOM 1613 OE2 GLU A 102 -4.569 -4.678 22.981 1.00 0.00 O ATOM 0 H GLU A 102 -0.672 -5.434 18.994 1.00 0.00 H new ATOM 0 HA GLU A 102 -3.314 -6.096 20.200 1.00 0.00 H new ATOM 0 HB2 GLU A 102 -0.980 -6.525 21.308 1.00 0.00 H new ATOM 0 HB3 GLU A 102 -0.959 -4.791 21.560 1.00 0.00 H new ATOM 0 HG2 GLU A 102 -3.102 -6.697 22.601 1.00 0.00 H new ATOM 0 HG3 GLU A 102 -1.779 -6.046 23.548 1.00 0.00 H new ATOM 1620 N THR A 103 -4.179 -3.847 19.541 1.00 0.00 N ATOM 1621 CA THR A 103 -4.780 -2.549 19.208 1.00 0.00 C ATOM 1622 C THR A 103 -6.310 -2.688 19.179 1.00 0.00 C ATOM 1623 O THR A 103 -6.834 -3.796 19.020 1.00 0.00 O ATOM 1624 CB THR A 103 -4.245 -2.007 17.833 1.00 0.00 C ATOM 1625 OG1 THR A 103 -4.896 -0.769 17.488 1.00 0.00 O ATOM 1626 CG2 THR A 103 -4.419 -3.032 16.692 1.00 0.00 C ATOM 0 H THR A 103 -4.826 -4.630 19.444 1.00 0.00 H new ATOM 0 HA THR A 103 -4.497 -1.826 19.974 1.00 0.00 H new ATOM 0 HB THR A 103 -3.176 -1.830 17.956 1.00 0.00 H new ATOM 0 HG1 THR A 103 -5.503 -0.918 16.733 1.00 0.00 H new ATOM 0 HG21 THR A 103 -4.035 -2.611 15.763 1.00 0.00 H new ATOM 0 HG22 THR A 103 -3.869 -3.942 16.933 1.00 0.00 H new ATOM 0 HG23 THR A 103 -5.476 -3.268 16.573 1.00 0.00 H new ATOM 1634 N ASP A 104 -7.027 -1.572 19.375 1.00 0.00 N ATOM 1635 CA ASP A 104 -8.507 -1.557 19.357 1.00 0.00 C ATOM 1636 C ASP A 104 -9.023 -1.200 17.949 1.00 0.00 C ATOM 1637 O ASP A 104 -10.119 -1.613 17.547 1.00 0.00 O ATOM 1638 CB ASP A 104 -9.058 -0.557 20.420 1.00 0.00 C ATOM 1639 CG ASP A 104 -8.866 0.926 20.046 1.00 0.00 C ATOM 1640 OD1 ASP A 104 -7.700 1.363 19.898 1.00 0.00 O ATOM 1641 OD2 ASP A 104 -9.874 1.655 19.894 1.00 0.00 O ATOM 0 H ASP A 104 -6.607 -0.659 19.549 1.00 0.00 H new ATOM 0 HA ASP A 104 -8.867 -2.554 19.611 1.00 0.00 H new ATOM 0 HB2 ASP A 104 -10.121 -0.749 20.568 1.00 0.00 H new ATOM 0 HB3 ASP A 104 -8.564 -0.747 21.373 1.00 0.00 H new ATOM 1646 N GLU A 105 -8.212 -0.430 17.221 1.00 0.00 N ATOM 1647 CA GLU A 105 -8.502 0.032 15.851 1.00 0.00 C ATOM 1648 C GLU A 105 -7.689 -0.787 14.851 1.00 0.00 C ATOM 1649 O GLU A 105 -6.607 -1.277 15.183 1.00 0.00 O ATOM 1650 CB GLU A 105 -8.172 1.547 15.734 1.00 0.00 C ATOM 1651 CG GLU A 105 -6.808 1.959 16.331 1.00 0.00 C ATOM 1652 CD GLU A 105 -6.642 3.474 16.477 1.00 0.00 C ATOM 1653 OE1 GLU A 105 -7.379 4.082 17.289 1.00 0.00 O ATOM 1654 OE2 GLU A 105 -5.785 4.069 15.799 1.00 0.00 O ATOM 0 H GLU A 105 -7.313 -0.099 17.571 1.00 0.00 H new ATOM 0 HA GLU A 105 -9.560 -0.108 15.627 1.00 0.00 H new ATOM 0 HB2 GLU A 105 -8.193 1.829 14.681 1.00 0.00 H new ATOM 0 HB3 GLU A 105 -8.958 2.115 16.232 1.00 0.00 H new ATOM 0 HG2 GLU A 105 -6.692 1.492 17.309 1.00 0.00 H new ATOM 0 HG3 GLU A 105 -6.010 1.573 15.697 1.00 0.00 H new ATOM 1661 N ILE A 106 -8.203 -0.930 13.624 1.00 0.00 N ATOM 1662 CA ILE A 106 -7.571 -1.768 12.599 1.00 0.00 C ATOM 1663 C ILE A 106 -7.327 -1.003 11.286 1.00 0.00 C ATOM 1664 O ILE A 106 -6.268 -1.167 10.682 1.00 0.00 O ATOM 1665 CB ILE A 106 -8.413 -3.074 12.321 1.00 0.00 C ATOM 1666 CG1 ILE A 106 -7.647 -4.035 11.353 1.00 0.00 C ATOM 1667 CG2 ILE A 106 -9.843 -2.754 11.810 1.00 0.00 C ATOM 1668 CD1 ILE A 106 -6.321 -4.549 11.880 1.00 0.00 C ATOM 0 H ILE A 106 -9.061 -0.473 13.316 1.00 0.00 H new ATOM 0 HA ILE A 106 -6.599 -2.059 12.998 1.00 0.00 H new ATOM 0 HB ILE A 106 -8.538 -3.591 13.273 1.00 0.00 H new ATOM 0 HG12 ILE A 106 -8.288 -4.888 11.129 1.00 0.00 H new ATOM 0 HG13 ILE A 106 -7.470 -3.514 10.412 1.00 0.00 H new ATOM 0 HG21 ILE A 106 -10.383 -3.684 11.633 1.00 0.00 H new ATOM 0 HG22 ILE A 106 -10.373 -2.163 12.557 1.00 0.00 H new ATOM 0 HG23 ILE A 106 -9.779 -2.189 10.880 1.00 0.00 H new ATOM 0 HD11 ILE A 106 -5.865 -5.207 11.140 1.00 0.00 H new ATOM 0 HD12 ILE A 106 -5.656 -3.707 12.076 1.00 0.00 H new ATOM 0 HD13 ILE A 106 -6.487 -5.103 12.804 1.00 0.00 H new ATOM 1680 N GLY A 107 -8.281 -0.136 10.889 1.00 0.00 N ATOM 1681 CA GLY A 107 -8.303 0.437 9.536 1.00 0.00 C ATOM 1682 C GLY A 107 -7.063 1.272 9.218 1.00 0.00 C ATOM 1683 O GLY A 107 -6.473 1.143 8.138 1.00 0.00 O ATOM 0 H GLY A 107 -9.043 0.180 11.489 1.00 0.00 H new ATOM 0 HA2 GLY A 107 -8.387 -0.370 8.808 1.00 0.00 H new ATOM 0 HA3 GLY A 107 -9.191 1.060 9.426 1.00 0.00 H new ATOM 1687 N THR A 108 -6.658 2.089 10.196 1.00 0.00 N ATOM 1688 CA THR A 108 -5.510 3.001 10.091 1.00 0.00 C ATOM 1689 C THR A 108 -4.160 2.257 9.943 1.00 0.00 C ATOM 1690 O THR A 108 -3.196 2.817 9.404 1.00 0.00 O ATOM 1691 CB THR A 108 -5.465 3.954 11.334 1.00 0.00 C ATOM 1692 OG1 THR A 108 -4.415 4.923 11.179 1.00 0.00 O ATOM 1693 CG2 THR A 108 -5.276 3.185 12.659 1.00 0.00 C ATOM 0 H THR A 108 -7.127 2.137 11.101 1.00 0.00 H new ATOM 0 HA THR A 108 -5.651 3.584 9.181 1.00 0.00 H new ATOM 0 HB THR A 108 -6.429 4.460 11.384 1.00 0.00 H new ATOM 0 HG1 THR A 108 -4.397 5.514 11.961 1.00 0.00 H new ATOM 0 HG21 THR A 108 -5.251 3.891 13.489 1.00 0.00 H new ATOM 0 HG22 THR A 108 -6.104 2.490 12.798 1.00 0.00 H new ATOM 0 HG23 THR A 108 -4.338 2.630 12.627 1.00 0.00 H new ATOM 1701 N LEU A 109 -4.110 0.996 10.405 1.00 0.00 N ATOM 1702 CA LEU A 109 -2.862 0.208 10.485 1.00 0.00 C ATOM 1703 C LEU A 109 -2.927 -1.091 9.645 1.00 0.00 C ATOM 1704 O LEU A 109 -1.937 -1.831 9.573 1.00 0.00 O ATOM 1705 CB LEU A 109 -2.521 -0.049 11.992 1.00 0.00 C ATOM 1706 CG LEU A 109 -3.702 -0.522 12.928 1.00 0.00 C ATOM 1707 CD1 LEU A 109 -3.871 -2.055 12.931 1.00 0.00 C ATOM 1708 CD2 LEU A 109 -3.542 0.021 14.368 1.00 0.00 C ATOM 0 H LEU A 109 -4.933 0.491 10.734 1.00 0.00 H new ATOM 0 HA LEU A 109 -2.048 0.780 10.040 1.00 0.00 H new ATOM 0 HB2 LEU A 109 -1.733 -0.800 12.037 1.00 0.00 H new ATOM 0 HB3 LEU A 109 -2.109 0.871 12.407 1.00 0.00 H new ATOM 0 HG LEU A 109 -4.615 -0.099 12.509 1.00 0.00 H new ATOM 0 HD11 LEU A 109 -4.695 -2.329 13.589 1.00 0.00 H new ATOM 0 HD12 LEU A 109 -4.085 -2.399 11.919 1.00 0.00 H new ATOM 0 HD13 LEU A 109 -2.952 -2.522 13.287 1.00 0.00 H new ATOM 0 HD21 LEU A 109 -4.373 -0.326 14.982 1.00 0.00 H new ATOM 0 HD22 LEU A 109 -2.604 -0.339 14.791 1.00 0.00 H new ATOM 0 HD23 LEU A 109 -3.536 1.111 14.347 1.00 0.00 H new ATOM 1720 N LEU A 110 -4.086 -1.332 8.989 1.00 0.00 N ATOM 1721 CA LEU A 110 -4.305 -2.483 8.088 1.00 0.00 C ATOM 1722 C LEU A 110 -5.646 -2.299 7.345 1.00 0.00 C ATOM 1723 O LEU A 110 -6.697 -2.148 7.975 1.00 0.00 O ATOM 1724 CB LEU A 110 -4.302 -3.827 8.877 1.00 0.00 C ATOM 1725 CG LEU A 110 -4.485 -5.124 8.028 1.00 0.00 C ATOM 1726 CD1 LEU A 110 -3.357 -5.282 6.988 1.00 0.00 C ATOM 1727 CD2 LEU A 110 -4.604 -6.376 8.933 1.00 0.00 C ATOM 0 H LEU A 110 -4.902 -0.726 9.073 1.00 0.00 H new ATOM 0 HA LEU A 110 -3.489 -2.523 7.367 1.00 0.00 H new ATOM 0 HB2 LEU A 110 -3.360 -3.903 9.421 1.00 0.00 H new ATOM 0 HB3 LEU A 110 -5.098 -3.789 9.621 1.00 0.00 H new ATOM 0 HG LEU A 110 -5.421 -5.028 7.478 1.00 0.00 H new ATOM 0 HD11 LEU A 110 -3.516 -6.195 6.415 1.00 0.00 H new ATOM 0 HD12 LEU A 110 -3.361 -4.425 6.314 1.00 0.00 H new ATOM 0 HD13 LEU A 110 -2.396 -5.337 7.499 1.00 0.00 H new ATOM 0 HD21 LEU A 110 -4.731 -7.263 8.312 1.00 0.00 H new ATOM 0 HD22 LEU A 110 -3.700 -6.479 9.533 1.00 0.00 H new ATOM 0 HD23 LEU A 110 -5.466 -6.268 9.592 1.00 0.00 H new ATOM 1739 N THR A 111 -5.593 -2.328 6.004 1.00 0.00 N ATOM 1740 CA THR A 111 -6.757 -2.053 5.141 1.00 0.00 C ATOM 1741 C THR A 111 -7.564 -3.343 4.872 1.00 0.00 C ATOM 1742 O THR A 111 -6.984 -4.383 4.536 1.00 0.00 O ATOM 1743 CB THR A 111 -6.304 -1.434 3.782 1.00 0.00 C ATOM 1744 OG1 THR A 111 -5.380 -0.366 4.015 1.00 0.00 O ATOM 1745 CG2 THR A 111 -7.505 -0.902 2.983 1.00 0.00 C ATOM 0 H THR A 111 -4.742 -2.543 5.485 1.00 0.00 H new ATOM 0 HA THR A 111 -7.393 -1.340 5.666 1.00 0.00 H new ATOM 0 HB THR A 111 -5.822 -2.220 3.201 1.00 0.00 H new ATOM 0 HG1 THR A 111 -5.099 0.016 3.158 1.00 0.00 H new ATOM 0 HG21 THR A 111 -7.156 -0.477 2.042 1.00 0.00 H new ATOM 0 HG22 THR A 111 -8.197 -1.719 2.778 1.00 0.00 H new ATOM 0 HG23 THR A 111 -8.015 -0.132 3.562 1.00 0.00 H new ATOM 1753 N LEU A 112 -8.911 -3.249 4.992 1.00 0.00 N ATOM 1754 CA LEU A 112 -9.834 -4.409 4.907 1.00 0.00 C ATOM 1755 C LEU A 112 -11.018 -4.115 3.976 1.00 0.00 C ATOM 1756 O LEU A 112 -11.444 -2.972 3.869 1.00 0.00 O ATOM 1757 CB LEU A 112 -10.375 -4.742 6.317 1.00 0.00 C ATOM 1758 CG LEU A 112 -9.289 -5.048 7.387 1.00 0.00 C ATOM 1759 CD1 LEU A 112 -9.873 -4.993 8.792 1.00 0.00 C ATOM 1760 CD2 LEU A 112 -8.590 -6.396 7.109 1.00 0.00 C ATOM 0 H LEU A 112 -9.390 -2.363 5.151 1.00 0.00 H new ATOM 0 HA LEU A 112 -9.277 -5.254 4.503 1.00 0.00 H new ATOM 0 HB2 LEU A 112 -10.979 -3.904 6.665 1.00 0.00 H new ATOM 0 HB3 LEU A 112 -11.039 -5.603 6.240 1.00 0.00 H new ATOM 0 HG LEU A 112 -8.526 -4.272 7.321 1.00 0.00 H new ATOM 0 HD11 LEU A 112 -9.091 -5.211 9.520 1.00 0.00 H new ATOM 0 HD12 LEU A 112 -10.276 -3.998 8.980 1.00 0.00 H new ATOM 0 HD13 LEU A 112 -10.670 -5.731 8.884 1.00 0.00 H new ATOM 0 HD21 LEU A 112 -7.837 -6.580 7.875 1.00 0.00 H new ATOM 0 HD22 LEU A 112 -9.328 -7.198 7.125 1.00 0.00 H new ATOM 0 HD23 LEU A 112 -8.112 -6.363 6.130 1.00 0.00 H new ATOM 1772 N VAL A 113 -11.536 -5.164 3.317 1.00 0.00 N ATOM 1773 CA VAL A 113 -12.774 -5.109 2.512 1.00 0.00 C ATOM 1774 C VAL A 113 -14.007 -5.375 3.406 1.00 0.00 C ATOM 1775 O VAL A 113 -15.129 -5.006 3.052 1.00 0.00 O ATOM 1776 CB VAL A 113 -12.747 -6.147 1.316 1.00 0.00 C ATOM 1777 CG1 VAL A 113 -11.640 -5.809 0.292 1.00 0.00 C ATOM 1778 CG2 VAL A 113 -12.588 -7.604 1.819 1.00 0.00 C ATOM 0 H VAL A 113 -11.103 -6.088 3.326 1.00 0.00 H new ATOM 0 HA VAL A 113 -12.840 -4.108 2.086 1.00 0.00 H new ATOM 0 HB VAL A 113 -13.711 -6.067 0.814 1.00 0.00 H new ATOM 0 HG11 VAL A 113 -11.653 -6.543 -0.513 1.00 0.00 H new ATOM 0 HG12 VAL A 113 -11.816 -4.815 -0.120 1.00 0.00 H new ATOM 0 HG13 VAL A 113 -10.669 -5.830 0.786 1.00 0.00 H new ATOM 0 HG21 VAL A 113 -12.574 -8.284 0.967 1.00 0.00 H new ATOM 0 HG22 VAL A 113 -11.654 -7.698 2.373 1.00 0.00 H new ATOM 0 HG23 VAL A 113 -13.424 -7.857 2.471 1.00 0.00 H new ATOM 1788 N ASP A 114 -13.779 -6.018 4.572 1.00 0.00 N ATOM 1789 CA ASP A 114 -14.856 -6.402 5.507 1.00 0.00 C ATOM 1790 C ASP A 114 -15.157 -5.234 6.474 1.00 0.00 C ATOM 1791 O ASP A 114 -16.228 -4.615 6.387 1.00 0.00 O ATOM 1792 CB ASP A 114 -14.452 -7.692 6.271 1.00 0.00 C ATOM 1793 CG ASP A 114 -15.536 -8.190 7.249 1.00 0.00 C ATOM 1794 OD1 ASP A 114 -15.555 -7.740 8.419 1.00 0.00 O ATOM 1795 OD2 ASP A 114 -16.371 -9.027 6.857 1.00 0.00 O ATOM 0 H ASP A 114 -12.847 -6.284 4.889 1.00 0.00 H new ATOM 0 HA ASP A 114 -15.769 -6.614 4.950 1.00 0.00 H new ATOM 0 HB2 ASP A 114 -14.235 -8.480 5.550 1.00 0.00 H new ATOM 0 HB3 ASP A 114 -13.532 -7.504 6.825 1.00 0.00 H new ATOM 1800 N GLN A 115 -14.207 -4.941 7.392 1.00 0.00 N ATOM 1801 CA GLN A 115 -14.327 -3.799 8.331 1.00 0.00 C ATOM 1802 C GLN A 115 -14.191 -2.459 7.571 1.00 0.00 C ATOM 1803 O GLN A 115 -13.395 -2.383 6.624 1.00 0.00 O ATOM 1804 CB GLN A 115 -13.256 -3.886 9.462 1.00 0.00 C ATOM 1805 CG GLN A 115 -13.428 -5.066 10.437 1.00 0.00 C ATOM 1806 CD GLN A 115 -14.734 -5.012 11.241 1.00 0.00 C ATOM 1807 OE1 GLN A 115 -14.794 -4.426 12.323 1.00 0.00 O ATOM 1808 NE2 GLN A 115 -15.786 -5.633 10.722 1.00 0.00 N ATOM 0 H GLN A 115 -13.348 -5.480 7.503 1.00 0.00 H new ATOM 0 HA GLN A 115 -15.314 -3.846 8.792 1.00 0.00 H new ATOM 0 HB2 GLN A 115 -12.270 -3.956 9.002 1.00 0.00 H new ATOM 0 HB3 GLN A 115 -13.277 -2.958 10.033 1.00 0.00 H new ATOM 0 HG2 GLN A 115 -13.395 -5.999 9.875 1.00 0.00 H new ATOM 0 HG3 GLN A 115 -12.586 -5.081 11.128 1.00 0.00 H new ATOM 0 HE21 GLN A 115 -15.705 -6.110 9.824 1.00 0.00 H new ATOM 0 HE22 GLN A 115 -16.675 -5.634 11.221 1.00 0.00 H new ATOM 1817 N PRO A 116 -14.952 -1.384 7.978 1.00 0.00 N ATOM 1818 CA PRO A 116 -14.918 -0.059 7.298 1.00 0.00 C ATOM 1819 C PRO A 116 -13.583 0.695 7.510 1.00 0.00 C ATOM 1820 O PRO A 116 -12.754 0.311 8.349 1.00 0.00 O ATOM 1821 CB PRO A 116 -16.109 0.697 7.944 1.00 0.00 C ATOM 1822 CG PRO A 116 -16.223 0.101 9.309 1.00 0.00 C ATOM 1823 CD PRO A 116 -15.902 -1.369 9.135 1.00 0.00 C ATOM 0 HA PRO A 116 -14.995 -0.150 6.215 1.00 0.00 H new ATOM 0 HB2 PRO A 116 -15.921 1.770 7.992 1.00 0.00 H new ATOM 0 HB3 PRO A 116 -17.026 0.559 7.371 1.00 0.00 H new ATOM 0 HG2 PRO A 116 -15.529 0.575 10.004 1.00 0.00 H new ATOM 0 HG3 PRO A 116 -17.225 0.239 9.715 1.00 0.00 H new ATOM 0 HD2 PRO A 116 -15.448 -1.790 10.032 1.00 0.00 H new ATOM 0 HD3 PRO A 116 -16.798 -1.954 8.926 1.00 0.00 H new ATOM 1831 N GLN A 117 -13.399 1.767 6.717 1.00 0.00 N ATOM 1832 CA GLN A 117 -12.192 2.607 6.763 1.00 0.00 C ATOM 1833 C GLN A 117 -12.181 3.428 8.065 1.00 0.00 C ATOM 1834 O GLN A 117 -13.074 4.261 8.279 1.00 0.00 O ATOM 1835 CB GLN A 117 -12.120 3.553 5.526 1.00 0.00 C ATOM 1836 CG GLN A 117 -12.229 2.870 4.137 1.00 0.00 C ATOM 1837 CD GLN A 117 -11.064 1.929 3.751 1.00 0.00 C ATOM 1838 OE1 GLN A 117 -10.446 1.260 4.578 1.00 0.00 O ATOM 1839 NE2 GLN A 117 -10.742 1.888 2.470 1.00 0.00 N ATOM 0 H GLN A 117 -14.084 2.074 6.027 1.00 0.00 H new ATOM 0 HA GLN A 117 -11.317 1.958 6.739 1.00 0.00 H new ATOM 0 HB2 GLN A 117 -12.920 4.289 5.610 1.00 0.00 H new ATOM 0 HB3 GLN A 117 -11.178 4.100 5.567 1.00 0.00 H new ATOM 0 HG2 GLN A 117 -13.157 2.298 4.107 1.00 0.00 H new ATOM 0 HG3 GLN A 117 -12.309 3.647 3.377 1.00 0.00 H new ATOM 0 HE21 GLN A 117 -11.263 2.448 1.795 1.00 0.00 H new ATOM 0 HE22 GLN A 117 -9.973 1.296 2.156 1.00 0.00 H new ATOM 1848 N ALA A 118 -11.193 3.168 8.934 1.00 0.00 N ATOM 1849 CA ALA A 118 -11.046 3.859 10.223 1.00 0.00 C ATOM 1850 C ALA A 118 -9.571 3.767 10.696 1.00 0.00 C ATOM 1851 O ALA A 118 -8.729 4.487 10.118 1.00 0.00 O ATOM 1852 CB ALA A 118 -12.050 3.275 11.246 1.00 0.00 C ATOM 1853 OXT ALA A 118 -9.249 2.967 11.609 1.00 0.00 O ATOM 0 H ALA A 118 -10.470 2.469 8.761 1.00 0.00 H new ATOM 0 HA ALA A 118 -11.282 4.918 10.119 1.00 0.00 H new ATOM 0 HB1 ALA A 118 -11.938 3.790 12.200 1.00 0.00 H new ATOM 0 HB2 ALA A 118 -13.066 3.412 10.877 1.00 0.00 H new ATOM 0 HB3 ALA A 118 -11.854 2.212 11.382 1.00 0.00 H new TER 1859 ALA A 118